*HEADER    DE NOVO PROTEIN                         02-AUG-13   2MBL              
*TITLE     SOLUTION NMR STRUCTURE OF DE NOVO DESIGNED TOP7 FOLD PROTEIN TOP7M13, 
*TITLE    2 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET OR33          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TOP7 FOLD PROTEIN TOP7M13;                                 
*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, A.L.ZANGHELLINI, K.CHAN, R.XIAO, H.JANJUA, S.KOGAN,            
*AUTHOR   2 M.MAGLAQUI, C.CICCOSANTI, T.B.ACTON, G.KORNHABER, J.K.EVERETT,       
*AUTHOR   3 D.BAKER, G.T.MONTELIONE, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM    
*AUTHOR   4 (NESG)                                                               
*REVDAT   1   13-NOV-13 2MBL    0                                                


 assign ((resid   4 and name HA   ))   ( (resid   5 and name HN   ))     2.57  0.77  0.39
 assign ((resid   4 and name HB2  ))   ( (resid   5 and name HN   ))     4.17  2.37  0.63
 assign ((resid   4 and name HD*  ))   ( (resid   5 and name HN   ))     5.00  3.20  0.75
 assign ((resid   5 and name HN   ))   ( (resid   6 and name HN   ))     4.73  2.93  0.71
 assign ((resid   5 and name HA   ))   ( (resid   6 and name HN   ))     3.11  1.31  0.47
 assign ((resid   5 and name HG*  ))   ( (resid   6 and name HN   ))     3.97  2.17  0.60
 assign ((resid   5 and name HD*  ))   ( (resid   6 and name HN   ))     5.00  3.20  0.75
 assign ((resid   6 and name HN   ))   ( (resid   7 and name HN   ))     4.76  2.96  0.71
 assign ((resid   6 and name HA   ))   ( (resid   7 and name HN   ))     2.95  1.15  0.44
 assign ((resid   6 and name HB   ))   ( (resid   7 and name HN   ))     4.01  2.21  0.60
 assign ((resid   6 and name HG2* ))   ( (resid   7 and name HN   ))     3.88  2.08  0.58
 assign ((resid   7 and name HN   ))   ( (resid   8 and name HN   ))     4.52  2.72  0.68
 assign ((resid   7 and name HA   ))   ( (resid   8 and name HN   ))     2.95  1.15  0.44
 assign ((resid   7 and name HG1  ))   ( (resid   8 and name HN   ))     4.69  2.89  0.70
 assign ((resid   8 and name HN   ))   ( (resid   9 and name HN   ))     4.59  2.79  0.69
 assign ((resid   8 and name HB   ))   ( (resid   9 and name HN   ))     4.53  2.73  0.68
 assign ((resid   8 and name HG2* ))   ( (resid   9 and name HN   ))     3.95  2.15  0.59
 assign ((resid   8 and name HG1* ))   ( (resid   9 and name HN   ))     3.32  1.52  0.50
 assign ((resid   9 and name HA   ))   ( (resid  10 and name HN   ))     3.28  1.48  0.49
 assign ((resid   9 and name HG1  ))   ( (resid  10 and name HN   ))     4.77  2.97  0.72
 assign ((resid  10 and name HN   ))   ( (resid  11 and name HN   ))     4.54  2.74  0.68
 assign ((resid  10 and name HA   ))   ( (resid  11 and name HN   ))     3.16  1.36  0.47
 assign ((resid  10 and name HG1* ))   ( (resid  11 and name HN   ))     4.35  2.55  0.65
 assign ((resid  10 and name HG2* ))   ( (resid  11 and name HN   ))     4.35  2.55  0.65
 assign ((resid  11 and name HA   ))   ( (resid  12 and name HN   ))     3.10  1.30  0.47
 assign ((resid  12 and name HN   ))   ( (resid  12 and name HG12 ))     5.28  3.48  0.79
 assign ((resid  12 and name HN   ))   ( (resid  13 and name HN   ))     5.05  3.25  0.76
 assign ((resid  12 and name HA   ))   ( (resid  13 and name HN   ))     3.16  1.36  0.47
 assign ((resid  12 and name HB   ))   ( (resid  13 and name HN   ))     4.61  2.81  0.69
 assign ((resid  12 and name HG2* ))   ( (resid  13 and name HN   ))     3.79  1.99  0.57
 assign ((resid  12 and name HG12 ))   ( (resid  13 and name HN   ))     4.23  2.43  0.63
 assign ((resid  12 and name HD1* ))   ( (resid  13 and name HN   ))     4.17  2.37  0.63
 assign ((resid  13 and name HN   ))   ( (resid  14 and name HN   ))     4.45  2.65  0.67
 assign ((resid  13 and name HA   ))   ( (resid  14 and name HN   ))     2.95  1.15  0.44
 assign ((resid  13 and name HB   ))   ( (resid  14 and name HN   ))     4.39  2.59  0.66
 assign ((resid  13 and name HG2* ))   ( (resid  14 and name HN   ))     3.39  1.59  0.51
 assign ((resid  17 and name HA   ))   ( (resid  18 and name HN   ))     3.00  1.20  0.45
 assign ((resid  17 and name HB2  ))   ( (resid  18 and name HN   ))     4.31  2.51  0.65
 assign ((resid  17 and name HB1  ))   ( (resid  18 and name HN   ))     4.31  2.51  0.65
 assign ((resid  17 and name HG2  ))   ( (resid  18 and name HN   ))     5.19  3.39  0.78
 assign ((resid  17 and name HG1  ))   ( (resid  18 and name HN   ))     5.19  3.39  0.78
 assign ((resid  17 and name HD*  ))   ( (resid  18 and name HN   ))     4.98  3.18  0.75
 assign ((resid  18 and name HA   ))   ( (resid  19 and name HN   ))     3.28  1.48  0.49
 assign ((resid  18 and name HB   ))   ( (resid  19 and name HN   ))     4.34  2.54  0.65
 assign ((resid  18 and name HG2* ))   ( (resid  19 and name HN   ))     3.33  1.53  0.50
 assign ((resid  20 and name HA   ))   ( (resid  21 and name HN   ))     3.10  1.30  0.47
 assign ((resid  20 and name HB2  ))   ( (resid  21 and name HN   ))     4.13  2.33  0.62
 assign ((resid  20 and name HB1  ))   ( (resid  21 and name HN   ))     4.13  2.33  0.62
 assign ((resid  20 and name HG2  ))   ( (resid  21 and name HN   ))     4.91  3.11  0.74
 assign ((resid  21 and name HA   ))   ( (resid  22 and name HN   ))     3.22  1.42  0.48
 assign ((resid  21 and name HB2  ))   ( (resid  22 and name HN   ))     4.33  2.53  0.65
 assign ((resid  21 and name HB1  ))   ( (resid  22 and name HN   ))     4.33  2.53  0.65
 assign ((resid  21 and name HG2  ))   ( (resid  22 and name HN   ))     4.21  2.41  0.63
 assign ((resid  21 and name HG1  ))   ( (resid  22 and name HN   ))     4.21  2.41  0.63
 assign ((resid  22 and name HA   ))   ( (resid  23 and name HN   ))     3.10  1.30  0.47
 assign ((resid  22 and name HB   ))   ( (resid  23 and name HN   ))     4.45  2.65  0.67
 assign ((resid  22 and name HG2* ))   ( (resid  23 and name HN   ))     3.35  1.55  0.50
 assign ((resid  23 and name HA   ))   ( (resid  24 and name HN   ))     3.26  1.46  0.49
 assign ((resid  23 and name HB2  ))   ( (resid  24 and name HN   ))     4.31  2.51  0.65
 assign ((resid  23 and name HB1  ))   ( (resid  24 and name HN   ))     4.31  2.51  0.65
 assign ((resid  23 and name HD*  ))   ( (resid  24 and name HN   ))     4.66  2.86  0.70
 assign ((resid  24 and name HA   ))   ( (resid  25 and name HN   ))     2.92  1.12  0.44
 assign ((resid  26 and name HA   ))   ( (resid  27 and name HN   ))     2.91  1.11  0.44
 assign ((resid  26 and name HB2  ))   ( (resid  27 and name HN   ))     4.63  2.83  0.69
 assign ((resid  26 and name HB1  ))   ( (resid  27 and name HN   ))     4.63  2.83  0.69
 assign ((resid  27 and name HB*  ))   ( (resid  28 and name HN   ))     4.09  2.29  0.61
 assign ((resid  28 and name HN   ))   ( (resid  29 and name HN   ))     4.30  2.50  0.65
 assign ((resid  28 and name HB   ))   ( (resid  29 and name HN   ))     3.41  1.61  0.51
 assign ((resid  28 and name HG1* ))   ( (resid  29 and name HN   ))     3.72  1.92  0.56
 assign ((resid  31 and name HB*  ))   ( (resid  32 and name HN   ))     3.63  1.83  0.54
 assign ((resid  31 and name HG1  ))   ( (resid  32 and name HN   ))     4.69  2.89  0.70
 assign ((resid  33 and name HN   ))   ( (resid  34 and name HN   ))     3.31  1.51  0.50
 assign ((resid  33 and name HB2  ))   ( (resid  34 and name HN   ))     3.70  1.90  0.56
 assign ((resid  33 and name HB1  ))   ( (resid  34 and name HN   ))     3.70  1.90  0.56
 assign ((resid  33 and name HD2* ))   ( (resid  34 and name HN   ))     4.95  3.15  0.74
 assign ((resid  33 and name HD1* ))   ( (resid  34 and name HN   ))     4.07  2.27  0.61
 assign ((resid  34 and name HB2  ))   ( (resid  35 and name HN   ))     3.60  1.80  0.54
 assign ((resid  34 and name HB1  ))   ( (resid  35 and name HN   ))     3.60  1.80  0.54
 assign ((resid  35 and name HN   ))   ( (resid  36 and name HN   ))     3.35  1.55  0.50
 assign ((resid  35 and name HB*  ))   ( (resid  36 and name HN   ))     3.35  1.55  0.50
 assign ((resid  35 and name HG1  ))   ( (resid  36 and name HN   ))     4.42  2.62  0.66
 assign ((resid  36 and name HG1  ))   ( (resid  37 and name HN   ))     4.58  2.78  0.69
 assign ((resid  37 and name HN   ))   ( (resid  38 and name HN   ))     3.10  1.30  0.47
 assign ((resid  37 and name HB2  ))   ( (resid  38 and name HN   ))     3.84  2.04  0.58
 assign ((resid  37 and name HB1  ))   ( (resid  38 and name HN   ))     3.84  2.04  0.58
 assign ((resid  37 and name HD1* ))   ( (resid  38 and name HN   ))     4.48  2.68  0.67
 assign ((resid  38 and name HN   ))   ( (resid  41 and name HD1* ))     4.38  2.58  0.66
 assign ((resid  38 and name HB2  ))   ( (resid  39 and name HN   ))     3.68  1.88  0.55
 assign ((resid  39 and name HN   ))   ( (resid  39 and name HD*  ))     3.84  2.04  0.58
 assign ((resid  39 and name HN   ))   ( (resid  40 and name HN   ))     3.37  1.57  0.51
 assign ((resid  39 and name HB*  ))   ( (resid  40 and name HN   ))     3.44  1.64  0.52
 assign ((resid  39 and name HD*  ))   ( (resid  40 and name HN   ))     5.26  3.46  0.79
 assign ((resid  40 and name HN   ))   ( (resid  41 and name HN   ))     3.44  1.64  0.52
 assign ((resid  40 and name HB   ))   ( (resid  41 and name HN   ))     3.46  1.66  0.52
 assign ((resid  40 and name HG1* ))   ( (resid  41 and name HN   ))     3.90  2.10  0.59
 assign ((resid  41 and name HN   ))   ( (resid  42 and name HN   ))     3.55  1.75  0.53
 assign ((resid  41 and name HB2  ))   ( (resid  42 and name HN   ))     4.01  2.21  0.60
 assign ((resid  41 and name HG   ))   ( (resid  42 and name HN   ))     4.82  3.02  0.72
 assign ((resid  42 and name HB1  ))   ( (resid  43 and name HN   ))     4.19  2.39  0.63
 assign ((resid  43 and name HN   ))   ( (resid  44 and name HN   ))     3.78  1.98  0.57
 assign ((resid  43 and name HB2  ))   ( (resid  44 and name HN   ))     3.90  2.10  0.59
 assign ((resid  44 and name HB2  ))   ( (resid  45 and name HN   ))     4.34  2.54  0.65
 assign ((resid  44 and name HB1  ))   ( (resid  45 and name HN   ))     4.34  2.54  0.65
 assign ((resid  31 and name HB*  ))   ( (resid  33 and name HN   ))     5.28  3.48  0.79
 assign ((resid  45 and name HE*  ))   ( (resid  46 and name HN   ))     5.87  4.07  0.88
 assign ((resid  45 and name HE*  ))   ( (resid  48 and name HN   ))     5.01  3.21  0.75
 assign ((resid  48 and name HN   ))   ( (resid  49 and name HN   ))     3.48  1.68  0.52
 assign ((resid  70 and name HN   ))   ( (resid  70 and name HG2  ))     4.27  2.47  0.64
 assign ((resid  48 and name HG2* ))   ( (resid  49 and name HN   ))     3.86  2.06  0.58
 assign ((resid  49 and name HB*  ))   ( (resid  50 and name HN   ))     4.66  2.86  0.70
 assign ((resid  49 and name HG1  ))   ( (resid  50 and name HN   ))     5.08  3.28  0.76
 assign ((resid  50 and name HG2  ))   ( (resid  51 and name HN   ))     5.65  3.85  0.85
 assign ((resid  50 and name HD*  ))   ( (resid  51 and name HN   ))     5.00  3.20  0.75
 assign ((resid  51 and name HN   ))   ( (resid  52 and name HN   ))     3.95  2.15  0.59
 assign ((resid  51 and name HG   ))   ( (resid  52 and name HN   ))     5.03  3.23  0.75
 assign ((resid  48 and name HG2* ))   ( (resid  52 and name HN   ))     5.84  4.04  0.88
 assign ((resid  51 and name HD1* ))   ( (resid  52 and name HN   ))     6.00  4.20  0.90
 assign ((resid  52 and name HN   ))   ( (resid  53 and name HN   ))     4.31  2.51  0.65
 assign ((resid  54 and name HB1  ))   ( (resid  55 and name HN   ))     4.69  2.89  0.70
 assign ((resid  54 and name HG2  ))   ( (resid  55 and name HN   ))     5.00  3.20  0.75
 assign ((resid  54 and name HG1  ))   ( (resid  55 and name HN   ))     5.00  3.20  0.75
 assign ((resid  55 and name HN   ))   ( (resid  55 and name HG2  ))     5.41  3.61  0.81
 assign ((resid  55 and name HA   ))   ( (resid  56 and name HN   ))     2.81  1.01  0.42
 assign ((resid  55 and name HB2  ))   ( (resid  56 and name HN   ))     4.30  2.50  0.65
 assign ((resid  55 and name HB1  ))   ( (resid  56 and name HN   ))     4.30  2.50  0.65
 assign ((resid  55 and name HG2  ))   ( (resid  56 and name HN   ))     4.17  2.37  0.63
 assign ((resid  55 and name HG1  ))   ( (resid  56 and name HN   ))     4.17  2.37  0.63
 assign ((resid  57 and name HA   ))   ( (resid  58 and name HN   ))     3.14  1.34  0.47
 assign ((resid  57 and name HB*  ))   ( (resid  58 and name HN   ))     4.22  2.42  0.63
 assign ((resid  58 and name HN   ))   ( (resid  59 and name HN   ))     4.62  2.82  0.69
 assign ((resid  58 and name HA   ))   ( (resid  59 and name HN   ))     3.15  1.35  0.47
 assign ((resid  58 and name HB   ))   ( (resid  59 and name HN   ))     4.57  2.77  0.69
 assign ((resid  58 and name HG2* ))   ( (resid  59 and name HN   ))     3.38  1.58  0.51
 assign ((resid  59 and name HN   ))   ( (resid  60 and name HN   ))     4.99  3.19  0.75
 assign ((resid  59 and name HA   ))   ( (resid  60 and name HN   ))     3.35  1.55  0.50
 assign ((resid  59 and name HB1  ))   ( (resid  60 and name HN   ))     4.50  2.70  0.68
 assign ((resid  60 and name HA   ))   ( (resid  61 and name HN   ))     3.01  1.21  0.45
 assign ((resid  60 and name HB   ))   ( (resid  61 and name HN   ))     4.30  2.50  0.65
 assign ((resid  60 and name HG2* ))   ( (resid  61 and name HN   ))     3.54  1.74  0.53
 assign ((resid  60 and name HG12 ))   ( (resid  61 and name HN   ))     4.85  3.05  0.73
 assign ((resid  61 and name HN   ))   ( (resid  61 and name HG*  ))     5.12  3.32  0.77
 assign ((resid  60 and name HG11 ))   ( (resid  61 and name HN   ))     4.85  3.05  0.73
 assign ((resid   8 and name HG2* ))   ( (resid  61 and name HN   ))     5.23  3.43  0.78
 assign ((resid  61 and name HA   ))   ( (resid  62 and name HN   ))     3.17  1.37  0.48
 assign ((resid  62 and name HN   ))   ( (resid  62 and name HB   ))     3.37  1.57  0.51
 assign ((resid  61 and name HG*  ))   ( (resid  62 and name HN   ))     4.22  2.42  0.63
 assign ((resid  62 and name HG2* ))   ( (resid  63 and name HN   ))     3.98  2.18  0.60
 assign ((resid   4 and name HG*  ))   ( (resid   5 and name HN   ))     5.00  3.20  0.75
 assign ((resid  48 and name HB   ))   ( (resid  49 and name HN   ))     3.85  2.05  0.58
 assign ((resid  72 and name HB*  ))   ( (resid  73 and name HN   ))     3.91  2.11  0.59
 assign ((resid  73 and name HN   ))   ( (resid  73 and name HB2  ))     4.15  2.35  0.62
 assign ((resid  72 and name HG*  ))   ( (resid  73 and name HN   ))     4.70  2.90  0.70
 assign ((resid  73 and name HN   ))   ( (resid  74 and name HN   ))     3.78  1.98  0.57
 assign ((resid  74 and name HN   ))   ( (resid  75 and name HN   ))     4.49  2.69  0.67
 assign ((resid  74 and name HB*  ))   ( (resid  76 and name HN   ))     5.09  3.29  0.76
 assign ((resid  76 and name HN   ))   ( (resid  77 and name HN   ))     4.23  2.43  0.63
 assign ((resid  76 and name HB2  ))   ( (resid  77 and name HN   ))     3.79  1.99  0.57
 assign ((resid  76 and name HB1  ))   ( (resid  77 and name HN   ))     3.79  1.99  0.57
 assign ((resid  67 and name HB*  ))   ( (resid  69 and name HN   ))     5.40  3.60  0.81
 assign ((resid  76 and name HD*  ))   ( (resid  77 and name HN   ))     4.91  3.11  0.74
 assign ((resid  77 and name HN   ))   ( (resid  78 and name HN   ))     3.63  1.83  0.54
 assign ((resid  77 and name HB2  ))   ( (resid  78 and name HN   ))     4.06  2.26  0.61
 assign ((resid  77 and name HB1  ))   ( (resid  78 and name HN   ))     4.06  2.26  0.61
 assign ((resid  78 and name HB*  ))   ( (resid  79 and name HN   ))     3.75  1.95  0.56
 assign ((resid  79 and name HB*  ))   ( (resid  80 and name HN   ))     3.37  1.57  0.51
 assign ((resid  80 and name HB   ))   ( (resid  81 and name HN   ))     3.52  1.72  0.53
 assign ((resid  37 and name HD1* ))   ( (resid  81 and name HN   ))     4.37  2.57  0.66
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HD2* ))     4.15  2.35  0.62
 assign ((resid  81 and name HN   ))   ( (resid  82 and name HN   ))     3.67  1.87  0.55
 assign ((resid  81 and name HB2  ))   ( (resid  82 and name HN   ))     4.37  2.57  0.66
 assign ((resid  81 and name HB1  ))   ( (resid  82 and name HN   ))     4.37  2.57  0.66
 assign ((resid  81 and name HG   ))   ( (resid  82 and name HN   ))     4.99  3.19  0.75
 assign ((resid  81 and name HD1* ))   ( (resid  82 and name HN   ))     5.38  3.58  0.81
 assign ((resid  81 and name HD2* ))   ( (resid  82 and name HN   ))     5.02  3.22  0.75
 assign ((resid  82 and name HN   ))   ( (resid  83 and name HN   ))     3.69  1.89  0.55
 assign ((resid  82 and name HB2  ))   ( (resid  83 and name HN   ))     3.91  2.11  0.59
 assign ((resid  82 and name HB1  ))   ( (resid  83 and name HN   ))     3.91  2.11  0.59
 assign ((resid  83 and name HB*  ))   ( (resid  84 and name HN   ))     3.42  1.62  0.51
 assign ((resid  84 and name HN   ))   ( (resid  86 and name HB*  ))     4.71  2.91  0.71
 assign ((resid  84 and name HN   ))   ( (resid  85 and name HN   ))     3.32  1.52  0.50
 assign ((resid  84 and name HB   ))   ( (resid  85 and name HN   ))     3.76  1.96  0.56
 assign ((resid  85 and name HN   ))   ( (resid  86 and name HN   ))     3.49  1.69  0.52
 assign ((resid  85 and name HB*  ))   ( (resid  86 and name HN   ))     3.68  1.88  0.55
 assign ((resid  86 and name HB*  ))   ( (resid  87 and name HN   ))     3.34  1.54  0.50
 assign ((resid  87 and name HN   ))   ( (resid  88 and name HN   ))     3.57  1.77  0.54
 assign ((resid  87 and name HB2  ))   ( (resid  88 and name HN   ))     4.23  2.43  0.63
 assign ((resid  87 and name HB1  ))   ( (resid  88 and name HN   ))     4.23  2.43  0.63
 assign ((resid  88 and name HN   ))   ( (resid  89 and name HN   ))     3.40  1.60  0.51
 assign ((resid  88 and name HB2  ))   ( (resid  89 and name HN   ))     4.76  2.96  0.71
 assign ((resid  88 and name HB1  ))   ( (resid  89 and name HN   ))     4.76  2.96  0.71
 assign ((resid  88 and name HD1* ))   ( (resid  89 and name HN   ))     5.01  3.21  0.75
 assign ((resid  88 and name HD2* ))   ( (resid  89 and name HN   ))     4.96  3.16  0.74
 assign ((resid  90 and name HN   ))   ( (resid  91 and name HN   ))     4.88  3.08  0.73
 assign ((resid  90 and name HB2  ))   ( (resid  91 and name HN   ))     4.72  2.92  0.71
 assign ((resid  90 and name HB1  ))   ( (resid  91 and name HN   ))     4.72  2.92  0.71
 assign ((resid  90 and name HD*  ))   ( (resid  91 and name HN   ))     4.68  2.88  0.70
 assign ((resid  91 and name HA   ))   ( (resid  92 and name HN   ))     3.07  1.27  0.46
 assign ((resid  91 and name HB*  ))   ( (resid  92 and name HN   ))     3.87  2.07  0.58
 assign ((resid  92 and name HB*  ))   ( (resid  93 and name HN   ))     4.38  2.58  0.66
 assign ((resid  93 and name HN   ))   ( (resid  94 and name HN   ))     4.35  2.55  0.65
 assign ((resid  92 and name HA   ))   ( (resid  94 and name HN   ))     4.30  2.50  0.65
 assign ((resid  93 and name HB*  ))   ( (resid  94 and name HN   ))     4.49  2.69  0.67
 assign ((resid  95 and name HA   ))   ( (resid  96 and name HN   ))     3.14  1.34  0.47
 assign ((resid  95 and name HB   ))   ( (resid  96 and name HN   ))     4.92  3.12  0.74
 assign ((resid  95 and name HG2* ))   ( (resid  96 and name HN   ))     4.43  2.63  0.66
 assign ((resid  95 and name HG1* ))   ( (resid  96 and name HN   ))     3.54  1.74  0.53
 assign ((resid  96 and name HA   ))   ( (resid  97 and name HN   ))     3.53  1.73  0.53
 assign ((resid  96 and name HB   ))   ( (resid  97 and name HN   ))     4.54  2.74  0.68
 assign ((resid  96 and name HG2* ))   ( (resid  97 and name HN   ))     3.90  2.10  0.59
 assign ((resid  97 and name HA   ))   ( (resid  98 and name HN   ))     3.18  1.38  0.48
 assign ((resid  97 and name HB2  ))   ( (resid  98 and name HN   ))     4.61  2.81  0.69
 assign ((resid  97 and name HB1  ))   ( (resid  98 and name HN   ))     4.61  2.81  0.69
 assign ((resid  97 and name HE3  ))   ( (resid  98 and name HN   ))     4.75  2.95  0.71
 assign ((resid 100 and name HN   ))   ( (resid 101 and name HN   ))     3.93  2.13  0.59
 assign ((resid 100 and name HA   ))   ( (resid 101 and name HN   ))     3.56  1.76  0.53
 assign ((resid 100 and name HB1  ))   ( (resid 101 and name HN   ))     4.92  3.12  0.74
 assign ((resid 101 and name HA   ))   ( (resid 102 and name HN   ))     3.29  1.49  0.49
 assign ((resid  96 and name HN   ))   ( (resid 103 and name HN   ))     3.62  1.82  0.54
 assign ((resid 102 and name HA   ))   ( (resid 103 and name HN   ))     3.33  1.53  0.50
 assign ((resid 102 and name HB   ))   ( (resid 103 and name HN   ))     4.89  3.09  0.73
 assign ((resid 102 and name HG2* ))   ( (resid 103 and name HN   ))     3.86  2.06  0.58
 assign ((resid 102 and name HG1* ))   ( (resid 103 and name HN   ))     4.81  3.01  0.72
 assign ((resid 103 and name HA   ))   ( (resid 104 and name HN   ))     3.08  1.28  0.46
 assign ((resid 103 and name HB   ))   ( (resid 104 and name HN   ))     4.46  2.66  0.67
 assign ((resid 104 and name HA   ))   ( (resid 105 and name HN   ))     3.37  1.57  0.51
 assign ((resid 104 and name HG1* ))   ( (resid 105 and name HN   ))     4.02  2.22  0.60
 assign ((resid 104 and name HG2* ))   ( (resid 105 and name HN   ))     4.29  2.49  0.64
 assign ((resid 105 and name HA   ))   ( (resid 106 and name HN   ))     2.95  1.15  0.44
 assign ((resid 105 and name HB2  ))   ( (resid 106 and name HN   ))     4.23  2.43  0.63
 assign ((resid 105 and name HG2  ))   ( (resid 106 and name HN   ))     4.83  3.03  0.72
 assign ((resid 105 and name HG1  ))   ( (resid 106 and name HN   ))     4.83  3.03  0.72
 assign ((resid 107 and name HA   ))   ( (resid 108 and name HN   ))     2.97  1.17  0.45
 assign ((resid 107 and name HB2  ))   ( (resid 108 and name HN   ))     4.43  2.63  0.66
 assign ((resid 107 and name HB1  ))   ( (resid 108 and name HN   ))     4.43  2.63  0.66
 assign ((resid 107 and name HG*  ))   ( (resid 108 and name HN   ))     4.09  2.29  0.61
 assign ((resid 108 and name HG   ))   ( (resid 109 and name HN   ))     4.63  2.83  0.69
 assign ((resid 110 and name HN   ))   ( (resid 111 and name HN   ))     4.64  2.84  0.70
 assign ((resid 110 and name HA*  ))   ( (resid 111 and name HN   ))     3.28  1.48  0.49
 assign ((resid 111 and name HA   ))   ( (resid 112 and name HN   ))     3.55  1.75  0.53
 assign ((resid 111 and name HB   ))   ( (resid 112 and name HN   ))     4.17  2.37  0.63
 assign ((resid 111 and name HG1* ))   ( (resid 112 and name HN   ))     4.69  2.89  0.70
 assign ((resid 111 and name HG2* ))   ( (resid 112 and name HN   ))     4.69  2.89  0.70
 assign ((resid 112 and name HN   ))   ( (resid 113 and name HN   ))     4.82  3.02  0.72
 assign ((resid 112 and name HA   ))   ( (resid 113 and name HN   ))     2.87  1.07  0.43
 assign ((resid 112 and name HB2  ))   ( (resid 113 and name HN   ))     4.56  2.76  0.68
 assign ((resid 112 and name HB1  ))   ( (resid 113 and name HN   ))     4.56  2.76  0.68
 assign ((resid 113 and name HB2  ))   ( (resid 114 and name HN   ))     3.95  2.15  0.59
 assign ((resid 113 and name HB1  ))   ( (resid 114 and name HN   ))     3.95  2.15  0.59
 assign ((resid 113 and name HD2* ))   ( (resid 114 and name HN   ))     4.66  2.86  0.70
 assign ((resid  91 and name HA   ))   ( (resid  91 and name HD21 ))     4.80  3.00  0.72
 assign ((resid  91 and name HA   ))   ( (resid  91 and name HD22 ))     4.80  3.00  0.72
 assign ((resid  94 and name HA   ))   ( (resid  94 and name HD21 ))     4.80  3.00  0.72
 assign ((resid  94 and name HA   ))   ( (resid  94 and name HD22 ))     4.80  3.00  0.72
 assign ((resid   9 and name HB2  ))   ( (resid   9 and name HE21 ))     4.80  3.00  0.72
 assign ((resid   9 and name HB1  ))   ( (resid   9 and name HE21 ))     4.80  3.00  0.72
 assign ((resid   9 and name HB2  ))   ( (resid   9 and name HE22 ))     4.80  3.00  0.72
 assign ((resid   9 and name HB1  ))   ( (resid   9 and name HE22 ))     4.80  3.00  0.72
 assign ((resid 107 and name HG*  ))   ( (resid 107 and name HE21 ))     4.02  2.22  0.60
 assign ((resid 107 and name HG*  ))   ( (resid 107 and name HE22 ))     4.02  2.22  0.60
 assign ((resid   4 and name HN   ))   ( (resid   4 and name HG*  ))     4.42  2.62  0.66
 assign ((resid   5 and name HN   ))   ( (resid   5 and name HB2  ))     3.14  1.34  0.47
 assign ((resid   5 and name HN   ))   ( (resid   5 and name HG*  ))     3.97  2.17  0.60
 assign ((resid   5 and name HN   ))   ( (resid   5 and name HB1  ))     3.14  1.34  0.47
 assign ((resid   5 and name HN   ))   ( (resid   5 and name HE*  ))     4.71  2.91  0.71
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HB   ))     3.44  1.64  0.52
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HG2* ))     3.86  2.06  0.58
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HB*  ))     3.21  1.41  0.48
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HG2  ))     4.62  2.82  0.69
 assign ((resid   8 and name HN   ))   ( (resid   8 and name HB   ))     3.19  1.39  0.48
 assign ((resid   8 and name HN   ))   ( (resid   8 and name HG2* ))     3.35  1.55  0.50
 assign ((resid   8 and name HN   ))   ( (resid   8 and name HG1* ))     3.89  2.09  0.58
 assign ((resid   8 and name HA   ))   ( (resid   9 and name HN   ))     2.95  1.15  0.44
 assign ((resid   9 and name HN   ))   ( (resid   9 and name HB2  ))     3.64  1.84  0.55
 assign ((resid   9 and name HN   ))   ( (resid   9 and name HB1  ))     3.64  1.84  0.55
 assign ((resid  10 and name HN   ))   ( (resid  10 and name HB   ))     3.50  1.70  0.53
 assign ((resid  10 and name HN   ))   ( (resid  10 and name HG1* ))     4.04  2.24  0.61
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HB2  ))     3.76  1.96  0.56
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HB1  ))     3.76  1.96  0.56
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HG2  ))     4.89  3.09  0.73
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HG1  ))     4.89  3.09  0.73
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HD*  ))     4.93  3.13  0.74
 assign ((resid  12 and name HN   ))   ( (resid  12 and name HB   ))     3.72  1.92  0.56
 assign ((resid  12 and name HN   ))   ( (resid  12 and name HG2* ))     4.10  2.30  0.62
 assign ((resid  11 and name HB2  ))   ( (resid  12 and name HN   ))     4.75  2.95  0.71
 assign ((resid  12 and name HN   ))   ( (resid  12 and name HG11 ))     5.28  3.48  0.79
 assign ((resid  12 and name HN   ))   ( (resid  12 and name HD1* ))     4.68  2.88  0.70
 assign ((resid  12 and name HG11 ))   ( (resid  13 and name HN   ))     4.23  2.43  0.63
 assign ((resid  14 and name HN   ))   ( (resid  14 and name HB2  ))     4.17  2.37  0.63
 assign ((resid  14 and name HN   ))   ( (resid  14 and name HB1  ))     4.17  2.37  0.63
 assign ((resid  17 and name HN   ))   ( (resid  17 and name HB2  ))     3.75  1.95  0.56
 assign ((resid  75 and name HB*  ))   ( (resid  76 and name HN   ))     4.06  2.26  0.61
 assign ((resid  76 and name HN   ))   ( (resid  76 and name HB1  ))     3.87  2.07  0.58
 assign ((resid  17 and name HN   ))   ( (resid  17 and name HB1  ))     3.75  1.95  0.56
 assign ((resid  18 and name HN   ))   ( (resid  18 and name HB   ))     3.39  1.59  0.51
 assign ((resid  18 and name HN   ))   ( (resid  18 and name HG2* ))     3.89  2.09  0.58
 assign ((resid  19 and name HN   ))   ( (resid  19 and name HB2  ))     3.88  2.08  0.58
 assign ((resid  19 and name HN   ))   ( (resid  19 and name HB1  ))     3.88  2.08  0.58
 assign ((resid  19 and name HN   ))   ( (resid  19 and name HE*  ))     4.59  2.79  0.69
 assign ((resid  19 and name HN   ))   ( (resid  19 and name HD*  ))     3.39  1.59  0.51
 assign ((resid  22 and name HN   ))   ( (resid  22 and name HB   ))     3.39  1.59  0.51
 assign ((resid  22 and name HN   ))   ( (resid  22 and name HG2* ))     4.25  2.45  0.64
 assign ((resid  24 and name HN   ))   ( (resid  24 and name HB2  ))     3.98  2.18  0.60
 assign ((resid  24 and name HN   ))   ( (resid  24 and name HB1  ))     3.98  2.18  0.60
 assign ((resid  24 and name HN   ))   ( (resid  24 and name HG2  ))     4.50  2.70  0.68
 assign ((resid  24 and name HN   ))   ( (resid  24 and name HG1  ))     4.50  2.70  0.68
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HB2  ))     3.86  2.06  0.58
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HB1  ))     3.86  2.06  0.58
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HG   ))     3.30  1.50  0.50
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HD2* ))     3.63  1.83  0.54
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HD1* ))     4.18  2.38  0.63
 assign ((resid  27 and name HN   ))   ( (resid  27 and name HB*  ))     3.08  1.28  0.46
 assign ((resid  28 and name HN   ))   ( (resid  28 and name HB   ))     4.19  2.39  0.63
 assign ((resid  28 and name HN   ))   ( (resid  28 and name HG2* ))     3.71  1.91  0.56
 assign ((resid  29 and name HN   ))   ( (resid  32 and name HB2  ))     4.35  2.55  0.65
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HG2  ))     3.90  2.10  0.59
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HG1  ))     3.90  2.10  0.59
 assign ((resid  31 and name HN   ))   ( (resid  31 and name HB*  ))     4.13  2.33  0.62
 assign ((resid  31 and name HN   ))   ( (resid  31 and name HG1  ))     5.12  3.32  0.77
 assign ((resid  32 and name HN   ))   ( (resid  32 and name HB2  ))     3.64  1.84  0.55
 assign ((resid  32 and name HN   ))   ( (resid  32 and name HB1  ))     3.64  1.84  0.55
 assign ((resid  32 and name HN   ))   ( (resid  32 and name HG2  ))     3.90  2.10  0.59
 assign ((resid  32 and name HN   ))   ( (resid  32 and name HG1  ))     3.90  2.10  0.59
 assign ((resid  46 and name HN   ))   ( (resid  47 and name HD2  ))     4.17  2.37  0.63
 assign ((resid  33 and name HN   ))   ( (resid  33 and name HB1  ))     3.37  1.57  0.51
 assign ((resid  33 and name HN   ))   ( (resid  33 and name HB2  ))     3.37  1.57  0.51
 assign ((resid  33 and name HN   ))   ( (resid  33 and name HD2* ))     3.99  2.19  0.60
 assign ((resid  33 and name HN   ))   ( (resid  33 and name HD1* ))     4.26  2.46  0.64
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HB2  ))     3.65  1.85  0.55
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HG2  ))     3.95  2.15  0.59
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HG1  ))     3.95  2.15  0.59
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HD2  ))     4.37  2.57  0.66
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HD1  ))     4.37  2.57  0.66
 assign ((resid  35 and name HN   ))   ( (resid  35 and name HB*  ))     2.90  1.10  0.44
 assign ((resid  35 and name HN   ))   ( (resid  35 and name HG2  ))     3.50  1.70  0.53
 assign ((resid  35 and name HN   ))   ( (resid  35 and name HG1  ))     3.50  1.70  0.53
 assign ((resid  36 and name HN   ))   ( (resid  36 and name HB1  ))     3.72  1.92  0.56
 assign ((resid  36 and name HN   ))   ( (resid  36 and name HG1  ))     3.56  1.76  0.53
 assign ((resid  37 and name HN   ))   ( (resid  37 and name HB2  ))     3.98  2.18  0.60
 assign ((resid  37 and name HN   ))   ( (resid  37 and name HG   ))     3.10  1.30  0.47
 assign ((resid  37 and name HN   ))   ( (resid  37 and name HD1* ))     3.63  1.83  0.54
 assign ((resid  25 and name HD1* ))   ( (resid  37 and name HN   ))     4.12  2.32  0.62
 assign ((resid  38 and name HN   ))   ( (resid  38 and name HG2  ))     3.89  2.09  0.58
 assign ((resid  38 and name HN   ))   ( (resid  38 and name HG1  ))     3.89  2.09  0.58
 assign ((resid  38 and name HN   ))   ( (resid  38 and name HD2  ))     4.23  2.43  0.63
 assign ((resid  38 and name HN   ))   ( (resid  38 and name HD1  ))     4.23  2.43  0.63
 assign ((resid  39 and name HN   ))   ( (resid  39 and name HB*  ))     2.78  0.98  0.42
 assign ((resid  39 and name HN   ))   ( (resid  39 and name HG1  ))     4.12  2.32  0.62
 assign ((resid  40 and name HN   ))   ( (resid  40 and name HB   ))     3.30  1.50  0.50
 assign ((resid  40 and name HN   ))   ( (resid  40 and name HG2* ))     3.31  1.51  0.50
 assign ((resid  40 and name HN   ))   ( (resid  40 and name HG1* ))     3.78  1.98  0.57
 assign ((resid  41 and name HN   ))   ( (resid  41 and name HB2  ))     3.59  1.79  0.54
 assign ((resid  41 and name HN   ))   ( (resid  41 and name HB1  ))     3.59  1.79  0.54
 assign ((resid  41 and name HN   ))   ( (resid  41 and name HG   ))     3.12  1.32  0.47
 assign ((resid  41 and name HN   ))   ( (resid  41 and name HD1* ))     3.83  2.03  0.57
 assign ((resid  42 and name HN   ))   ( (resid  42 and name HB2  ))     3.58  1.78  0.54
 assign ((resid  42 and name HN   ))   ( (resid  42 and name HB1  ))     3.58  1.78  0.54
 assign ((resid  43 and name HN   ))   ( (resid  43 and name HB1  ))     4.13  2.33  0.62
 assign ((resid  44 and name HN   ))   ( (resid  44 and name HB2  ))     4.02  2.22  0.60
 assign ((resid  44 and name HN   ))   ( (resid  44 and name HB1  ))     4.02  2.22  0.60
 assign ((resid  43 and name HB1  ))   ( (resid  44 and name HN   ))     3.90  2.10  0.59
 assign ((resid  44 and name HN   ))   ( (resid  44 and name HG1  ))     4.77  2.97  0.72
 assign ((resid  45 and name HN   ))   ( (resid  45 and name HB2  ))     3.63  1.83  0.54
 assign ((resid  45 and name HN   ))   ( (resid  45 and name HB1  ))     3.63  1.83  0.54
 assign ((resid  45 and name HN   ))   ( (resid  45 and name HG2  ))     4.24  2.44  0.64
 assign ((resid  45 and name HN   ))   ( (resid  45 and name HG1  ))     4.24  2.44  0.64
 assign ((resid  46 and name HN   ))   ( (resid  46 and name HB2  ))     3.73  1.93  0.56
 assign ((resid  48 and name HN   ))   ( (resid  48 and name HG1* ))     3.81  2.01  0.57
 assign ((resid  49 and name HN   ))   ( (resid  49 and name HD*  ))     4.43  2.63  0.66
 assign ((resid  50 and name HN   ))   ( (resid  50 and name HG1  ))     4.85  3.05  0.73
 assign ((resid  49 and name HG2  ))   ( (resid  50 and name HN   ))     5.08  3.28  0.76
 assign ((resid  50 and name HN   ))   ( (resid  50 and name HD*  ))     5.41  3.61  0.81
 assign ((resid  51 and name HN   ))   ( (resid  51 and name HB2  ))     3.76  1.96  0.56
 assign ((resid  51 and name HN   ))   ( (resid  51 and name HB1  ))     3.76  1.96  0.56
 assign ((resid  51 and name HN   ))   ( (resid  51 and name HG   ))     3.11  1.31  0.47
 assign ((resid  51 and name HN   ))   ( (resid  51 and name HD2* ))     3.17  1.37  0.48
 assign ((resid  53 and name HN   ))   ( (resid  53 and name HB2  ))     3.97  2.17  0.60
 assign ((resid  53 and name HN   ))   ( (resid  53 and name HB1  ))     3.97  2.17  0.60
 assign ((resid  54 and name HB2  ))   ( (resid  55 and name HN   ))     4.69  2.89  0.70
 assign ((resid  55 and name HN   ))   ( (resid  55 and name HG1  ))     5.41  3.61  0.81
 assign ((resid  56 and name HN   ))   ( (resid  56 and name HB   ))     3.98  2.18  0.60
 assign ((resid  56 and name HN   ))   ( (resid  56 and name HG2* ))     3.14  1.34  0.47
 assign ((resid  58 and name HN   ))   ( (resid  58 and name HB   ))     3.75  1.95  0.56
 assign ((resid  58 and name HN   ))   ( (resid  58 and name HG2* ))     3.95  2.15  0.59
 assign ((resid  56 and name HG2* ))   ( (resid  58 and name HN   ))     4.47  2.67  0.67
 assign ((resid  58 and name HN   ))   ( (resid  58 and name HD1* ))     4.24  2.44  0.64
 assign ((resid  59 and name HN   ))   ( (resid  59 and name HB2  ))     3.96  2.16  0.59
 assign ((resid  59 and name HN   ))   ( (resid  59 and name HB1  ))     3.96  2.16  0.59
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HB   ))     3.77  1.97  0.57
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HG2* ))     4.72  2.92  0.71
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HG12 ))     4.64  2.84  0.70
 assign ((resid  60 and name HN   ))   ( (resid  61 and name HG*  ))     6.50  4.70  0.98
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HG11 ))     4.64  2.84  0.70
 assign ((resid  61 and name HN   ))   ( (resid  61 and name HB2  ))     3.81  2.01  0.57
 assign ((resid  61 and name HN   ))   ( (resid  61 and name HB1  ))     3.81  2.01  0.57
 assign ((resid  62 and name HN   ))   ( (resid  62 and name HG1* ))     4.23  2.43  0.63
 assign ((resid  62 and name HN   ))   ( (resid  62 and name HG2* ))     3.85  2.05  0.58
 assign ((resid  62 and name HA   ))   ( (resid  63 and name HN   ))     3.16  1.36  0.47
 assign ((resid  63 and name HN   ))   ( (resid  63 and name HB2  ))     3.79  1.99  0.57
 assign ((resid  63 and name HN   ))   ( (resid  63 and name HB1  ))     3.79  1.99  0.57
 assign ((resid  68 and name HN   ))   ( (resid  68 and name HB*  ))     3.55  1.75  0.53
 assign ((resid  69 and name HN   ))   ( (resid  69 and name HB2  ))     4.18  2.38  0.63
 assign ((resid  69 and name HN   ))   ( (resid  69 and name HB1  ))     4.18  2.38  0.63
 assign ((resid  69 and name HN   ))   ( (resid  69 and name HG*  ))     4.04  2.24  0.61
 assign ((resid  70 and name HN   ))   ( (resid  70 and name HB*  ))     3.39  1.59  0.51
 assign ((resid  70 and name HN   ))   ( (resid  70 and name HG1  ))     4.27  2.47  0.64
 assign ((resid  71 and name HB*  ))   ( (resid  72 and name HN   ))     4.48  2.68  0.67
 assign ((resid  72 and name HN   ))   ( (resid  72 and name HG*  ))     5.73  3.93  0.86
 assign ((resid  73 and name HN   ))   ( (resid  73 and name HB1  ))     4.15  2.35  0.62
 assign ((resid  74 and name HN   ))   ( (resid  74 and name HB*  ))     3.65  1.85  0.55
 assign ((resid  76 and name HN   ))   ( (resid  76 and name HB2  ))     3.87  2.07  0.58
 assign ((resid  72 and name HG*  ))   ( (resid  76 and name HN   ))     5.23  3.43  0.78
 assign ((resid  72 and name HD*  ))   ( (resid  76 and name HN   ))     6.50  4.70  0.98
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HB2  ))     3.46  1.66  0.52
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HB1  ))     3.46  1.66  0.52
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HD*  ))     4.25  2.45  0.64
 assign ((resid  78 and name HN   ))   ( (resid  78 and name HB*  ))     3.11  1.31  0.47
 assign ((resid  79 and name HN   ))   ( (resid  79 and name HB*  ))     3.09  1.29  0.46
 assign ((resid  80 and name HN   ))   ( (resid  80 and name HG2* ))     3.81  2.01  0.57
 assign ((resid  80 and name HN   ))   ( (resid  80 and name HD1* ))     3.64  1.84  0.55
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HB2  ))     3.75  1.95  0.56
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HB1  ))     3.75  1.95  0.56
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HG   ))     3.68  1.88  0.55
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HD1* ))     4.14  2.34  0.62
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HB2  ))     3.68  1.88  0.55
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HB1  ))     3.68  1.88  0.55
 assign ((resid  83 and name HN   ))   ( (resid  83 and name HB*  ))     2.83  1.03  0.42
 assign ((resid  83 and name HN   ))   ( (resid  83 and name HG2  ))     3.84  2.04  0.58
 assign ((resid  83 and name HN   ))   ( (resid  83 and name HG1  ))     3.84  2.04  0.58
 assign ((resid  83 and name HN   ))   ( (resid  83 and name HD*  ))     4.20  2.40  0.63
 assign ((resid  84 and name HN   ))   ( (resid  84 and name HB   ))     3.37  1.57  0.51
 assign ((resid  84 and name HN   ))   ( (resid  84 and name HG2* ))     3.22  1.42  0.48
 assign ((resid  85 and name HN   ))   ( (resid  85 and name HB*  ))     3.65  1.85  0.55
 assign ((resid  85 and name HN   ))   ( (resid  85 and name HD*  ))     4.17  2.37  0.63
 assign ((resid  86 and name HN   ))   ( (resid  86 and name HB*  ))     2.94  1.14  0.44
 assign ((resid  87 and name HN   ))   ( (resid  87 and name HB2  ))     3.59  1.79  0.54
 assign ((resid  87 and name HN   ))   ( (resid  87 and name HB1  ))     3.59  1.79  0.54
 assign ((resid  87 and name HN   ))   ( (resid  87 and name HG2  ))     3.94  2.14  0.59
 assign ((resid  87 and name HN   ))   ( (resid  87 and name HG1  ))     3.94  2.14  0.59
 assign ((resid  88 and name HN   ))   ( (resid  88 and name HG   ))     3.12  1.32  0.47
 assign ((resid  88 and name HN   ))   ( (resid  88 and name HD1* ))     4.09  2.29  0.61
 assign ((resid  88 and name HN   ))   ( (resid  88 and name HD2* ))     3.82  2.02  0.57
 assign ((resid  90 and name HN   ))   ( (resid  90 and name HB2  ))     3.74  1.94  0.56
 assign ((resid  90 and name HN   ))   ( (resid  90 and name HB1  ))     3.74  1.94  0.56
 assign ((resid  90 and name HN   ))   ( (resid  90 and name HD*  ))     3.68  1.88  0.55
 assign ((resid  91 and name HN   ))   ( (resid  91 and name HB*  ))     3.71  1.91  0.56
 assign ((resid  92 and name HN   ))   ( (resid  92 and name HB*  ))     3.71  1.91  0.56
 assign ((resid  93 and name HN   ))   ( (resid  93 and name HB*  ))     3.96  2.16  0.59
 assign ((resid  95 and name HN   ))   ( (resid  95 and name HB   ))     3.86  2.06  0.58
 assign ((resid  95 and name HN   ))   ( (resid  95 and name HG2* ))     3.92  2.12  0.59
 assign ((resid  95 and name HN   ))   ( (resid  95 and name HG1* ))     4.63  2.83  0.69
 assign ((resid  96 and name HN   ))   ( (resid  96 and name HB   ))     3.91  2.11  0.59
 assign ((resid  98 and name HN   ))   ( (resid  98 and name HB2  ))     4.18  2.38  0.63
 assign ((resid  98 and name HN   ))   ( (resid  98 and name HB1  ))     4.18  2.38  0.63
 assign ((resid 101 and name HN   ))   ( (resid 101 and name HB   ))     3.18  1.38  0.48
 assign ((resid 101 and name HN   ))   ( (resid 101 and name HG2* ))     4.02  2.22  0.60
 assign ((resid 102 and name HN   ))   ( (resid 102 and name HG2* ))     5.62  3.82  0.84
 assign ((resid 103 and name HN   ))   ( (resid 103 and name HB   ))     3.91  2.11  0.59
 assign ((resid 103 and name HN   ))   ( (resid 103 and name HG2* ))     4.71  2.91  0.71
 assign ((resid 104 and name HN   ))   ( (resid 104 and name HB   ))     3.97  2.17  0.60
 assign ((resid 104 and name HN   ))   ( (resid 104 and name HG1* ))     4.06  2.26  0.61
 assign ((resid 104 and name HN   ))   ( (resid 104 and name HG2* ))     3.93  2.13  0.59
 assign ((resid 105 and name HN   ))   ( (resid 105 and name HB1  ))     4.18  2.38  0.63
 assign ((resid 107 and name HN   ))   ( (resid 107 and name HB2  ))     4.03  2.23  0.60
 assign ((resid 107 and name HN   ))   ( (resid 107 and name HB1  ))     4.03  2.23  0.60
 assign ((resid 108 and name HN   ))   ( (resid 108 and name HB*  ))     3.19  1.39  0.48
 assign ((resid 109 and name HN   ))   ( (resid 109 and name HB2  ))     4.17  2.37  0.63
 assign ((resid 109 and name HN   ))   ( (resid 109 and name HB1  ))     4.17  2.37  0.63
 assign ((resid 109 and name HN   ))   ( (resid 109 and name HG*  ))     4.30  2.50  0.65
 assign ((resid 111 and name HN   ))   ( (resid 111 and name HG2* ))     4.23  2.43  0.63
 assign ((resid 112 and name HN   ))   ( (resid 112 and name HB2  ))     3.86  2.06  0.58
 assign ((resid 112 and name HN   ))   ( (resid 112 and name HB1  ))     3.86  2.06  0.58
 assign ((resid 113 and name HN   ))   ( (resid 113 and name HB2  ))     3.57  1.77  0.54
 assign ((resid 113 and name HN   ))   ( (resid 113 and name HB1  ))     3.57  1.77  0.54
 assign ((resid 113 and name HN   ))   ( (resid 113 and name HG   ))     3.30  1.50  0.50
 assign ((resid 113 and name HN   ))   ( (resid 113 and name HD1* ))     4.22  2.42  0.63
 assign ((resid 113 and name HN   ))   ( (resid 113 and name HD2* ))     4.16  2.36  0.62
 assign ((resid 114 and name HN   ))   ( (resid 114 and name HB*  ))     3.29  1.49  0.49
 assign ((resid 114 and name HN   ))   ( (resid 114 and name HG2  ))     4.14  2.34  0.62
 assign ((resid 114 and name HN   ))   ( (resid 114 and name HG1  ))     4.14  2.34  0.62
 assign ((resid   9 and name HN   ))   ( (resid  10 and name HN   ))     4.20  2.40  0.63
 assign ((resid  11 and name HN   ))   ( (resid  12 and name HN   ))     4.19  2.39  0.63
 assign ((resid  17 and name HN   ))   ( (resid  18 and name HN   ))     4.62  2.82  0.69
 assign ((resid  21 and name HN   ))   ( (resid  22 and name HN   ))     4.31  2.51  0.65
 assign ((resid  27 and name HN   ))   ( (resid  28 and name HN   ))     4.79  2.99  0.72
 assign ((resid  32 and name HN   ))   ( (resid  33 and name HN   ))     3.27  1.47  0.49
 assign ((resid  34 and name HN   ))   ( (resid  35 and name HN   ))     3.29  1.49  0.49
 assign ((resid  36 and name HN   ))   ( (resid  37 and name HN   ))     3.17  1.37  0.48
 assign ((resid  38 and name HN   ))   ( (resid  39 and name HN   ))     3.16  1.36  0.47
 assign ((resid  42 and name HN   ))   ( (resid  43 and name HN   ))     3.65  1.85  0.55
 assign ((resid  44 and name HN   ))   ( (resid  45 and name HN   ))     3.57  1.77  0.54
 assign ((resid  45 and name HN   ))   ( (resid  46 and name HN   ))     4.11  2.31  0.62
 assign ((resid  11 and name HN   ))   ( (resid  59 and name HN   ))     3.72  1.92  0.56
 assign ((resid  61 and name HN   ))   ( (resid  62 and name HN   ))     4.38  2.58  0.66
 assign ((resid  62 and name HN   ))   ( (resid  63 and name HN   ))     4.52  2.72  0.68
 assign ((resid  70 and name HN   ))   ( (resid  71 and name HN   ))     3.55  1.75  0.53
 assign ((resid  69 and name HN   ))   ( (resid  70 and name HN   ))     3.93  2.13  0.59
 assign ((resid  78 and name HN   ))   ( (resid  79 and name HN   ))     4.05  2.25  0.61
 assign ((resid  79 and name HN   ))   ( (resid  80 and name HN   ))     3.42  1.62  0.51
 assign ((resid  80 and name HN   ))   ( (resid  81 and name HN   ))     3.54  1.74  0.53
 assign ((resid  83 and name HN   ))   ( (resid  84 and name HN   ))     3.42  1.62  0.51
 assign ((resid  86 and name HN   ))   ( (resid  87 and name HN   ))     3.71  1.91  0.56
 assign ((resid  89 and name HN   ))   ( (resid  90 and name HN   ))     3.21  1.41  0.48
 assign ((resid  94 and name HN   ))   ( (resid  95 and name HN   ))     3.91  2.11  0.59
 assign ((resid  97 and name HN   ))   ( (resid  98 and name HN   ))     5.15  3.35  0.77
 assign ((resid 101 and name HN   ))   ( (resid 102 and name HN   ))     4.48  2.68  0.67
 assign ((resid 103 and name HN   ))   ( (resid 104 and name HN   ))     4.77  2.97  0.72
 assign ((resid 105 and name HN   ))   ( (resid 106 and name HN   ))     4.47  2.67  0.67
 assign ((resid 106 and name HN   ))   ( (resid 107 and name HN   ))     4.60  2.80  0.69
 assign ((resid 113 and name HN   ))   ( (resid 114 and name HN   ))     4.81  3.01  0.72
 assign ((resid  32 and name HN   ))   ( (resid  34 and name HN   ))     4.59  2.79  0.69
 assign ((resid  31 and name HA   ))   ( (resid  34 and name HN   ))     3.73  1.93  0.56
 assign ((resid  32 and name HA   ))   ( (resid  35 and name HN   ))     4.03  2.23  0.60
 assign ((resid  35 and name HN   ))   ( (resid  37 and name HN   ))     4.70  2.90  0.70
 assign ((resid  33 and name HA   ))   ( (resid  36 and name HN   ))     3.67  1.87  0.55
 assign ((resid  32 and name HA   ))   ( (resid  36 and name HN   ))     5.76  3.96  0.86
 assign ((resid  43 and name HN   ))   ( (resid  44 and name HA   ))     6.00  4.20  0.90
 assign ((resid  34 and name HA   ))   ( (resid  37 and name HN   ))     4.46  2.66  0.67
 assign ((resid  35 and name HA   ))   ( (resid  38 and name HN   ))     3.75  1.95  0.56
 assign ((resid  36 and name HN   ))   ( (resid  38 and name HN   ))     4.52  2.72  0.68
 assign ((resid  37 and name HA   ))   ( (resid  39 and name HN   ))     4.74  2.94  0.71
 assign ((resid  37 and name HN   ))   ( (resid  39 and name HN   ))     4.36  2.56  0.65
 assign ((resid  36 and name HA   ))   ( (resid  39 and name HN   ))     3.76  1.96  0.56
 assign ((resid  38 and name HA   ))   ( (resid  40 and name HN   ))     5.00  3.20  0.75
 assign ((resid  38 and name HN   ))   ( (resid  40 and name HN   ))     4.54  2.74  0.68
 assign ((resid  37 and name HA   ))   ( (resid  40 and name HN   ))     4.01  2.21  0.60
 assign ((resid  39 and name HN   ))   ( (resid  41 and name HN   ))     4.32  2.52  0.65
 assign ((resid  38 and name HA   ))   ( (resid  41 and name HN   ))     4.19  2.39  0.63
 assign ((resid  37 and name HA   ))   ( (resid  41 and name HN   ))     4.27  2.47  0.64
 assign ((resid  39 and name HA   ))   ( (resid  42 and name HN   ))     4.18  2.38  0.63
 assign ((resid  38 and name HA   ))   ( (resid  42 and name HN   ))     5.12  3.32  0.77
 assign ((resid  42 and name HN   ))   ( (resid  44 and name HN   ))     4.70  2.90  0.70
 assign ((resid  40 and name HA   ))   ( (resid  43 and name HN   ))     4.57  2.77  0.69
 assign ((resid  67 and name HA   ))   ( (resid  70 and name HN   ))     4.89  3.09  0.73
 assign ((resid  49 and name HN   ))   ( (resid  50 and name HN   ))     4.08  2.28  0.61
 assign ((resid  47 and name HA   ))   ( (resid  50 and name HN   ))     4.12  2.32  0.62
 assign ((resid  49 and name HA   ))   ( (resid  51 and name HN   ))     4.58  2.78  0.69
 assign ((resid  48 and name HA   ))   ( (resid  51 and name HN   ))     3.99  2.19  0.60
 assign ((resid  71 and name HA   ))   ( (resid  74 and name HN   ))     5.06  3.26  0.76
 assign ((resid  73 and name HA   ))   ( (resid  76 and name HN   ))     4.85  3.05  0.73
 assign ((resid  73 and name HA   ))   ( (resid  77 and name HN   ))     6.00  4.20  0.90
 assign ((resid  75 and name HA   ))   ( (resid  78 and name HN   ))     4.22  2.42  0.63
 assign ((resid  78 and name HN   ))   ( (resid  80 and name HN   ))     4.36  2.56  0.65
 assign ((resid  77 and name HN   ))   ( (resid  79 and name HN   ))     5.01  3.21  0.75
 assign ((resid  75 and name HA   ))   ( (resid  79 and name HN   ))     5.08  3.28  0.76
 assign ((resid  79 and name HN   ))   ( (resid  81 and name HN   ))     4.86  3.06  0.73
 assign ((resid  77 and name HA   ))   ( (resid  80 and name HN   ))     3.86  2.06  0.58
 assign ((resid  76 and name HA   ))   ( (resid  80 and name HN   ))     5.77  3.97  0.87
 assign ((resid  78 and name HA   ))   ( (resid  81 and name HN   ))     4.02  2.22  0.60
 assign ((resid  80 and name HA   ))   ( (resid  82 and name HN   ))     4.89  3.09  0.73
 assign ((resid  80 and name HN   ))   ( (resid  82 and name HN   ))     4.90  3.10  0.74
 assign ((resid  78 and name HA   ))   ( (resid  82 and name HN   ))     4.52  2.72  0.68
 assign ((resid  79 and name HA   ))   ( (resid  82 and name HN   ))     4.73  2.93  0.71
 assign ((resid  82 and name HN   ))   ( (resid  84 and name HN   ))     5.10  3.30  0.77
 assign ((resid  81 and name HA   ))   ( (resid  83 and name HN   ))     4.69  2.89  0.70
 assign ((resid  81 and name HN   ))   ( (resid  83 and name HN   ))     4.77  2.97  0.72
 assign ((resid  80 and name HA   ))   ( (resid  83 and name HN   ))     3.94  2.14  0.59
 assign ((resid  79 and name HA   ))   ( (resid  83 and name HN   ))     4.24  2.44  0.64
 assign ((resid  83 and name HN   ))   ( (resid  85 and name HN   ))     4.80  3.00  0.72
 assign ((resid  81 and name HA   ))   ( (resid  84 and name HN   ))     4.00  2.20  0.60
 assign ((resid  85 and name HN   ))   ( (resid  87 and name HN   ))     5.06  3.26  0.76
 assign ((resid  84 and name HA   ))   ( (resid  86 and name HN   ))     4.67  2.87  0.70
 assign ((resid  84 and name HN   ))   ( (resid  86 and name HN   ))     4.09  2.29  0.61
 assign ((resid  83 and name HA   ))   ( (resid  86 and name HN   ))     3.89  2.09  0.58
 assign ((resid  86 and name HN   ))   ( (resid  88 and name HN   ))     4.86  3.06  0.73
 assign ((resid  84 and name HA   ))   ( (resid  87 and name HN   ))     4.30  2.50  0.65
 assign ((resid  83 and name HA   ))   ( (resid  87 and name HN   ))     4.37  2.57  0.66
 assign ((resid  85 and name HA   ))   ( (resid  88 and name HN   ))     4.19  2.39  0.63
 assign ((resid  86 and name HA   ))   ( (resid  88 and name HN   ))     4.49  2.69  0.67
 assign ((resid  84 and name HA   ))   ( (resid  88 and name HN   ))     4.89  3.09  0.73
 assign ((resid   6 and name HN   ))   ( (resid  26 and name HA   ))     4.10  2.30  0.62
 assign ((resid   6 and name HN   ))   ( (resid  33 and name HD2* ))     4.95  3.15  0.74
 assign ((resid  14 and name HN   ))   ( (resid  18 and name HA   ))     3.99  2.19  0.60
 assign ((resid  14 and name HN   ))   ( (resid  48 and name HG2* ))     5.50  3.70  0.83
 assign ((resid  14 and name HN   ))   ( (resid  56 and name HG1* ))     5.75  3.95  0.86
 assign ((resid  13 and name HN   ))   ( (resid  57 and name HB*  ))     4.34  2.54  0.65
 assign ((resid  12 and name HN   ))   ( (resid  20 and name HA   ))     4.42  2.62  0.66
 assign ((resid   7 and name HN   ))   ( (resid   8 and name HA   ))     5.43  3.63  0.81
 assign ((resid   7 and name HN   ))   ( (resid  24 and name HA   ))     5.89  4.09  0.88
 assign ((resid   7 and name HN   ))   ( (resid  62 and name HG2* ))     4.97  3.17  0.75
 assign ((resid   7 and name HN   ))   ( (resid   8 and name HG2* ))     4.84  3.04  0.73
 assign ((resid   8 and name HN   ))   ( (resid  22 and name HG2* ))     3.96  2.16  0.59
 assign ((resid   8 and name HN   ))   ( (resid  23 and name HB2  ))     5.06  3.26  0.76
 assign ((resid   9 and name HN   ))   ( (resid  61 and name HB2  ))     4.50  2.70  0.68
 assign ((resid   9 and name HN   ))   ( (resid  60 and name HA   ))     4.28  2.48  0.64
 assign ((resid   9 and name HN   ))   ( (resid  62 and name HA   ))     4.14  2.34  0.62
 assign ((resid   8 and name HG1* ))   ( (resid  10 and name HN   ))     4.81  3.01  0.72
 assign ((resid  10 and name HN   ))   ( (resid  22 and name HA   ))     4.11  2.31  0.62
 assign ((resid  11 and name HN   ))   ( (resid  21 and name HN   ))     5.98  4.18  0.90
 assign ((resid  11 and name HN   ))   ( (resid  61 and name HN   ))     6.00  4.20  0.90
 assign ((resid  11 and name HN   ))   ( (resid  58 and name HG2* ))     3.98  2.18  0.60
 assign ((resid  14 and name HN   ))   ( (resid  17 and name HN   ))     3.55  1.75  0.53
 assign ((resid  17 and name HN   ))   ( (resid  19 and name HE*  ))     4.52  2.72  0.68
 assign ((resid  13 and name HG2* ))   ( (resid  17 and name HN   ))     3.62  1.82  0.54
 assign ((resid  12 and name HN   ))   ( (resid  19 and name HN   ))     3.79  1.99  0.57
 assign ((resid  13 and name HA   ))   ( (resid  19 and name HN   ))     3.92  2.12  0.59
 assign ((resid  12 and name HB   ))   ( (resid  19 and name HN   ))     5.37  3.57  0.81
 assign ((resid  10 and name HN   ))   ( (resid  21 and name HN   ))     4.14  2.34  0.62
 assign ((resid  10 and name HB   ))   ( (resid  21 and name HN   ))     4.41  2.61  0.66
 assign ((resid   8 and name HB   ))   ( (resid  23 and name HN   ))     4.05  2.25  0.61
 assign ((resid   8 and name HG1* ))   ( (resid  23 and name HN   ))     4.10  2.30  0.62
 assign ((resid   9 and name HA   ))   ( (resid  23 and name HN   ))     4.09  2.29  0.61
 assign ((resid   8 and name HN   ))   ( (resid  23 and name HN   ))     3.91  2.11  0.59
 assign ((resid  24 and name HN   ))   ( (resid  25 and name HD2* ))     4.66  2.86  0.70
 assign ((resid   7 and name HA   ))   ( (resid  25 and name HN   ))     3.94  2.14  0.59
 assign ((resid   5 and name HA   ))   ( (resid  25 and name HN   ))     5.39  3.59  0.81
 assign ((resid  27 and name HN   ))   ( (resid  33 and name HD2* ))     4.47  2.67  0.67
 assign ((resid  27 and name HB*  ))   ( (resid  29 and name HN   ))     3.97  2.17  0.60
 assign ((resid  29 and name HN   ))   ( (resid  32 and name HB1  ))     4.35  2.55  0.65
 assign ((resid  29 and name HB2  ))   ( (resid  32 and name HN   ))     4.50  2.70  0.68
 assign ((resid  27 and name HB*  ))   ( (resid  32 and name HN   ))     4.56  2.76  0.68
 assign ((resid  27 and name HB*  ))   ( (resid  33 and name HN   ))     3.57  1.77  0.54
 assign ((resid  34 and name HN   ))   ( (resid  80 and name HG2* ))     3.66  1.86  0.55
 assign ((resid  34 and name HN   ))   ( (resid  84 and name HG2* ))     4.79  2.99  0.72
 assign ((resid  36 and name HN   ))   ( (resid  36 and name HG2  ))     3.56  1.76  0.53
 assign ((resid  33 and name HD1* ))   ( (resid  36 and name HN   ))     4.11  2.31  0.62
 assign ((resid  25 and name HD1* ))   ( (resid  36 and name HN   ))     5.36  3.56  0.80
 assign ((resid  33 and name HD1* ))   ( (resid  37 and name HN   ))     3.75  1.95  0.56
 assign ((resid  38 and name HN   ))   ( (resid  88 and name HD1* ))     4.70  2.90  0.70
 assign ((resid  25 and name HD1* ))   ( (resid  40 and name HN   ))     5.04  3.24  0.76
 assign ((resid  42 and name HD21 ))   ( (resid  88 and name HD2* ))     4.13  2.33  0.62
 assign ((resid  42 and name HD22 ))   ( (resid  88 and name HD2* ))     4.13  2.33  0.62
 assign ((resid  12 and name HD1* ))   ( (resid  45 and name HN   ))     5.06  3.26  0.76
 assign ((resid  48 and name HG2* ))   ( (resid  53 and name HN   ))     5.34  3.54  0.80
 assign ((resid  53 and name HN   ))   ( (resid  56 and name HG1* ))     5.67  3.87  0.85
 assign ((resid  13 and name HB   ))   ( (resid  57 and name HN   ))     4.51  2.71  0.68
 assign ((resid  57 and name HN   ))   ( (resid  57 and name HD*  ))     4.90  3.10  0.74
 assign ((resid  56 and name HB   ))   ( (resid  57 and name HN   ))     3.89  2.09  0.58
 assign ((resid  57 and name HN   ))   ( (resid  57 and name HB*  ))     3.67  1.87  0.55
 assign ((resid  13 and name HN   ))   ( (resid  57 and name HN   ))     3.81  2.01  0.57
 assign ((resid  11 and name HB1  ))   ( (resid  59 and name HN   ))     4.21  2.41  0.63
 assign ((resid  12 and name HA   ))   ( (resid  59 and name HN   ))     4.10  2.30  0.62
 assign ((resid  60 and name HN   ))   ( (resid 103 and name HA   ))     4.51  2.71  0.68
 assign ((resid  60 and name HN   ))   ( (resid 102 and name HG1* ))     4.09  2.29  0.61
 assign ((resid   9 and name HB2  ))   ( (resid  61 and name HN   ))     4.47  2.67  0.67
 assign ((resid   9 and name HB1  ))   ( (resid  61 and name HN   ))     4.47  2.67  0.67
 assign ((resid   8 and name HG2* ))   ( (resid  62 and name HN   ))     5.99  4.19  0.90
 assign ((resid  62 and name HN   ))   ( (resid  81 and name HD1* ))     6.00  4.20  0.90
 assign ((resid   8 and name HG2* ))   ( (resid  63 and name HN   ))     4.71  2.91  0.71
 assign ((resid   7 and name HB*  ))   ( (resid  63 and name HN   ))     4.19  2.39  0.63
 assign ((resid  78 and name HN   ))   ( (resid  79 and name HB*  ))     4.55  2.75  0.68
 assign ((resid  79 and name HN   ))   ( (resid  80 and name HB   ))     5.21  3.41  0.78
 assign ((resid  83 and name HN   ))   ( (resid  84 and name HG2* ))     4.67  2.87  0.70
 assign ((resid  80 and name HG2* ))   ( (resid  83 and name HN   ))     4.96  3.16  0.74
 assign ((resid  80 and name HG2* ))   ( (resid  84 and name HN   ))     4.50  2.70  0.68
 assign ((resid  85 and name HN   ))   ( (resid  86 and name HB*  ))     4.49  2.69  0.67
 assign ((resid  81 and name HD2* ))   ( (resid  85 and name HN   ))     4.56  2.76  0.68
 assign ((resid  85 and name HD*  ))   ( (resid  86 and name HN   ))     4.62  2.82  0.69
 assign ((resid  88 and name HN   ))   ( (resid  90 and name HD*  ))     5.10  3.30  0.77
 assign ((resid  87 and name HN   ))   ( (resid  89 and name HN   ))     4.69  2.89  0.70
 assign ((resid  88 and name HN   ))   ( (resid  90 and name HN   ))     3.98  2.18  0.60
 assign ((resid  85 and name HB*  ))   ( (resid  90 and name HN   ))     4.31  2.51  0.65
 assign ((resid  94 and name HN   ))   ( (resid  95 and name HG2* ))     4.60  2.80  0.69
 assign ((resid  96 and name HN   ))   ( (resid 102 and name HG2* ))     4.07  2.27  0.61
 assign ((resid  95 and name HG1* ))   ( (resid  97 and name HE1  ))     3.95  2.15  0.59
 assign ((resid  81 and name HD2* ))   ( (resid  97 and name HE1  ))     5.86  4.06  0.88
 assign ((resid  95 and name HG2* ))   ( (resid  97 and name HE1  ))     6.00  4.20  0.90
 assign ((resid  98 and name HN   ))   ( (resid 101 and name HN   ))     4.52  2.72  0.68
 assign ((resid  98 and name HN   ))   ( (resid 102 and name HA   ))     4.13  2.33  0.62
 assign ((resid  60 and name HN   ))   ( (resid 102 and name HN   ))     4.21  2.41  0.63
 assign ((resid  60 and name HG2* ))   ( (resid 102 and name HN   ))     5.07  3.27  0.76
 assign ((resid  58 and name HG2* ))   ( (resid 104 and name HN   ))     4.26  2.46  0.64
 assign ((resid  58 and name HB   ))   ( (resid 104 and name HN   ))     4.34  2.54  0.65
 assign ((resid  59 and name HA   ))   ( (resid 104 and name HN   ))     4.08  2.28  0.61
 assign ((resid  94 and name HA   ))   ( (resid 105 and name HN   ))     4.09  2.29  0.61
 assign ((resid  94 and name HB2  ))   ( (resid 105 and name HN   ))     4.90  3.10  0.74
 assign ((resid  94 and name HB1  ))   ( (resid 105 and name HN   ))     4.90  3.10  0.74
 assign ((resid  56 and name HG2* ))   ( (resid 106 and name HN   ))     3.80  2.00  0.57
 assign ((resid  56 and name HN   ))   ( (resid 106 and name HN   ))     4.00  2.20  0.60
 assign ((resid  10 and name HN   ))   ( (resid  23 and name HN   ))     4.88  3.08  0.73
 assign ((resid  13 and name HN   ))   ( (resid  58 and name HA   ))     5.32  3.52  0.80
 assign ((resid   7 and name HN   ))   ( (resid  63 and name HN   ))     3.35  1.55  0.50
 assign ((resid  97 and name HA   ))   ( (resid 103 and name HN   ))     4.18  2.38  0.63
 assign ((resid  85 and name HA   ))   ( (resid  90 and name HN   ))     4.88  3.08  0.73
 assign ((resid  86 and name HA   ))   ( (resid  90 and name HN   ))     4.60  2.80  0.69
 assign ((resid   8 and name HN   ))   ( (resid  23 and name HB1  ))     5.06  3.26  0.76
 assign ((resid   9 and name HN   ))   ( (resid  61 and name HB1  ))     4.50  2.70  0.68
 assign ((resid  17 and name HN   ))   ( (resid  17 and name HE*  ))     5.57  3.77  0.84
 assign ((resid  58 and name HN   ))   ( (resid 105 and name HA   ))     4.01  2.21  0.60
 assign ((resid  23 and name HN   ))   ( (resid  23 and name HE*  ))     5.02  3.22  0.75
 assign ((resid  22 and name HG2* ))   ( (resid  24 and name HE22 ))     5.34  3.54  0.80
 assign ((resid  22 and name HG2* ))   ( (resid  24 and name HE21 ))     5.34  3.54  0.80
 assign ((resid   6 and name HN   ))   ( (resid  25 and name HN   ))     4.09  2.29  0.61
 assign ((resid  60 and name HB   ))   ( (resid 102 and name HN   ))     4.98  3.18  0.75
 assign ((resid  56 and name HA   ))   ( (resid  57 and name HN   ))     3.17  1.37  0.48
 assign ((resid  58 and name HN   ))   ( (resid 103 and name HG2* ))     4.43  2.63  0.66
 assign ((resid  58 and name HN   ))   ( (resid 104 and name HG2* ))     5.54  3.74  0.83
 assign ((resid  58 and name HN   ))   ( (resid 104 and name HN   ))     3.95  2.15  0.59
 assign ((resid  11 and name HB2  ))   ( (resid  59 and name HN   ))     4.21  2.41  0.63
 assign ((resid   8 and name HA   ))   ( (resid  63 and name HN   ))     4.65  2.85  0.70
 assign ((resid  41 and name HA   ))   ( (resid  45 and name HN   ))     4.35  2.55  0.65
 assign ((resid  42 and name HA   ))   ( (resid  45 and name HN   ))     3.79  1.99  0.57
 assign ((resid  43 and name HN   ))   ( (resid  45 and name HN   ))     3.82  2.02  0.57
 assign ((resid  77 and name HN   ))   ( (resid  81 and name HD1* ))     5.77  3.97  0.87
 assign ((resid  81 and name HA   ))   ( (resid  85 and name HN   ))     4.70  2.90  0.70
 assign ((resid  89 and name HN   ))   ( (resid  90 and name HD*  ))     4.66  2.86  0.70
 assign ((resid  86 and name HA   ))   ( (resid  89 and name HN   ))     4.05  2.25  0.61
 assign ((resid   7 and name HN   ))   ( (resid  63 and name HB2  ))     4.34  2.54  0.65
 assign ((resid   7 and name HN   ))   ( (resid  63 and name HB1  ))     4.34  2.54  0.65
 assign ((resid   6 and name HB   ))   ( (resid  63 and name HN   ))     4.44  2.64  0.67
 assign ((resid 111 and name HN   ))   ( (resid 112 and name HN   ))     4.74  2.94  0.71
 assign ((resid   6 and name HG2* ))   ( (resid  25 and name HN   ))     4.25  2.45  0.64
 assign ((resid   9 and name HN   ))   ( (resid  61 and name HN   ))     3.84  2.04  0.58
 assign ((resid  78 and name HA   ))   ( (resid  97 and name HE1  ))     4.88  3.08  0.73
 assign ((resid  97 and name HE1  ))   ( (resid 102 and name HG2* ))     4.31  2.51  0.65
 assign ((resid  78 and name HB*  ))   ( (resid  97 and name HE1  ))     5.03  3.23  0.75
 assign ((resid  81 and name HD1* ))   ( (resid  97 and name HE1  ))     5.34  3.54  0.80
 assign ((resid  63 and name HG*  ))   ( (resid  64 and name HN   ))     4.98  3.18  0.75
 assign ((resid   4 and name HA   ))   ( (resid   4 and name HG*  ))     3.46  1.66  0.52
 assign ((resid   4 and name HA   ))   ( (resid   4 and name HD*  ))     3.54  1.74  0.53
 assign ((resid   4 and name HA   ))   ( (resid   4 and name HE*  ))     5.00  3.20  0.75
 assign ((resid   4 and name HB2  ))   ( (resid   4 and name HD*  ))     3.56  1.76  0.53
 assign ((resid   4 and name HB1  ))   ( (resid   4 and name HD*  ))     3.56  1.76  0.53
 assign ((resid  50 and name HB2  ))   ( (resid  50 and name HE*  ))     3.36  1.56  0.50
 assign ((resid   5 and name HB1  ))   ( (resid   5 and name HE*  ))     4.38  2.58  0.66
 assign ((resid   5 and name HA   ))   ( (resid   5 and name HG*  ))     3.95  2.15  0.59
 assign ((resid   5 and name HB2  ))   ( (resid   5 and name HG*  ))     3.01  1.21  0.45
 assign ((resid   5 and name HN   ))   ( (resid   5 and name HD*  ))     4.85  3.05  0.73
 assign ((resid   5 and name HA   ))   ( (resid   5 and name HD*  ))     4.21  2.41  0.63
 assign ((resid   5 and name HG*  ))   ( (resid   5 and name HD*  ))     2.84  1.04  0.43
 assign ((resid   5 and name HA   ))   ( (resid   5 and name HE*  ))     4.75  2.95  0.71
 assign ((resid   5 and name HB2  ))   ( (resid   5 and name HE*  ))     4.38  2.58  0.66
 assign ((resid   5 and name HD*  ))   ( (resid   5 and name HE*  ))     2.88  1.08  0.43
 assign ((resid   6 and name HA   ))   ( (resid   6 and name HG2* ))     3.84  2.04  0.58
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HG1* ))     4.21  2.41  0.63
 assign ((resid   6 and name HA   ))   ( (resid   6 and name HG1* ))     3.67  1.87  0.55
 assign ((resid   7 and name HA   ))   ( (resid   7 and name HG2  ))     3.97  2.17  0.60
 assign ((resid   7 and name HA   ))   ( (resid   7 and name HG1  ))     3.97  2.17  0.60
 assign ((resid   7 and name HB*  ))   ( (resid   7 and name HG2  ))     2.76  0.96  0.41
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HG1  ))     4.62  2.82  0.69
 assign ((resid   7 and name HB*  ))   ( (resid   7 and name HG1  ))     2.76  0.96  0.41
 assign ((resid   8 and name HA   ))   ( (resid   8 and name HG2* ))     3.67  1.87  0.55
 assign ((resid   8 and name HA   ))   ( (resid   8 and name HG1* ))     3.29  1.49  0.49
 assign ((resid   9 and name HA   ))   ( (resid   9 and name HG2  ))     3.96  2.16  0.59
 assign ((resid   9 and name HA   ))   ( (resid   9 and name HG1  ))     3.96  2.16  0.59
 assign ((resid  10 and name HA   ))   ( (resid  10 and name HG1* ))     3.60  1.80  0.54
 assign ((resid  10 and name HN   ))   ( (resid  10 and name HG2* ))     4.04  2.24  0.61
 assign ((resid  10 and name HA   ))   ( (resid  10 and name HG2* ))     3.60  1.80  0.54
 assign ((resid  11 and name HA   ))   ( (resid  11 and name HD*  ))     4.28  2.48  0.64
 assign ((resid  11 and name HB2  ))   ( (resid  11 and name HD*  ))     3.12  1.32  0.47
 assign ((resid  11 and name HB1  ))   ( (resid  11 and name HD*  ))     3.12  1.32  0.47
 assign ((resid  11 and name HA   ))   ( (resid  11 and name HE*  ))     4.60  2.80  0.69
 assign ((resid  11 and name HB2  ))   ( (resid  11 and name HE*  ))     3.60  1.80  0.54
 assign ((resid  11 and name HB1  ))   ( (resid  11 and name HE*  ))     3.60  1.80  0.54
 assign ((resid  11 and name HG2  ))   ( (resid  11 and name HE*  ))     3.44  1.64  0.52
 assign ((resid  11 and name HG1  ))   ( (resid  11 and name HE*  ))     3.44  1.64  0.52
 assign ((resid  11 and name HD*  ))   ( (resid  11 and name HE*  ))     2.87  1.07  0.43
 assign ((resid  12 and name HA   ))   ( (resid  12 and name HD1* ))     4.03  2.23  0.60
 assign ((resid  12 and name HA   ))   ( (resid  12 and name HG2* ))     3.45  1.65  0.52
 assign ((resid  12 and name HG2* ))   ( (resid  12 and name HG11 ))     3.34  1.54  0.50
 assign ((resid  12 and name HA   ))   ( (resid  12 and name HG12 ))     4.16  2.36  0.62
 assign ((resid  12 and name HG2* ))   ( (resid  12 and name HG12 ))     3.34  1.54  0.50
 assign ((resid  12 and name HA   ))   ( (resid  12 and name HG11 ))     4.16  2.36  0.62
 assign ((resid  12 and name HB   ))   ( (resid  12 and name HD1* ))     3.21  1.41  0.48
 assign ((resid  12 and name HG2* ))   ( (resid  12 and name HD1* ))     2.67  0.87  0.40
 assign ((resid  13 and name HN   ))   ( (resid  13 and name HB   ))     3.64  1.84  0.55
 assign ((resid  13 and name HN   ))   ( (resid  13 and name HG2* ))     3.90  2.10  0.59
 assign ((resid  13 and name HA   ))   ( (resid  13 and name HG2* ))     3.32  1.52  0.50
 assign ((resid  17 and name HA   ))   ( (resid  17 and name HG2  ))     4.04  2.24  0.61
 assign ((resid  17 and name HA   ))   ( (resid  17 and name HG1  ))     4.04  2.24  0.61
 assign ((resid  17 and name HA   ))   ( (resid  17 and name HD*  ))     4.10  2.30  0.62
 assign ((resid  17 and name HG2  ))   ( (resid  17 and name HE*  ))     4.00  2.20  0.60
 assign ((resid  17 and name HG1  ))   ( (resid  17 and name HE*  ))     4.00  2.20  0.60
 assign ((resid  17 and name HN   ))   ( (resid  17 and name HD*  ))     4.76  2.96  0.71
 assign ((resid  17 and name HD*  ))   ( (resid  17 and name HE*  ))     2.74  0.94  0.41
 assign ((resid  17 and name HA   ))   ( (resid  17 and name HE*  ))     4.30  2.50  0.65
 assign ((resid  18 and name HA   ))   ( (resid  18 and name HG2* ))     3.52  1.72  0.53
 assign ((resid  19 and name HA   ))   ( (resid  19 and name HE*  ))     5.06  3.26  0.76
 assign ((resid  21 and name HA   ))   ( (resid  21 and name HG2  ))     4.17  2.37  0.63
 assign ((resid  21 and name HA   ))   ( (resid  21 and name HG1  ))     4.17  2.37  0.63
 assign ((resid  21 and name HA   ))   ( (resid  21 and name HD1  ))     4.74  2.94  0.71
 assign ((resid  21 and name HB1  ))   ( (resid  21 and name HD1  ))     3.94  2.14  0.59
 assign ((resid  21 and name HA   ))   ( (resid  21 and name HD2  ))     4.74  2.94  0.71
 assign ((resid  21 and name HB2  ))   ( (resid  21 and name HD2  ))     3.94  2.14  0.59
 assign ((resid  21 and name HB1  ))   ( (resid  21 and name HD2  ))     3.94  2.14  0.59
 assign ((resid  21 and name HB2  ))   ( (resid  21 and name HD1  ))     3.94  2.14  0.59
 assign ((resid  22 and name HA   ))   ( (resid  22 and name HG2* ))     3.32  1.52  0.50
 assign ((resid 107 and name HN   ))   ( (resid 107 and name HG*  ))     4.18  2.38  0.63
 assign ((resid  24 and name HA   ))   ( (resid  24 and name HG2  ))     3.65  1.85  0.55
 assign ((resid  24 and name HA   ))   ( (resid  24 and name HG1  ))     3.65  1.85  0.55
 assign ((resid  25 and name HB2  ))   ( (resid  25 and name HD1* ))     3.37  1.57  0.51
 assign ((resid  25 and name HA   ))   ( (resid  25 and name HG   ))     3.87  2.07  0.58
 assign ((resid   8 and name HG2* ))   ( (resid  25 and name HG   ))     3.41  1.61  0.51
 assign ((resid  25 and name HA   ))   ( (resid  25 and name HD2* ))     2.86  1.06  0.43
 assign ((resid  25 and name HB2  ))   ( (resid  25 and name HD2* ))     3.53  1.73  0.53
 assign ((resid  25 and name HB1  ))   ( (resid  25 and name HD2* ))     3.53  1.73  0.53
 assign ((resid  25 and name HD2* ))   ( (resid  36 and name HD1  ))     4.19  2.39  0.63
 assign ((resid  25 and name HA   ))   ( (resid  25 and name HD1* ))     4.12  2.32  0.62
 assign ((resid  25 and name HB1  ))   ( (resid  25 and name HD1* ))     3.37  1.57  0.51
 assign ((resid   8 and name HG2* ))   ( (resid  25 and name HD1* ))     2.71  0.91  0.41
 assign ((resid  28 and name HN   ))   ( (resid  28 and name HG1* ))     4.37  2.57  0.66
 assign ((resid  28 and name HA   ))   ( (resid  28 and name HG1* ))     2.99  1.19  0.45
 assign ((resid  28 and name HA   ))   ( (resid  28 and name HG2* ))     3.12  1.32  0.47
 assign ((resid  29 and name HA   ))   ( (resid  29 and name HG2  ))     3.85  2.05  0.58
 assign ((resid  29 and name HA   ))   ( (resid  29 and name HG1  ))     3.85  2.05  0.58
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HD*  ))     4.48  2.68  0.67
 assign ((resid  29 and name HA   ))   ( (resid  29 and name HD*  ))     4.26  2.46  0.64
 assign ((resid  29 and name HB2  ))   ( (resid  29 and name HD*  ))     3.26  1.46  0.49
 assign ((resid  29 and name HB1  ))   ( (resid  29 and name HD*  ))     3.26  1.46  0.49
 assign ((resid  29 and name HG2  ))   ( (resid  29 and name HD*  ))     2.94  1.14  0.44
 assign ((resid  29 and name HG1  ))   ( (resid  29 and name HD*  ))     2.94  1.14  0.44
 assign ((resid  31 and name HA   ))   ( (resid  31 and name HG2  ))     4.05  2.25  0.61
 assign ((resid  31 and name HB*  ))   ( (resid  31 and name HG2  ))     2.77  0.97  0.42
 assign ((resid  31 and name HB*  ))   ( (resid  31 and name HG1  ))     2.77  0.97  0.42
 assign ((resid  31 and name HN   ))   ( (resid  31 and name HG2  ))     5.12  3.32  0.77
 assign ((resid  35 and name HB*  ))   ( (resid  35 and name HG1  ))     2.95  1.15  0.44
 assign ((resid  33 and name HA   ))   ( (resid  33 and name HD2* ))     3.35  1.55  0.50
 assign ((resid  33 and name HA   ))   ( (resid  33 and name HD1* ))     2.80  1.00  0.42
 assign ((resid  33 and name HB2  ))   ( (resid  33 and name HD1* ))     3.20  1.40  0.48
 assign ((resid  33 and name HB1  ))   ( (resid  33 and name HD1* ))     3.20  1.40  0.48
 assign ((resid  33 and name HN   ))   ( (resid  33 and name HG   ))     4.82  3.02  0.72
 assign ((resid  33 and name HA   ))   ( (resid  33 and name HG   ))     4.09  2.29  0.61
 assign ((resid  81 and name HB2  ))   ( (resid  81 and name HD1* ))     3.82  2.02  0.57
 assign ((resid  34 and name HA   ))   ( (resid  34 and name HG2  ))     3.73  1.93  0.56
 assign ((resid  34 and name HA   ))   ( (resid  34 and name HG1  ))     3.73  1.93  0.56
 assign ((resid  34 and name HA   ))   ( (resid  37 and name HG   ))     4.36  2.56  0.65
 assign ((resid  34 and name HB2  ))   ( (resid  34 and name HD2  ))     3.99  2.19  0.60
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HB1  ))     3.65  1.85  0.55
 assign ((resid  34 and name HB1  ))   ( (resid  34 and name HD2  ))     3.99  2.19  0.60
 assign ((resid   5 and name HB1  ))   ( (resid   5 and name HG*  ))     3.01  1.21  0.45
 assign ((resid  31 and name HB*  ))   ( (resid  34 and name HD2  ))     5.00  3.20  0.75
 assign ((resid  34 and name HB2  ))   ( (resid  34 and name HD1  ))     3.99  2.19  0.60
 assign ((resid  76 and name HB1  ))   ( (resid  76 and name HD*  ))     3.33  1.53  0.50
 assign ((resid  31 and name HB*  ))   ( (resid  34 and name HD1  ))     5.00  3.20  0.75
 assign ((resid  34 and name HB1  ))   ( (resid  34 and name HD1  ))     3.99  2.19  0.60
 assign ((resid  72 and name HG*  ))   ( (resid  72 and name HD*  ))     2.87  1.07  0.43
 assign ((resid  75 and name HB*  ))   ( (resid  75 and name HE*  ))     3.98  2.18  0.60
 assign ((resid  35 and name HA   ))   ( (resid  35 and name HB*  ))     3.02  1.22  0.45
 assign ((resid  31 and name HA   ))   ( (resid  31 and name HG1  ))     4.05  2.25  0.61
 assign ((resid  35 and name HB*  ))   ( (resid  35 and name HG2  ))     2.95  1.15  0.44
 assign ((resid  36 and name HA   ))   ( (resid  36 and name HG2  ))     3.71  1.91  0.56
 assign ((resid  39 and name HA   ))   ( (resid  39 and name HD*  ))     4.00  2.20  0.60
 assign ((resid  36 and name HN   ))   ( (resid  36 and name HB2  ))     3.72  1.92  0.56
 assign ((resid  36 and name HA   ))   ( (resid  36 and name HG1  ))     3.71  1.91  0.56
 assign ((resid  36 and name HG1  ))   ( (resid  36 and name HE*  ))     3.51  1.71  0.53
 assign ((resid  36 and name HB2  ))   ( (resid  36 and name HD2  ))     3.33  1.53  0.50
 assign ((resid  36 and name HB1  ))   ( (resid  36 and name HD2  ))     3.33  1.53  0.50
 assign ((resid  36 and name HB2  ))   ( (resid  36 and name HD1  ))     3.33  1.53  0.50
 assign ((resid  36 and name HB1  ))   ( (resid  36 and name HD1  ))     3.33  1.53  0.50
 assign ((resid  36 and name HN   ))   ( (resid  36 and name HE*  ))     4.49  2.69  0.67
 assign ((resid  36 and name HA   ))   ( (resid  36 and name HE*  ))     4.98  3.18  0.75
 assign ((resid  36 and name HB2  ))   ( (resid  36 and name HE*  ))     4.32  2.52  0.65
 assign ((resid  36 and name HB1  ))   ( (resid  36 and name HE*  ))     4.32  2.52  0.65
 assign ((resid  36 and name HG2  ))   ( (resid  36 and name HE*  ))     3.51  1.71  0.53
 assign ((resid  37 and name HA   ))   ( (resid  37 and name HG   ))     3.69  1.89  0.55
 assign ((resid  37 and name HA   ))   ( (resid  37 and name HD1* ))     3.96  2.16  0.59
 assign ((resid  37 and name HN   ))   ( (resid  37 and name HB1  ))     3.98  2.18  0.60
 assign ((resid  37 and name HB2  ))   ( (resid  37 and name HD1* ))     3.69  1.89  0.55
 assign ((resid  37 and name HB1  ))   ( (resid  37 and name HD1* ))     3.69  1.89  0.55
 assign ((resid  37 and name HD1* ))   ( (resid  80 and name HG2* ))     2.80  1.00  0.42
 assign ((resid  37 and name HN   ))   ( (resid  37 and name HD2* ))     4.02  2.22  0.60
 assign ((resid  37 and name HA   ))   ( (resid  37 and name HD2* ))     2.99  1.19  0.45
 assign ((resid  37 and name HB2  ))   ( (resid  37 and name HD2* ))     3.55  1.75  0.53
 assign ((resid  37 and name HB1  ))   ( (resid  37 and name HD2* ))     3.55  1.75  0.53
 assign ((resid  38 and name HA   ))   ( (resid  38 and name HG2  ))     3.76  1.96  0.56
 assign ((resid  38 and name HA   ))   ( (resid  38 and name HG1  ))     3.76  1.96  0.56
 assign ((resid  49 and name HB*  ))   ( (resid  49 and name HD*  ))     2.64  0.84  0.40
 assign ((resid  38 and name HA   ))   ( (resid  38 and name HD2  ))     5.16  3.36  0.77
 assign ((resid  38 and name HA   ))   ( (resid  38 and name HD1  ))     5.16  3.36  0.77
 assign ((resid  49 and name HN   ))   ( (resid  49 and name HE*  ))     4.19  2.39  0.63
 assign ((resid  49 and name HB*  ))   ( (resid  49 and name HE*  ))     3.34  1.54  0.50
 assign ((resid  63 and name HB1  ))   ( (resid  63 and name HE*  ))     4.06  2.26  0.61
 assign ((resid  39 and name HA   ))   ( (resid  39 and name HB*  ))     2.67  0.87  0.40
 assign ((resid  39 and name HB*  ))   ( (resid  39 and name HD*  ))     2.65  0.85  0.40
 assign ((resid  39 and name HN   ))   ( (resid  39 and name HG2  ))     4.12  2.32  0.62
 assign ((resid  71 and name HA   ))   ( (resid  71 and name HG1  ))     4.05  2.25  0.61
 assign ((resid  39 and name HG2  ))   ( (resid  39 and name HD*  ))     2.58  0.78  0.39
 assign ((resid  71 and name HG1  ))   ( (resid  71 and name HD*  ))     2.94  1.14  0.44
 assign ((resid  39 and name HG1  ))   ( (resid  39 and name HD*  ))     2.58  0.78  0.39
 assign ((resid  39 and name HD*  ))   ( (resid  39 and name HE*  ))     2.67  0.87  0.40
 assign ((resid  39 and name HA   ))   ( (resid  39 and name HE*  ))     4.38  2.58  0.66
 assign ((resid  50 and name HB1  ))   ( (resid  50 and name HE*  ))     3.36  1.56  0.50
 assign ((resid  40 and name HA   ))   ( (resid  40 and name HG1* ))     3.41  1.61  0.51
 assign ((resid  40 and name HA   ))   ( (resid  40 and name HG2* ))     3.46  1.66  0.52
 assign ((resid  41 and name HA   ))   ( (resid  41 and name HG   ))     3.26  1.46  0.49
 assign ((resid  41 and name HB1  ))   ( (resid  41 and name HD1* ))     3.46  1.66  0.52
 assign ((resid  41 and name HN   ))   ( (resid  41 and name HD2* ))     4.16  2.36  0.62
 assign ((resid  41 and name HA   ))   ( (resid  41 and name HD2* ))     2.98  1.18  0.45
 assign ((resid  41 and name HB2  ))   ( (resid  41 and name HD2* ))     3.35  1.55  0.50
 assign ((resid  41 and name HA   ))   ( (resid  41 and name HD1* ))     3.91  2.11  0.59
 assign ((resid  41 and name HB2  ))   ( (resid  41 and name HD1* ))     3.46  1.66  0.52
 assign ((resid  43 and name HA   ))   ( (resid  43 and name HG2  ))     3.75  1.95  0.56
 assign ((resid  43 and name HA   ))   ( (resid  43 and name HG1  ))     3.75  1.95  0.56
 assign ((resid  44 and name HA   ))   ( (resid  44 and name HG2  ))     4.21  2.41  0.63
 assign ((resid  44 and name HA   ))   ( (resid  44 and name HG1  ))     4.21  2.41  0.63
 assign ((resid  44 and name HA   ))   ( (resid  44 and name HD2  ))     3.84  2.04  0.58
 assign ((resid  44 and name HA   ))   ( (resid  44 and name HD1  ))     3.84  2.04  0.58
 assign ((resid  44 and name HN   ))   ( (resid  44 and name HG2  ))     4.77  2.97  0.72
 assign ((resid  45 and name HA   ))   ( (resid  48 and name HB   ))     3.61  1.81  0.54
 assign ((resid  45 and name HG2  ))   ( (resid  45 and name HE*  ))     3.90  2.10  0.59
 assign ((resid  45 and name HN   ))   ( (resid  45 and name HE*  ))     4.89  3.09  0.73
 assign ((resid  45 and name HG1  ))   ( (resid  45 and name HE*  ))     3.90  2.10  0.59
 assign ((resid  46 and name HN   ))   ( (resid  46 and name HB1  ))     3.73  1.93  0.56
 assign ((resid  44 and name HA   ))   ( (resid  47 and name HD2  ))     4.51  2.71  0.68
 assign ((resid  44 and name HA   ))   ( (resid  47 and name HD1  ))     4.51  2.71  0.68
 assign ((resid  44 and name HA   ))   ( (resid  47 and name HG2  ))     4.10  2.30  0.62
 assign ((resid  44 and name HA   ))   ( (resid  47 and name HG1  ))     4.10  2.30  0.62
 assign ((resid  48 and name HA   ))   ( (resid  48 and name HG2* ))     3.31  1.51  0.50
 assign ((resid  48 and name HA   ))   ( (resid  48 and name HG1* ))     3.92  2.12  0.59
 assign ((resid  48 and name HN   ))   ( (resid  48 and name HB   ))     3.92  2.12  0.59
 assign ((resid  48 and name HN   ))   ( (resid  48 and name HG2* ))     4.05  2.25  0.61
 assign ((resid  48 and name HG2* ))   ( (resid  48 and name HG1* ))     3.13  1.33  0.47
 assign ((resid  48 and name HN   ))   ( (resid  48 and name HD1* ))     4.67  2.87  0.70
 assign ((resid  48 and name HA   ))   ( (resid  48 and name HD1* ))     3.68  1.88  0.55
 assign ((resid  48 and name HG2* ))   ( (resid  48 and name HD1* ))     3.04  1.24  0.46
 assign ((resid  49 and name HA   ))   ( (resid  49 and name HG2  ))     4.11  2.31  0.62
 assign ((resid  49 and name HA   ))   ( (resid  49 and name HG1  ))     4.11  2.31  0.62
 assign ((resid  49 and name HA   ))   ( (resid  49 and name HE*  ))     5.70  3.90  0.86
 assign ((resid  49 and name HN   ))   ( (resid  49 and name HB*  ))     3.20  1.40  0.48
 assign ((resid  35 and name HA   ))   ( (resid  38 and name HG2  ))     4.88  3.08  0.73
 assign ((resid  49 and name HG2  ))   ( (resid  49 and name HD*  ))     2.93  1.13  0.44
 assign ((resid  49 and name HG1  ))   ( (resid  49 and name HD*  ))     2.93  1.13  0.44
 assign ((resid  49 and name HG2  ))   ( (resid  49 and name HE*  ))     3.50  1.70  0.53
 assign ((resid  49 and name HG1  ))   ( (resid  49 and name HE*  ))     3.50  1.70  0.53
 assign ((resid  49 and name HD*  ))   ( (resid  49 and name HE*  ))     2.99  1.19  0.45
 assign ((resid  50 and name HB2  ))   ( (resid  50 and name HD*  ))     3.64  1.84  0.55
 assign ((resid  50 and name HA   ))   ( (resid  50 and name HG2  ))     3.84  2.04  0.58
 assign ((resid  50 and name HG2  ))   ( (resid  50 and name HD*  ))     2.95  1.15  0.44
 assign ((resid  50 and name HG2  ))   ( (resid  50 and name HE*  ))     3.59  1.79  0.54
 assign ((resid  50 and name HA   ))   ( (resid  50 and name HG1  ))     3.84  2.04  0.58
 assign ((resid  50 and name HG1  ))   ( (resid  50 and name HE*  ))     3.59  1.79  0.54
 assign ((resid  50 and name HA   ))   ( (resid  50 and name HD*  ))     3.93  2.13  0.59
 assign ((resid  50 and name HG1  ))   ( (resid  50 and name HD*  ))     2.95  1.15  0.44
 assign ((resid  50 and name HN   ))   ( (resid  50 and name HE*  ))     4.99  3.19  0.75
 assign ((resid  50 and name HE*  ))   ( (resid  51 and name HN   ))     5.36  3.56  0.80
 assign ((resid  68 and name HA   ))   ( (resid  71 and name HE*  ))     4.62  2.82  0.69
 assign ((resid  83 and name HA   ))   ( (resid  83 and name HE*  ))     4.96  3.16  0.74
 assign ((resid  51 and name HA   ))   ( (resid  51 and name HG   ))     3.63  1.83  0.54
 assign ((resid  51 and name HA   ))   ( (resid  51 and name HD2* ))     2.81  1.01  0.42
 assign ((resid  51 and name HB1  ))   ( (resid  51 and name HD1* ))     3.10  1.30  0.47
 assign ((resid  51 and name HB2  ))   ( (resid  51 and name HD2* ))     3.62  1.82  0.54
 assign ((resid  51 and name HB1  ))   ( (resid  51 and name HD2* ))     3.62  1.82  0.54
 assign ((resid  51 and name HN   ))   ( (resid  51 and name HD1* ))     4.36  2.56  0.65
 assign ((resid  51 and name HA   ))   ( (resid  51 and name HD1* ))     4.17  2.37  0.63
 assign ((resid  51 and name HB2  ))   ( (resid  51 and name HD1* ))     3.10  1.30  0.47
 assign ((resid  54 and name HA   ))   ( (resid  54 and name HG1  ))     3.98  2.18  0.60
 assign ((resid  54 and name HA   ))   ( (resid  54 and name HD*  ))     4.00  2.20  0.60
 assign ((resid  54 and name HB2  ))   ( (resid  54 and name HD*  ))     3.55  1.75  0.53
 assign ((resid  54 and name HB1  ))   ( (resid  54 and name HD*  ))     3.55  1.75  0.53
 assign ((resid  54 and name HA   ))   ( (resid  54 and name HG2  ))     3.98  2.18  0.60
 assign ((resid  54 and name HG2  ))   ( (resid  54 and name HE*  ))     3.26  1.46  0.49
 assign ((resid  54 and name HD*  ))   ( (resid  54 and name HE*  ))     2.58  0.78  0.39
 assign ((resid  83 and name HD*  ))   ( (resid  83 and name HE*  ))     2.77  0.97  0.42
 assign ((resid  39 and name HB*  ))   ( (resid  39 and name HE*  ))     4.06  2.26  0.61
 assign ((resid  54 and name HG1  ))   ( (resid  54 and name HE*  ))     3.26  1.46  0.49
 assign ((resid  55 and name HA   ))   ( (resid  55 and name HG2  ))     3.94  2.14  0.59
 assign ((resid  55 and name HA   ))   ( (resid  55 and name HG1  ))     3.94  2.14  0.59
 assign ((resid  55 and name HA   ))   ( (resid  55 and name HD*  ))     5.00  3.20  0.75
 assign ((resid  55 and name HB2  ))   ( (resid  55 and name HD*  ))     3.44  1.64  0.52
 assign ((resid  55 and name HB1  ))   ( (resid  55 and name HD*  ))     3.44  1.64  0.52
 assign ((resid  56 and name HA   ))   ( (resid  56 and name HG1* ))     3.01  1.21  0.45
 assign ((resid  56 and name HN   ))   ( (resid  56 and name HG1* ))     3.86  2.06  0.58
 assign ((resid  56 and name HA   ))   ( (resid  56 and name HG2* ))     3.80  2.00  0.57
 assign ((resid  57 and name HA   ))   ( (resid  57 and name HD*  ))     4.74  2.94  0.71
 assign ((resid  57 and name HB*  ))   ( (resid  57 and name HD*  ))     3.37  1.57  0.51
 assign ((resid  58 and name HA   ))   ( (resid  58 and name HG2* ))     3.57  1.77  0.54
 assign ((resid  58 and name HG2* ))   ( (resid  58 and name HD1* ))     2.76  0.96  0.41
 assign ((resid  12 and name HD1* ))   ( (resid  58 and name HG12 ))     3.98  2.18  0.60
 assign ((resid  12 and name HD1* ))   ( (resid  58 and name HG11 ))     3.98  2.18  0.60
 assign ((resid  58 and name HA   ))   ( (resid  58 and name HD1* ))     4.35  2.55  0.65
 assign ((resid  58 and name HB   ))   ( (resid  58 and name HD1* ))     3.65  1.85  0.55
 assign ((resid  12 and name HD1* ))   ( (resid  58 and name HD1* ))     3.03  1.23  0.45
 assign ((resid  60 and name HA   ))   ( (resid  60 and name HG2* ))     3.43  1.63  0.51
 assign ((resid  60 and name HA   ))   ( (resid  60 and name HG12 ))     4.17  2.37  0.63
 assign ((resid  60 and name HA   ))   ( (resid  60 and name HG11 ))     4.17  2.37  0.63
 assign ((resid  60 and name HA   ))   ( (resid  60 and name HD1* ))     3.96  2.16  0.59
 assign ((resid   9 and name HN   ))   ( (resid  60 and name HG2* ))     4.59  2.79  0.69
 assign ((resid  60 and name HG2* ))   ( (resid  60 and name HG11 ))     3.75  1.95  0.56
 assign ((resid  60 and name HG2* ))   ( (resid  60 and name HD1* ))     2.40  0.60  0.36
 assign ((resid  60 and name HG2* ))   ( (resid  60 and name HG12 ))     3.75  1.95  0.56
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HD1* ))     4.03  2.23  0.60
 assign ((resid  60 and name HB   ))   ( (resid  60 and name HD1* ))     3.14  1.34  0.47
 assign ((resid  58 and name HG2* ))   ( (resid  60 and name HD1* ))     2.55  0.75  0.38
 assign ((resid  61 and name HA   ))   ( (resid  61 and name HG*  ))     4.03  2.23  0.60
 assign ((resid  61 and name HA   ))   ( (resid  61 and name HD*  ))     4.27  2.47  0.64
 assign ((resid  61 and name HB2  ))   ( (resid  61 and name HD*  ))     3.60  1.80  0.54
 assign ((resid  61 and name HB1  ))   ( (resid  61 and name HD*  ))     3.60  1.80  0.54
 assign ((resid  62 and name HA   ))   ( (resid  62 and name HG1* ))     3.82  2.02  0.57
 assign ((resid  62 and name HA   ))   ( (resid  62 and name HG2* ))     3.65  1.85  0.55
 assign ((resid  63 and name HA   ))   ( (resid  63 and name HD*  ))     4.89  3.09  0.73
 assign ((resid  63 and name HN   ))   ( (resid  63 and name HG*  ))     4.11  2.31  0.62
 assign ((resid  63 and name HA   ))   ( (resid  63 and name HG*  ))     3.97  2.17  0.60
 assign ((resid  63 and name HN   ))   ( (resid  63 and name HD*  ))     4.78  2.98  0.72
 assign ((resid  63 and name HN   ))   ( (resid  63 and name HE*  ))     6.00  4.20  0.90
 assign ((resid  63 and name HA   ))   ( (resid  63 and name HE*  ))     4.70  2.90  0.70
 assign ((resid  63 and name HD*  ))   ( (resid  63 and name HE*  ))     2.72  0.92  0.41
 assign ((resid  75 and name HG2  ))   ( (resid  75 and name HE*  ))     3.77  1.97  0.57
 assign ((resid  69 and name HA   ))   ( (resid  69 and name HG*  ))     3.31  1.51  0.50
 assign ((resid  69 and name HB2  ))   ( (resid  69 and name HG*  ))     2.83  1.03  0.42
 assign ((resid  70 and name HB*  ))   ( (resid  70 and name HG2  ))     2.85  1.05  0.43
 assign ((resid  70 and name HA   ))   ( (resid  73 and name HG1  ))     4.92  3.12  0.74
 assign ((resid  70 and name HA   ))   ( (resid  73 and name HG2  ))     4.92  3.12  0.74
 assign ((resid  69 and name HB1  ))   ( (resid  69 and name HG*  ))     2.83  1.03  0.42
 assign ((resid  70 and name HB*  ))   ( (resid  70 and name HG1  ))     2.85  1.05  0.43
 assign ((resid  71 and name HA   ))   ( (resid  71 and name HG2  ))     4.05  2.25  0.61
 assign ((resid  71 and name HA   ))   ( (resid  71 and name HD*  ))     4.38  2.58  0.66
 assign ((resid  71 and name HB*  ))   ( (resid  71 and name HD*  ))     2.72  0.92  0.41
 assign ((resid  54 and name HG1  ))   ( (resid  54 and name HD*  ))     2.76  0.96  0.41
 assign ((resid  71 and name HG2  ))   ( (resid  71 and name HD*  ))     2.94  1.14  0.44
 assign ((resid  54 and name HG2  ))   ( (resid  54 and name HD*  ))     2.76  0.96  0.41
 assign ((resid  71 and name HD*  ))   ( (resid  71 and name HE*  ))     2.73  0.93  0.41
 assign ((resid  71 and name HA   ))   ( (resid  71 and name HE*  ))     6.00  4.20  0.90
 assign ((resid  72 and name HA   ))   ( (resid  72 and name HB*  ))     2.73  0.93  0.41
 assign ((resid  72 and name HA   ))   ( (resid  72 and name HG*  ))     3.26  1.46  0.49
 assign ((resid  72 and name HA   ))   ( (resid  72 and name HD*  ))     4.25  2.45  0.64
 assign ((resid  72 and name HA   ))   ( (resid  72 and name HE*  ))     4.08  2.28  0.61
 assign ((resid  71 and name HB*  ))   ( (resid  71 and name HE*  ))     4.07  2.27  0.61
 assign ((resid  72 and name HB*  ))   ( (resid  72 and name HE*  ))     4.30  2.50  0.65
 assign ((resid   4 and name HG*  ))   ( (resid   4 and name HE*  ))     2.81  1.01  0.42
 assign ((resid  72 and name HG*  ))   ( (resid  72 and name HE*  ))     3.22  1.42  0.48
 assign ((resid   4 and name HD*  ))   ( (resid   4 and name HE*  ))     2.72  0.92  0.41
 assign ((resid  73 and name HN   ))   ( (resid  73 and name HG2  ))     4.83  3.03  0.72
 assign ((resid  73 and name HN   ))   ( (resid  73 and name HG1  ))     4.83  3.03  0.72
 assign ((resid  67 and name HA   ))   ( (resid  70 and name HG2  ))     4.26  2.46  0.64
 assign ((resid  74 and name HB*  ))   ( (resid  75 and name HA   ))     4.39  2.59  0.66
 assign ((resid  75 and name HN   ))   ( (resid  75 and name HB*  ))     4.19  2.39  0.63
 assign ((resid  75 and name HA   ))   ( (resid  75 and name HG2  ))     4.22  2.42  0.63
 assign ((resid  75 and name HA   ))   ( (resid  75 and name HG1  ))     4.22  2.42  0.63
 assign ((resid  75 and name HA   ))   ( (resid  75 and name HD*  ))     4.09  2.29  0.61
 assign ((resid  75 and name HB*  ))   ( (resid  75 and name HD*  ))     2.74  0.94  0.41
 assign ((resid  63 and name HG*  ))   ( (resid  63 and name HD*  ))     2.75  0.95  0.41
 assign ((resid  75 and name HA   ))   ( (resid  75 and name HE*  ))     4.95  3.15  0.74
 assign ((resid  63 and name HB2  ))   ( (resid  63 and name HE*  ))     4.06  2.26  0.61
 assign ((resid  63 and name HG*  ))   ( (resid  63 and name HE*  ))     3.17  1.37  0.48
 assign ((resid  75 and name HG1  ))   ( (resid  75 and name HE*  ))     3.77  1.97  0.57
 assign ((resid  75 and name HD*  ))   ( (resid  75 and name HE*  ))     2.78  0.98  0.42
 assign ((resid  76 and name HA   ))   ( (resid  76 and name HE*  ))     5.37  3.57  0.81
 assign ((resid  76 and name HB2  ))   ( (resid  76 and name HD*  ))     3.33  1.53  0.50
 assign ((resid  76 and name HB2  ))   ( (resid  76 and name HE*  ))     4.46  2.66  0.67
 assign ((resid  76 and name HN   ))   ( (resid  76 and name HG2  ))     4.55  2.75  0.68
 assign ((resid  76 and name HA   ))   ( (resid  76 and name HG2  ))     3.99  2.19  0.60
 assign ((resid   4 and name HG*  ))   ( (resid   4 and name HD*  ))     2.59  0.79  0.39
 assign ((resid  76 and name HN   ))   ( (resid  76 and name HG1  ))     4.55  2.75  0.68
 assign ((resid  76 and name HA   ))   ( (resid  76 and name HG1  ))     3.99  2.19  0.60
 assign ((resid  76 and name HN   ))   ( (resid  76 and name HD*  ))     4.71  2.91  0.71
 assign ((resid  76 and name HA   ))   ( (resid  76 and name HD*  ))     4.36  2.56  0.65
 assign ((resid  72 and name HB*  ))   ( (resid  72 and name HD*  ))     3.10  1.30  0.47
 assign ((resid  76 and name HB1  ))   ( (resid  76 and name HE*  ))     4.46  2.66  0.67
 assign ((resid   5 and name HG*  ))   ( (resid   5 and name HE*  ))     3.32  1.52  0.50
 assign ((resid  77 and name HA   ))   ( (resid  77 and name HD*  ))     3.93  2.13  0.59
 assign ((resid  80 and name HA   ))   ( (resid  80 and name HG12 ))     3.81  2.01  0.57
 assign ((resid  80 and name HA   ))   ( (resid  80 and name HD1* ))     3.59  1.79  0.54
 assign ((resid  80 and name HN   ))   ( (resid  80 and name HB   ))     3.80  2.00  0.57
 assign ((resid  80 and name HB   ))   ( (resid  80 and name HD1* ))     3.57  1.77  0.54
 assign ((resid  80 and name HA   ))   ( (resid  80 and name HG2* ))     3.22  1.42  0.48
 assign ((resid  80 and name HG2* ))   ( (resid  80 and name HD1* ))     2.55  0.75  0.38
 assign ((resid  80 and name HA   ))   ( (resid  80 and name HG11 ))     3.81  2.01  0.57
 assign ((resid  81 and name HA   ))   ( (resid  81 and name HG   ))     4.17  2.37  0.63
 assign ((resid  81 and name HA   ))   ( (resid  81 and name HD2* ))     3.32  1.52  0.50
 assign ((resid  81 and name HB2  ))   ( (resid  81 and name HD2* ))     3.67  1.87  0.55
 assign ((resid  41 and name HB1  ))   ( (resid  42 and name HN   ))     4.01  2.21  0.60
 assign ((resid  41 and name HB1  ))   ( (resid  41 and name HD2* ))     3.35  1.55  0.50
 assign ((resid  81 and name HA   ))   ( (resid  81 and name HD1* ))     3.94  2.14  0.59
 assign ((resid  81 and name HB1  ))   ( (resid  81 and name HD1* ))     3.82  2.02  0.57
 assign ((resid 108 and name HD2* ))   ( (resid 109 and name HN   ))     4.31  2.51  0.65
 assign ((resid  81 and name HB1  ))   ( (resid  81 and name HD2* ))     3.67  1.87  0.55
 assign ((resid  83 and name HA   ))   ( (resid  83 and name HD*  ))     4.00  2.20  0.60
 assign ((resid  83 and name HA   ))   ( (resid  83 and name HB*  ))     2.76  0.96  0.41
 assign ((resid  50 and name HB1  ))   ( (resid  50 and name HD*  ))     3.64  1.84  0.55
 assign ((resid  83 and name HB*  ))   ( (resid  83 and name HD*  ))     2.58  0.78  0.39
 assign ((resid  83 and name HA   ))   ( (resid  83 and name HG2  ))     3.93  2.13  0.59
 assign ((resid  83 and name HG2  ))   ( (resid  83 and name HE*  ))     3.58  1.78  0.54
 assign ((resid  83 and name HA   ))   ( (resid  83 and name HG1  ))     3.93  2.13  0.59
 assign ((resid  83 and name HG1  ))   ( (resid  83 and name HD*  ))     2.55  0.75  0.38
 assign ((resid  83 and name HG1  ))   ( (resid  83 and name HE*  ))     3.58  1.78  0.54
 assign ((resid  83 and name HG2  ))   ( (resid  83 and name HD*  ))     2.55  0.75  0.38
 assign ((resid  84 and name HA   ))   ( (resid  84 and name HG1* ))     3.52  1.72  0.53
 assign ((resid  84 and name HA   ))   ( (resid  84 and name HG2* ))     3.23  1.43  0.48
 assign ((resid  84 and name HN   ))   ( (resid  84 and name HG1* ))     3.98  2.18  0.60
 assign ((resid  85 and name HA   ))   ( (resid  85 and name HD*  ))     3.74  1.94  0.56
 assign ((resid  87 and name HA   ))   ( (resid  87 and name HG2  ))     3.39  1.59  0.51
 assign ((resid  87 and name HA   ))   ( (resid  87 and name HG1  ))     3.39  1.59  0.51
 assign ((resid  88 and name HA   ))   ( (resid  88 and name HD1* ))     3.93  2.13  0.59
 assign ((resid  88 and name HB1  ))   ( (resid  88 and name HD2* ))     3.97  2.17  0.60
 assign ((resid  88 and name HB2  ))   ( (resid  88 and name HD1* ))     3.43  1.63  0.51
 assign ((resid  88 and name HB1  ))   ( (resid  88 and name HD1* ))     3.43  1.63  0.51
 assign ((resid  88 and name HA   ))   ( (resid  88 and name HD2* ))     2.93  1.13  0.44
 assign ((resid  88 and name HB2  ))   ( (resid  88 and name HD2* ))     3.97  2.17  0.60
 assign ((resid  90 and name HN   ))   ( (resid  90 and name HE*  ))     5.35  3.55  0.80
 assign ((resid  95 and name HA   ))   ( (resid  95 and name HG1* ))     3.85  2.05  0.58
 assign ((resid  95 and name HA   ))   ( (resid  95 and name HG2* ))     3.74  1.94  0.56
 assign ((resid  96 and name HN   ))   ( (resid  96 and name HG2* ))     3.90  2.10  0.59
 assign ((resid  96 and name HA   ))   ( (resid  96 and name HG2* ))     3.32  1.52  0.50
 assign ((resid 101 and name HA   ))   ( (resid 101 and name HG2* ))     3.29  1.49  0.49
 assign ((resid 102 and name HA   ))   ( (resid 102 and name HG2* ))     4.11  2.31  0.62
 assign ((resid 102 and name HN   ))   ( (resid 102 and name HG1* ))     3.40  1.60  0.51
 assign ((resid 103 and name HA   ))   ( (resid 103 and name HG2* ))     3.69  1.89  0.55
 assign ((resid 104 and name HA   ))   ( (resid 104 and name HG1* ))     4.19  2.39  0.63
 assign ((resid 104 and name HA   ))   ( (resid 104 and name HG2* ))     4.14  2.34  0.62
 assign ((resid 102 and name HG2* ))   ( (resid 104 and name HG2* ))     2.97  1.17  0.45
 assign ((resid 105 and name HN   ))   ( (resid 105 and name HB2  ))     4.18  2.38  0.63
 assign ((resid  45 and name HE*  ))   ( (resid  48 and name HB   ))     3.02  1.22  0.45
 assign ((resid 107 and name HA   ))   ( (resid 107 and name HG*  ))     3.56  1.76  0.53
 assign ((resid 107 and name HB2  ))   ( (resid 107 and name HG*  ))     2.88  1.08  0.43
 assign ((resid 107 and name HB1  ))   ( (resid 107 and name HG*  ))     2.88  1.08  0.43
 assign ((resid 108 and name HN   ))   ( (resid 108 and name HG   ))     4.35  2.55  0.65
 assign ((resid 108 and name HB*  ))   ( (resid 108 and name HG   ))     2.40  0.60  0.36
 assign ((resid 108 and name HN   ))   ( (resid 108 and name HD1* ))     4.47  2.67  0.67
 assign ((resid 108 and name HA   ))   ( (resid 108 and name HD1* ))     3.94  2.14  0.59
 assign ((resid 108 and name HB*  ))   ( (resid 108 and name HD1* ))     3.02  1.22  0.45
 assign ((resid 108 and name HN   ))   ( (resid 108 and name HD2* ))     4.60  2.80  0.69
 assign ((resid 108 and name HD2* ))   ( (resid 110 and name HN   ))     5.05  3.25  0.76
 assign ((resid 108 and name HA   ))   ( (resid 108 and name HD2* ))     3.56  1.76  0.53
 assign ((resid 108 and name HB*  ))   ( (resid 108 and name HD2* ))     3.10  1.30  0.47
 assign ((resid 109 and name HA   ))   ( (resid 109 and name HG*  ))     3.51  1.71  0.53
 assign ((resid 109 and name HB2  ))   ( (resid 109 and name HG*  ))     2.93  1.13  0.44
 assign ((resid 109 and name HB1  ))   ( (resid 109 and name HG*  ))     2.93  1.13  0.44
 assign ((resid 111 and name HA   ))   ( (resid 111 and name HG1* ))     3.46  1.66  0.52
 assign ((resid 111 and name HN   ))   ( (resid 111 and name HB   ))     3.98  2.18  0.60
 assign ((resid 111 and name HN   ))   ( (resid 111 and name HG1* ))     4.23  2.43  0.63
 assign ((resid 111 and name HA   ))   ( (resid 111 and name HG2* ))     3.46  1.66  0.52
 assign ((resid 113 and name HA   ))   ( (resid 113 and name HG   ))     3.73  1.93  0.56
 assign ((resid 113 and name HA   ))   ( (resid 113 and name HD1* ))     4.09  2.29  0.61
 assign ((resid 113 and name HA   ))   ( (resid 113 and name HD2* ))     2.89  1.09  0.43
 assign ((resid 113 and name HB1  ))   ( (resid 113 and name HD1* ))     3.28  1.48  0.49
 assign ((resid 113 and name HB2  ))   ( (resid 113 and name HD1* ))     3.28  1.48  0.49
 assign ((resid 113 and name HB2  ))   ( (resid 113 and name HD2* ))     3.27  1.47  0.49
 assign ((resid 113 and name HB1  ))   ( (resid 113 and name HD2* ))     3.27  1.47  0.49
 assign ((resid 114 and name HA   ))   ( (resid 114 and name HB*  ))     2.74  0.94  0.41
 assign ((resid 114 and name HA   ))   ( (resid 114 and name HG2  ))     4.06  2.26  0.61
 assign ((resid 114 and name HB*  ))   ( (resid 114 and name HG2  ))     2.85  1.05  0.43
 assign ((resid 114 and name HA   ))   ( (resid 114 and name HG1  ))     4.06  2.26  0.61
 assign ((resid 114 and name HB*  ))   ( (resid 114 and name HG1  ))     2.85  1.05  0.43
 assign ((resid   4 and name HB1  ))   ( (resid   5 and name HN   ))     4.17  2.37  0.63
 assign ((resid   5 and name HB2  ))   ( (resid   6 and name HN   ))     4.74  2.94  0.71
 assign ((resid   5 and name HB1  ))   ( (resid   6 and name HN   ))     4.74  2.94  0.71
 assign ((resid   6 and name HG1* ))   ( (resid   7 and name HN   ))     4.07  2.27  0.61
 assign ((resid   7 and name HB*  ))   ( (resid   8 and name HN   ))     4.40  2.60  0.66
 assign ((resid   7 and name HG2  ))   ( (resid   8 and name HN   ))     4.69  2.89  0.70
 assign ((resid   9 and name HG2  ))   ( (resid  10 and name HN   ))     4.77  2.97  0.72
 assign ((resid  10 and name HB   ))   ( (resid  11 and name HN   ))     4.43  2.63  0.66
 assign ((resid  11 and name HB1  ))   ( (resid  12 and name HN   ))     4.75  2.95  0.71
 assign ((resid  12 and name HG2* ))   ( (resid  19 and name HN   ))     3.78  1.98  0.57
 assign ((resid  17 and name HE*  ))   ( (resid  18 and name HN   ))     3.94  2.14  0.59
 assign ((resid  20 and name HG1  ))   ( (resid  21 and name HN   ))     4.91  3.11  0.74
 assign ((resid  25 and name HD2* ))   ( (resid  26 and name HN   ))     5.76  3.96  0.86
 assign ((resid  28 and name HG2* ))   ( (resid  29 and name HN   ))     4.04  2.24  0.61
 assign ((resid  31 and name HG2  ))   ( (resid  32 and name HN   ))     4.69  2.89  0.70
 assign ((resid  33 and name HG   ))   ( (resid  34 and name HN   ))     5.34  3.54  0.80
 assign ((resid  33 and name HD2* ))   ( (resid  36 and name HN   ))     5.89  4.09  0.88
 assign ((resid  43 and name HN   ))   ( (resid  43 and name HB2  ))     4.13  2.33  0.62
 assign ((resid  35 and name HG2  ))   ( (resid  36 and name HN   ))     4.42  2.62  0.66
 assign ((resid  36 and name HG2  ))   ( (resid  37 and name HN   ))     4.58  2.78  0.69
 assign ((resid  37 and name HG   ))   ( (resid  38 and name HN   ))     4.92  3.12  0.74
 assign ((resid  37 and name HD2* ))   ( (resid  38 and name HN   ))     4.86  3.06  0.73
 assign ((resid  38 and name HB1  ))   ( (resid  39 and name HN   ))     3.68  1.88  0.55
 assign ((resid  39 and name HG2  ))   ( (resid  40 and name HN   ))     4.83  3.03  0.72
 assign ((resid  39 and name HG1  ))   ( (resid  40 and name HN   ))     4.83  3.03  0.72
 assign ((resid  40 and name HG2* ))   ( (resid  41 and name HN   ))     4.19  2.39  0.63
 assign ((resid  41 and name HD2* ))   ( (resid  42 and name HN   ))     4.69  2.89  0.70
 assign ((resid  41 and name HD1* ))   ( (resid  42 and name HN   ))     4.91  3.11  0.74
 assign ((resid  42 and name HB2  ))   ( (resid  43 and name HN   ))     4.19  2.39  0.63
 assign ((resid  43 and name HG2  ))   ( (resid  44 and name HN   ))     5.15  3.35  0.77
 assign ((resid  43 and name HG1  ))   ( (resid  44 and name HN   ))     5.15  3.35  0.77
 assign ((resid  47 and name HD2  ))   ( (resid  48 and name HN   ))     4.71  2.91  0.71
 assign ((resid  47 and name HD1  ))   ( (resid  48 and name HN   ))     4.71  2.91  0.71
 assign ((resid  47 and name HG2  ))   ( (resid  48 and name HN   ))     4.45  2.65  0.67
 assign ((resid  47 and name HG1  ))   ( (resid  48 and name HN   ))     4.45  2.65  0.67
 assign ((resid  48 and name HG1* ))   ( (resid  49 and name HN   ))     5.31  3.51  0.80
 assign ((resid  48 and name HD1* ))   ( (resid  49 and name HN   ))     5.35  3.55  0.80
 assign ((resid  50 and name HN   ))   ( (resid  50 and name HB2  ))     4.07  2.27  0.61
 assign ((resid  50 and name HN   ))   ( (resid  50 and name HB1  ))     4.07  2.27  0.61
 assign ((resid  50 and name HN   ))   ( (resid  50 and name HG2  ))     4.85  3.05  0.73
 assign ((resid  50 and name HG1  ))   ( (resid  51 and name HN   ))     5.65  3.85  0.85
 assign ((resid  51 and name HD2* ))   ( (resid  52 and name HN   ))     4.66  2.86  0.70
 assign ((resid  55 and name HD*  ))   ( (resid  56 and name HN   ))     4.84  3.04  0.73
 assign ((resid  57 and name HD*  ))   ( (resid  58 and name HN   ))     5.24  3.44  0.79
 assign ((resid  59 and name HB2  ))   ( (resid  60 and name HN   ))     4.50  2.70  0.68
 assign ((resid  62 and name HB   ))   ( (resid  63 and name HN   ))     4.77  2.97  0.72
 assign ((resid  62 and name HG1* ))   ( (resid  63 and name HN   ))     3.91  2.11  0.59
 assign ((resid  67 and name HN   ))   ( (resid  67 and name HB*  ))     4.18  2.38  0.63
 assign ((resid  68 and name HB*  ))   ( (resid  69 and name HN   ))     3.60  1.80  0.54
 assign ((resid  74 and name HB*  ))   ( (resid  75 and name HN   ))     4.47  2.67  0.67
 assign ((resid  76 and name HG2  ))   ( (resid  77 and name HN   ))     5.09  3.29  0.76
 assign ((resid  76 and name HG1  ))   ( (resid  77 and name HN   ))     5.09  3.29  0.76
 assign ((resid  80 and name HG2* ))   ( (resid  81 and name HN   ))     4.08  2.28  0.61
 assign ((resid  80 and name HD1* ))   ( (resid  81 and name HN   ))     4.49  2.69  0.67
 assign ((resid  84 and name HG2* ))   ( (resid  85 and name HN   ))     4.05  2.25  0.61
 assign ((resid  84 and name HG1* ))   ( (resid  85 and name HN   ))     4.08  2.28  0.61
 assign ((resid  87 and name HG2  ))   ( (resid  88 and name HN   ))     5.42  3.62  0.81
 assign ((resid 101 and name HB   ))   ( (resid 102 and name HN   ))     4.53  2.73  0.68
 assign ((resid 101 and name HG2* ))   ( (resid 102 and name HN   ))     3.52  1.72  0.53
 assign ((resid 103 and name HG2* ))   ( (resid 104 and name HN   ))     3.47  1.67  0.52
 assign ((resid 104 and name HB   ))   ( (resid 105 and name HN   ))     4.89  3.09  0.73
 assign ((resid 105 and name HB1  ))   ( (resid 106 and name HN   ))     4.23  2.43  0.63
 assign ((resid 108 and name HB*  ))   ( (resid 109 and name HN   ))     3.86  2.06  0.58
 assign ((resid 108 and name HD1* ))   ( (resid 109 and name HN   ))     4.38  2.58  0.66
 assign ((resid 109 and name HA   ))   ( (resid 110 and name HN   ))     3.40  1.60  0.51
 assign ((resid 113 and name HG   ))   ( (resid 114 and name HN   ))     4.93  3.13  0.74
 assign ((resid  30 and name HA   ))   ( (resid  32 and name HN   ))     4.68  2.88  0.70
 assign ((resid  30 and name HA   ))   ( (resid  33 and name HN   ))     3.77  1.97  0.57
 assign ((resid  30 and name HA   ))   ( (resid  33 and name HB2  ))     3.89  2.09  0.58
 assign ((resid  30 and name HA   ))   ( (resid  33 and name HB1  ))     3.89  2.09  0.58
 assign ((resid  30 and name HA   ))   ( (resid  34 and name HN   ))     5.28  3.48  0.79
 assign ((resid  31 and name HA   ))   ( (resid  33 and name HN   ))     4.23  2.43  0.63
 assign ((resid  34 and name HB2  ))   ( (resid  35 and name HA   ))     4.82  3.02  0.72
 assign ((resid  31 and name HA   ))   ( (resid  31 and name HB*  ))     2.72  0.92  0.41
 assign ((resid  34 and name HB1  ))   ( (resid  35 and name HA   ))     4.82  3.02  0.72
 assign ((resid  32 and name HA   ))   ( (resid  34 and name HN   ))     4.19  2.39  0.63
 assign ((resid  32 and name HA   ))   ( (resid  35 and name HB*  ))     5.12  3.32  0.77
 assign ((resid  33 and name HA   ))   ( (resid  35 and name HN   ))     4.92  3.12  0.74
 assign ((resid  33 and name HA   ))   ( (resid  37 and name HN   ))     4.43  2.63  0.66
 assign ((resid  34 and name HA   ))   ( (resid  37 and name HB2  ))     4.36  2.56  0.65
 assign ((resid  34 and name HA   ))   ( (resid  37 and name HB1  ))     4.36  2.56  0.65
 assign ((resid  34 and name HA   ))   ( (resid  38 and name HN   ))     4.91  3.11  0.74
 assign ((resid  35 and name HA   ))   ( (resid  37 and name HN   ))     4.64  2.84  0.70
 assign ((resid  49 and name HA   ))   ( (resid  49 and name HB*  ))     2.86  1.06  0.43
 assign ((resid  36 and name HA   ))   ( (resid  38 and name HN   ))     4.79  2.99  0.72
 assign ((resid  37 and name HA   ))   ( (resid  40 and name HB   ))     3.65  1.85  0.55
 assign ((resid  39 and name HA   ))   ( (resid  41 and name HN   ))     4.87  3.07  0.73
 assign ((resid  39 and name HA   ))   ( (resid  42 and name HB2  ))     4.23  2.43  0.63
 assign ((resid  39 and name HA   ))   ( (resid  42 and name HB1  ))     4.23  2.43  0.63
 assign ((resid  40 and name HA   ))   ( (resid  43 and name HB2  ))     4.30  2.50  0.65
 assign ((resid  40 and name HA   ))   ( (resid  43 and name HB1  ))     4.30  2.50  0.65
 assign ((resid  40 and name HA   ))   ( (resid  44 and name HN   ))     4.86  3.06  0.73
 assign ((resid  41 and name HA   ))   ( (resid  44 and name HN   ))     3.99  2.19  0.60
 assign ((resid  41 and name HA   ))   ( (resid  44 and name HB2  ))     4.18  2.38  0.63
 assign ((resid  41 and name HA   ))   ( (resid  44 and name HB1  ))     4.18  2.38  0.63
 assign ((resid  42 and name HA   ))   ( (resid  44 and name HN   ))     5.10  3.30  0.77
 assign ((resid  46 and name HA   ))   ( (resid  49 and name HB*  ))     4.64  2.84  0.70
 assign ((resid  47 and name HA   ))   ( (resid  50 and name HB2  ))     3.63  1.83  0.54
 assign ((resid  47 and name HA   ))   ( (resid  50 and name HB1  ))     3.63  1.83  0.54
 assign ((resid  48 and name HA   ))   ( (resid  50 and name HN   ))     4.94  3.14  0.74
 assign ((resid  68 and name HA   ))   ( (resid  71 and name HN   ))     5.23  3.43  0.78
 assign ((resid  68 and name HA   ))   ( (resid  71 and name HB*  ))     5.09  3.29  0.76
 assign ((resid  69 and name HA   ))   ( (resid  71 and name HN   ))     5.24  3.44  0.79
 assign ((resid  69 and name HA   ))   ( (resid  72 and name HB*  ))     3.79  1.99  0.57
 assign ((resid  69 and name HA   ))   ( (resid  73 and name HN   ))     4.55  2.75  0.68
 assign ((resid  70 and name HA   ))   ( (resid  73 and name HN   ))     5.16  3.36  0.77
 assign ((resid  70 and name HA   ))   ( (resid  73 and name HB2  ))     4.96  3.16  0.74
 assign ((resid  70 and name HA   ))   ( (resid  73 and name HB1  ))     4.96  3.16  0.74
 assign ((resid  72 and name HA   ))   ( (resid  74 and name HN   ))     4.24  2.44  0.64
 assign ((resid  72 and name HA   ))   ( (resid  75 and name HN   ))     5.25  3.45  0.79
 assign ((resid  72 and name HA   ))   ( (resid  75 and name HB*  ))     3.71  1.91  0.56
 assign ((resid  72 and name HA   ))   ( (resid  76 and name HN   ))     4.93  3.13  0.74
 assign ((resid  73 and name HA   ))   ( (resid  76 and name HB2  ))     4.22  2.42  0.63
 assign ((resid  73 and name HA   ))   ( (resid  76 and name HB1  ))     4.22  2.42  0.63
 assign ((resid  74 and name HA   ))   ( (resid  77 and name HN   ))     5.52  3.72  0.83
 assign ((resid  74 and name HA   ))   ( (resid  77 and name HB2  ))     4.44  2.64  0.67
 assign ((resid  74 and name HA   ))   ( (resid  77 and name HB1  ))     4.44  2.64  0.67
 assign ((resid  75 and name HA   ))   ( (resid  78 and name HB*  ))     3.72  1.92  0.56
 assign ((resid  76 and name HA   ))   ( (resid  78 and name HN   ))     4.24  2.44  0.64
 assign ((resid  76 and name HA   ))   ( (resid  79 and name HN   ))     4.43  2.63  0.66
 assign ((resid  71 and name HA   ))   ( (resid  74 and name HB*  ))     3.44  1.64  0.52
 assign ((resid  76 and name HA   ))   ( (resid  79 and name HB*  ))     4.00  2.20  0.60
 assign ((resid  87 and name HA   ))   ( (resid  89 and name HN   ))     4.46  2.66  0.67
 assign ((resid  77 and name HA   ))   ( (resid  80 and name HB   ))     4.22  2.42  0.63
 assign ((resid  77 and name HA   ))   ( (resid  81 and name HN   ))     4.48  2.68  0.67
 assign ((resid  79 and name HA   ))   ( (resid  82 and name HB2  ))     3.97  2.17  0.60
 assign ((resid  79 and name HA   ))   ( (resid  82 and name HB1  ))     3.97  2.17  0.60
 assign ((resid  80 and name HA   ))   ( (resid  83 and name HB*  ))     3.47  1.67  0.52
 assign ((resid  80 and name HA   ))   ( (resid  84 and name HN   ))     4.63  2.83  0.69
 assign ((resid  81 and name HA   ))   ( (resid  84 and name HB   ))     3.67  1.87  0.55
 assign ((resid  82 and name HA   ))   ( (resid  84 and name HN   ))     4.73  2.93  0.71
 assign ((resid  82 and name HA   ))   ( (resid  85 and name HB*  ))     4.38  2.58  0.66
 assign ((resid  82 and name HA   ))   ( (resid  86 and name HN   ))     4.69  2.89  0.70
 assign ((resid  83 and name HA   ))   ( (resid  85 and name HN   ))     5.22  3.42  0.78
 assign ((resid  83 and name HA   ))   ( (resid  86 and name HB*  ))     2.92  1.12  0.44
 assign ((resid  84 and name HA   ))   ( (resid  87 and name HB2  ))     4.11  2.31  0.62
 assign ((resid  84 and name HA   ))   ( (resid  87 and name HB1  ))     4.11  2.31  0.62
 assign ((resid   6 and name HA   ))   ( (resid   7 and name HB*  ))     4.67  2.87  0.70
 assign ((resid  85 and name HA   ))   ( (resid  88 and name HG   ))     4.83  3.03  0.72
 assign ((resid   3 and name HA1  ))   ( (resid  26 and name HE*  ))     5.05  3.25  0.76
 assign ((resid   5 and name HG*  ))   ( (resid  25 and name HN   ))     5.05  3.25  0.76
 assign ((resid   5 and name HG*  ))   ( (resid  26 and name HA   ))     4.89  3.09  0.73
 assign ((resid   5 and name HD*  ))   ( (resid  26 and name HD*  ))     4.79  2.99  0.72
 assign ((resid   5 and name HE*  ))   ( (resid  26 and name HE*  ))     7.00  5.20  1.05
 assign ((resid   5 and name HE*  ))   ( (resid  26 and name HD*  ))     5.24  3.44  0.79
 assign ((resid   6 and name HG1* ))   ( (resid  26 and name HA   ))     4.88  3.08  0.73
 assign ((resid  41 and name HD1* ))   ( (resid  85 and name HA   ))     4.49  2.69  0.67
 assign ((resid  85 and name HA   ))   ( (resid  88 and name HD1* ))     4.05  2.25  0.61
 assign ((resid  14 and name HB2  ))   ( (resid  51 and name HD1* ))     4.00  2.20  0.60
 assign ((resid  14 and name HB2  ))   ( (resid  56 and name HG1* ))     4.29  2.49  0.64
 assign ((resid  14 and name HB1  ))   ( (resid  51 and name HD1* ))     4.00  2.20  0.60
 assign ((resid  14 and name HB1  ))   ( (resid  56 and name HG1* ))     4.29  2.49  0.64
 assign ((resid  14 and name HB1  ))   ( (resid  48 and name HD1* ))     4.88  3.08  0.73
 assign ((resid  14 and name HB2  ))   ( (resid  48 and name HD1* ))     4.88  3.08  0.73
 assign ((resid  13 and name HB   ))   ( (resid  57 and name HD*  ))     5.21  3.41  0.78
 assign ((resid  13 and name HG2* ))   ( (resid  57 and name HD*  ))     5.82  4.02  0.87
 assign ((resid  13 and name HG2* ))   ( (resid  57 and name HB*  ))     4.46  2.66  0.67
 assign ((resid  13 and name HB   ))   ( (resid  57 and name HB*  ))     3.42  1.62  0.51
 assign ((resid   7 and name HB*  ))   ( (resid  22 and name HB   ))     5.30  3.50  0.80
 assign ((resid  13 and name HB   ))   ( (resid  56 and name HB   ))     5.58  3.78  0.84
 assign ((resid  12 and name HG2* ))   ( (resid  13 and name HA   ))     4.87  3.07  0.73
 assign ((resid  13 and name HG2* ))   ( (resid  18 and name HA   ))     4.26  2.46  0.64
 assign ((resid  13 and name HA   ))   ( (resid  17 and name HN   ))     4.89  3.09  0.73
 assign ((resid  13 and name HG2* ))   ( (resid  57 and name HN   ))     4.26  2.46  0.64
 assign ((resid  12 and name HB   ))   ( (resid  19 and name HD*  ))     5.29  3.49  0.79
 assign ((resid   6 and name HG2* ))   ( (resid  77 and name HE*  ))     4.32  2.52  0.65
 assign ((resid   6 and name HG2* ))   ( (resid  77 and name HD*  ))     5.16  3.36  0.77
 assign ((resid   6 and name HG1* ))   ( (resid  77 and name HE*  ))     3.96  2.16  0.59
 assign ((resid   6 and name HG1* ))   ( (resid  77 and name HZ   ))     4.35  2.55  0.65
 assign ((resid   6 and name HG1* ))   ( (resid  63 and name HN   ))     4.86  3.06  0.73
 assign ((resid   7 and name HB*  ))   ( (resid   8 and name HA   ))     4.39  2.59  0.66
 assign ((resid   7 and name HG2  ))   ( (resid  24 and name HA   ))     4.38  2.58  0.66
 assign ((resid   7 and name HG1  ))   ( (resid  24 and name HA   ))     4.38  2.58  0.66
 assign ((resid   8 and name HB   ))   ( (resid  23 and name HB2  ))     4.17  2.37  0.63
 assign ((resid   8 and name HG1* ))   ( (resid  23 and name HD*  ))     3.89  2.09  0.58
 assign ((resid   8 and name HB   ))   ( (resid  23 and name HB1  ))     4.17  2.37  0.63
 assign ((resid   8 and name HG1* ))   ( (resid  10 and name HB   ))     4.32  2.52  0.65
 assign ((resid  28 and name HG1* ))   ( (resid  29 and name HB2  ))     4.57  2.77  0.69
 assign ((resid  11 and name HA   ))   ( (resid  21 and name HN   ))     4.29  2.49  0.64
 assign ((resid  11 and name HB1  ))   ( (resid  59 and name HB2  ))     4.73  2.93  0.71
 assign ((resid  11 and name HA   ))   ( (resid  20 and name HA   ))     3.58  1.78  0.54
 assign ((resid  11 and name HA   ))   ( (resid  12 and name HG2* ))     4.56  2.76  0.68
 assign ((resid  11 and name HA   ))   ( (resid  20 and name HG2  ))     4.95  3.15  0.74
 assign ((resid  17 and name HG2  ))   ( (resid  19 and name HE*  ))     5.08  3.28  0.76
 assign ((resid  17 and name HG1  ))   ( (resid  19 and name HE*  ))     5.08  3.28  0.76
 assign ((resid  11 and name HE*  ))   ( (resid  18 and name HG2* ))     3.74  1.94  0.56
 assign ((resid  13 and name HA   ))   ( (resid  18 and name HB   ))     5.36  3.56  0.80
 assign ((resid  17 and name HA   ))   ( (resid  18 and name HB   ))     4.88  3.08  0.73
 assign ((resid  13 and name HA   ))   ( (resid  18 and name HG2* ))     4.05  2.25  0.61
 assign ((resid  19 and name HE*  ))   ( (resid  48 and name HG1* ))     4.99  3.19  0.75
 assign ((resid  18 and name HG2* ))   ( (resid  20 and name HG2  ))     4.49  2.69  0.67
 assign ((resid  11 and name HA   ))   ( (resid  20 and name HG1  ))     4.95  3.15  0.74
 assign ((resid  11 and name HA   ))   ( (resid  20 and name HB1  ))     4.11  2.31  0.62
 assign ((resid  21 and name HG1  ))   ( (resid  23 and name HD*  ))     5.15  3.35  0.77
 assign ((resid  21 and name HG2  ))   ( (resid  23 and name HD*  ))     5.15  3.35  0.77
 assign ((resid  21 and name HD1  ))   ( (resid  23 and name HE*  ))     4.38  2.58  0.66
 assign ((resid   7 and name HG1  ))   ( (resid  22 and name HG2* ))     3.94  2.14  0.59
 assign ((resid  21 and name HA   ))   ( (resid  22 and name HB   ))     5.11  3.31  0.77
 assign ((resid  23 and name HB2  ))   ( (resid  25 and name HD2* ))     4.05  2.25  0.61
 assign ((resid   8 and name HG2* ))   ( (resid  23 and name HD*  ))     4.92  3.12  0.74
 assign ((resid   9 and name HA   ))   ( (resid  22 and name HA   ))     3.57  1.77  0.54
 assign ((resid   5 and name HD*  ))   ( (resid  24 and name HG2  ))     4.03  2.23  0.60
 assign ((resid   5 and name HG*  ))   ( (resid  24 and name HG2  ))     4.71  2.91  0.71
 assign ((resid   5 and name HD*  ))   ( (resid  24 and name HG1  ))     5.00  3.20  0.75
 assign ((resid  25 and name HD1* ))   ( (resid  36 and name HB2  ))     4.08  2.28  0.61
 assign ((resid   8 and name HB   ))   ( (resid  25 and name HD1* ))     3.86  2.06  0.58
 assign ((resid  23 and name HB1  ))   ( (resid  25 and name HD1* ))     5.16  3.36  0.77
 assign ((resid  25 and name HD1* ))   ( (resid  37 and name HA   ))     3.89  2.09  0.58
 assign ((resid  25 and name HD2* ))   ( (resid  36 and name HD2  ))     4.19  2.39  0.63
 assign ((resid  25 and name HD2* ))   ( (resid  36 and name HB2  ))     4.02  2.22  0.60
 assign ((resid  23 and name HB1  ))   ( (resid  25 and name HD2* ))     4.05  2.25  0.61
 assign ((resid  23 and name HB1  ))   ( (resid  25 and name HG   ))     5.11  3.31  0.77
 assign ((resid  23 and name HD*  ))   ( (resid  25 and name HD2* ))     4.32  2.52  0.65
 assign ((resid   5 and name HN   ))   ( (resid  26 and name HE*  ))     5.06  3.26  0.76
 assign ((resid  26 and name HD*  ))   ( (resid  33 and name HD2* ))     4.95  3.15  0.74
 assign ((resid  27 and name HB*  ))   ( (resid  30 and name HA   ))     4.02  2.22  0.60
 assign ((resid  27 and name HB*  ))   ( (resid  33 and name HA   ))     3.26  1.46  0.49
 assign ((resid  27 and name HB*  ))   ( (resid  36 and name HD2  ))     4.22  2.42  0.63
 assign ((resid  27 and name HB*  ))   ( (resid  36 and name HD1  ))     4.22  2.42  0.63
 assign ((resid  27 and name HB*  ))   ( (resid  33 and name HB2  ))     3.88  2.08  0.58
 assign ((resid  27 and name HB*  ))   ( (resid  28 and name HG2* ))     4.50  2.70  0.68
 assign ((resid  27 and name HB*  ))   ( (resid  33 and name HD1* ))     3.45  1.65  0.52
 assign ((resid  27 and name HA   ))   ( (resid  28 and name HG2* ))     3.99  2.19  0.60
 assign ((resid  27 and name HA   ))   ( (resid  33 and name HD2* ))     4.22  2.42  0.63
 assign ((resid  27 and name HA   ))   ( (resid  28 and name HB   ))     4.92  3.12  0.74
 assign ((resid  26 and name HA   ))   ( (resid  27 and name HB*  ))     4.50  2.70  0.68
 assign ((resid  27 and name HB*  ))   ( (resid  28 and name HA   ))     4.79  2.99  0.72
 assign ((resid  27 and name HB*  ))   ( (resid  28 and name HB   ))     4.90  3.10  0.74
 assign ((resid  61 and name HB2  ))   ( (resid 101 and name HG2* ))     5.36  3.56  0.80
 assign ((resid  28 and name HG1* ))   ( (resid  29 and name HG1  ))     3.56  1.76  0.53
 assign ((resid  29 and name HD*  ))   ( (resid  32 and name HN   ))     4.62  2.82  0.69
 assign ((resid  29 and name HB1  ))   ( (resid  32 and name HN   ))     4.50  2.70  0.68
 assign ((resid  28 and name HG1* ))   ( (resid  29 and name HD*  ))     4.06  2.26  0.61
 assign ((resid  30 and name HA   ))   ( (resid  80 and name HD1* ))     3.73  1.93  0.56
 assign ((resid  30 and name HB1  ))   ( (resid  80 and name HD1* ))     3.98  2.18  0.60
 assign ((resid  30 and name HA   ))   ( (resid  33 and name HD2* ))     5.00  3.20  0.75
 assign ((resid  29 and name HD*  ))   ( (resid  31 and name HB*  ))     5.00  3.20  0.75
 assign ((resid  27 and name HB*  ))   ( (resid  32 and name HB2  ))     4.33  2.53  0.65
 assign ((resid  28 and name HG2* ))   ( (resid  32 and name HB2  ))     6.00  4.20  0.90
 assign ((resid  27 and name HB*  ))   ( (resid  32 and name HA   ))     4.32  2.52  0.65
 assign ((resid  28 and name HG2* ))   ( (resid  32 and name HB1  ))     6.00  4.20  0.90
 assign ((resid  27 and name HB*  ))   ( (resid  32 and name HG1  ))     4.23  2.43  0.63
 assign ((resid  33 and name HB2  ))   ( (resid  80 and name HG2* ))     3.94  2.14  0.59
 assign ((resid  33 and name HB1  ))   ( (resid  80 and name HG2* ))     3.94  2.14  0.59
 assign ((resid  78 and name HA   ))   ( (resid  81 and name HD1* ))     4.89  3.09  0.73
 assign ((resid  30 and name HA   ))   ( (resid  33 and name HG   ))     5.04  3.24  0.76
 assign ((resid  34 and name HA   ))   ( (resid  37 and name HD1* ))     3.56  1.76  0.53
 assign ((resid  34 and name HB2  ))   ( (resid  80 and name HD1* ))     4.84  3.04  0.73
 assign ((resid  34 and name HB2  ))   ( (resid  80 and name HG2* ))     3.93  2.13  0.59
 assign ((resid  34 and name HB1  ))   ( (resid  80 and name HD1* ))     4.84  3.04  0.73
 assign ((resid  25 and name HD2* ))   ( (resid  36 and name HA   ))     4.82  3.02  0.72
 assign ((resid  25 and name HD1* ))   ( (resid  36 and name HA   ))     4.90  3.10  0.74
 assign ((resid  36 and name HN   ))   ( (resid  37 and name HD1* ))     5.24  3.44  0.79
 assign ((resid  37 and name HD2* ))   ( (resid  77 and name HE*  ))     4.21  2.41  0.63
 assign ((resid  37 and name HD2* ))   ( (resid  77 and name HZ   ))     4.27  2.47  0.64
 assign ((resid  34 and name HA   ))   ( (resid  37 and name HD2* ))     4.78  2.98  0.72
 assign ((resid  37 and name HA   ))   ( (resid  40 and name HG1* ))     4.45  2.65  0.67
 assign ((resid  38 and name HA   ))   ( (resid  88 and name HD1* ))     3.92  2.12  0.59
 assign ((resid  38 and name HA   ))   ( (resid  41 and name HD1* ))     3.88  2.08  0.58
 assign ((resid  38 and name HG1  ))   ( (resid  84 and name HG1* ))     3.83  2.03  0.57
 assign ((resid  35 and name HA   ))   ( (resid  38 and name HG1  ))     4.88  3.08  0.73
 assign ((resid  40 and name HG1* ))   ( (resid  41 and name HA   ))     4.08  2.28  0.61
 assign ((resid  38 and name HG2  ))   ( (resid  84 and name HG1* ))     3.83  2.03  0.57
 assign ((resid  23 and name HE*  ))   ( (resid  40 and name HG2* ))     4.40  2.60  0.66
 assign ((resid  41 and name HB2  ))   ( (resid  88 and name HD1* ))     4.18  2.38  0.63
 assign ((resid  41 and name HB1  ))   ( (resid  88 and name HD1* ))     4.18  2.38  0.63
 assign ((resid  41 and name HD2* ))   ( (resid  44 and name HN   ))     5.27  3.47  0.79
 assign ((resid  41 and name HD2* ))   ( (resid  85 and name HE*  ))     4.35  2.55  0.65
 assign ((resid  41 and name HD2* ))   ( (resid  85 and name HD*  ))     4.37  2.57  0.66
 assign ((resid  41 and name HD1* ))   ( (resid  85 and name HE*  ))     3.97  2.17  0.60
 assign ((resid  12 and name HD1* ))   ( (resid  45 and name HA   ))     4.02  2.22  0.60
 assign ((resid  45 and name HA   ))   ( (resid  48 and name HG2* ))     3.85  2.05  0.58
 assign ((resid  45 and name HA   ))   ( (resid  45 and name HE*  ))     3.89  2.09  0.58
 assign ((resid  12 and name HD1* ))   ( (resid  45 and name HG2  ))     4.22  2.42  0.63
 assign ((resid  12 and name HD1* ))   ( (resid  45 and name HG1  ))     4.22  2.42  0.63
 assign ((resid  12 and name HD1* ))   ( (resid  45 and name HE*  ))     2.92  1.12  0.44
 assign ((resid  45 and name HE*  ))   ( (resid  58 and name HD1* ))     3.66  1.86  0.55
 assign ((resid  45 and name HE*  ))   ( (resid  49 and name HE*  ))     4.75  2.95  0.71
 assign ((resid  46 and name HB1  ))   ( (resid  47 and name HG2  ))     5.37  3.57  0.81
 assign ((resid  46 and name HA   ))   ( (resid  49 and name HD*  ))     4.02  2.22  0.60
 assign ((resid  46 and name HB1  ))   ( (resid  47 and name HD1  ))     3.52  1.72  0.53
 assign ((resid  46 and name HB1  ))   ( (resid  47 and name HD2  ))     3.52  1.72  0.53
 assign ((resid  46 and name HB2  ))   ( (resid  47 and name HD1  ))     3.52  1.72  0.53
 assign ((resid  46 and name HB2  ))   ( (resid  47 and name HD2  ))     3.52  1.72  0.53
 assign ((resid  46 and name HN   ))   ( (resid  47 and name HD1  ))     4.17  2.37  0.63
 assign ((resid  46 and name HB2  ))   ( (resid  47 and name HG2  ))     5.37  3.57  0.81
 assign ((resid  46 and name HB1  ))   ( (resid  47 and name HG1  ))     5.37  3.57  0.81
 assign ((resid  46 and name HB2  ))   ( (resid  47 and name HG1  ))     5.37  3.57  0.81
 assign ((resid  47 and name HG1  ))   ( (resid  51 and name HD2* ))     6.00  4.20  0.90
 assign ((resid  47 and name HG2  ))   ( (resid  51 and name HD2* ))     6.00  4.20  0.90
 assign ((resid  48 and name HA   ))   ( (resid  51 and name HG   ))     3.95  2.15  0.59
 assign ((resid  45 and name HA   ))   ( (resid  48 and name HD1* ))     4.77  2.97  0.72
 assign ((resid  45 and name HE*  ))   ( (resid  48 and name HD1* ))     5.46  3.66  0.82
 assign ((resid  12 and name HB   ))   ( (resid  48 and name HD1* ))     4.79  2.99  0.72
 assign ((resid  48 and name HD1* ))   ( (resid  51 and name HG   ))     5.07  3.27  0.76
 assign ((resid  12 and name HD1* ))   ( (resid  48 and name HD1* ))     3.64  1.84  0.55
 assign ((resid  28 and name HG1* ))   ( (resid  32 and name HG1  ))     5.27  3.47  0.79
 assign ((resid  48 and name HA   ))   ( (resid  51 and name HD1* ))     3.18  1.38  0.48
 assign ((resid  12 and name HD1* ))   ( (resid  48 and name HG2* ))     2.57  0.77  0.39
 assign ((resid  19 and name HE*  ))   ( (resid  48 and name HG2* ))     4.81  3.01  0.72
 assign ((resid  48 and name HA   ))   ( (resid  51 and name HD2* ))     4.29  2.49  0.64
 assign ((resid  48 and name HG1* ))   ( (resid  51 and name HD2* ))     5.68  3.88  0.85
 assign ((resid  48 and name HG2* ))   ( (resid  52 and name HA2  ))     6.00  4.20  0.90
 assign ((resid  51 and name HD2* ))   ( (resid  52 and name HA2  ))     6.00  4.20  0.90
 assign ((resid  53 and name HB1  ))   ( (resid  55 and name HN   ))     6.00  4.20  0.90
 assign ((resid  53 and name HB2  ))   ( (resid  55 and name HN   ))     6.00  4.20  0.90
 assign ((resid  53 and name HB2  ))   ( (resid  56 and name HG1* ))     3.93  2.13  0.59
 assign ((resid  53 and name HB1  ))   ( (resid  56 and name HG1* ))     3.93  2.13  0.59
 assign ((resid  12 and name HB   ))   ( (resid  58 and name HD1* ))     4.89  3.09  0.73
 assign ((resid  58 and name HG2* ))   ( (resid 104 and name HG2* ))     4.38  2.58  0.66
 assign ((resid  58 and name HB   ))   ( (resid 104 and name HG1* ))     4.32  2.52  0.65
 assign ((resid  58 and name HG2* ))   ( (resid  85 and name HE*  ))     4.23  2.43  0.63
 assign ((resid  58 and name HG2* ))   ( (resid  85 and name HZ   ))     4.83  3.03  0.72
 assign ((resid  58 and name HD1* ))   ( (resid  85 and name HE*  ))     4.81  3.01  0.72
 assign ((resid  59 and name HA   ))   ( (resid  60 and name HB   ))     5.39  3.59  0.81
 assign ((resid  11 and name HB1  ))   ( (resid  59 and name HB1  ))     4.73  2.93  0.71
 assign ((resid  11 and name HD*  ))   ( (resid  59 and name HB1  ))     5.03  3.23  0.75
 assign ((resid  11 and name HB2  ))   ( (resid  59 and name HB2  ))     4.73  2.93  0.71
 assign ((resid  58 and name HG2* ))   ( (resid  59 and name HA   ))     5.51  3.71  0.83
 assign ((resid  60 and name HD1* ))   ( (resid  85 and name HE*  ))     3.60  1.80  0.54
 assign ((resid  60 and name HG2* ))   ( (resid  85 and name HD*  ))     6.00  4.20  0.90
 assign ((resid  60 and name HG2* ))   ( (resid  97 and name HH2  ))     6.00  4.20  0.90
 assign ((resid  60 and name HG11 ))   ( (resid  85 and name HZ   ))     5.20  3.40  0.78
 assign ((resid  10 and name HA   ))   ( (resid  60 and name HG11 ))     4.98  3.18  0.75
 assign ((resid  41 and name HA   ))   ( (resid  60 and name HD1* ))     5.17  3.37  0.78
 assign ((resid  61 and name HA   ))   ( (resid  81 and name HD1* ))     5.64  3.84  0.85
 assign ((resid  61 and name HA   ))   ( (resid  62 and name HG2* ))     5.36  3.56  0.80
 assign ((resid  62 and name HG2* ))   ( (resid  74 and name HA   ))     6.00  4.20  0.90
 assign ((resid  62 and name HG2* ))   ( (resid  77 and name HA   ))     6.00  4.20  0.90
 assign ((resid  85 and name HD*  ))   ( (resid  95 and name HG1* ))     3.72  1.92  0.56
 assign ((resid  85 and name HB*  ))   ( (resid  95 and name HG1* ))     4.60  2.80  0.69
 assign ((resid  67 and name HA   ))   ( (resid  70 and name HB*  ))     3.63  1.83  0.54
 assign ((resid  67 and name HA   ))   ( (resid  70 and name HG1  ))     4.26  2.46  0.64
 assign ((resid  67 and name HB*  ))   ( (resid  70 and name HB*  ))     4.38  2.58  0.66
 assign ((resid  64 and name HB*  ))   ( (resid  67 and name HB*  ))     4.95  3.15  0.74
 assign ((resid  68 and name HA   ))   ( (resid  71 and name HD*  ))     4.59  2.79  0.69
 assign ((resid  68 and name HB*  ))   ( (resid  71 and name HE*  ))     5.17  3.37  0.78
 assign ((resid  70 and name HA   ))   ( (resid  74 and name HB*  ))     4.61  2.81  0.69
 assign ((resid  68 and name HB*  ))   ( (resid  69 and name HG*  ))     3.55  1.75  0.53
 assign ((resid  74 and name HA   ))   ( (resid  77 and name HD*  ))     5.78  3.98  0.87
 assign ((resid  77 and name HA   ))   ( (resid  79 and name HB*  ))     4.98  3.18  0.75
 assign ((resid  77 and name HA   ))   ( (resid  81 and name HD1* ))     4.75  2.95  0.71
 assign ((resid  77 and name HA   ))   ( (resid  80 and name HD1* ))     4.06  2.26  0.61
 assign ((resid  77 and name HA   ))   ( (resid  80 and name HG2* ))     4.64  2.84  0.70
 assign ((resid  62 and name HB   ))   ( (resid  77 and name HB2  ))     5.90  4.10  0.89
 assign ((resid  62 and name HG2* ))   ( (resid  77 and name HB2  ))     4.79  2.99  0.72
 assign ((resid  62 and name HB   ))   ( (resid  77 and name HB1  ))     5.90  4.10  0.89
 assign ((resid  77 and name HB1  ))   ( (resid  81 and name HD1* ))     4.91  3.11  0.74
 assign ((resid  62 and name HG2* ))   ( (resid  77 and name HB1  ))     4.79  2.99  0.72
 assign ((resid  33 and name HD1* ))   ( (resid  77 and name HZ   ))     4.78  2.98  0.72
 assign ((resid  77 and name HD*  ))   ( (resid  80 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  77 and name HA   ))   ( (resid  97 and name HH2  ))     5.98  4.18  0.90
 assign ((resid  77 and name HB2  ))   ( (resid  97 and name HH2  ))     4.99  3.19  0.75
 assign ((resid  77 and name HB1  ))   ( (resid  97 and name HH2  ))     4.99  3.19  0.75
 assign ((resid  78 and name HB*  ))   ( (resid  79 and name HB*  ))     3.75  1.95  0.56
 assign ((resid  79 and name HB*  ))   ( (resid  80 and name HB   ))     4.94  3.14  0.74
 assign ((resid  79 and name HB*  ))   ( (resid  82 and name HB2  ))     5.18  3.38  0.78
 assign ((resid  79 and name HB*  ))   ( (resid  82 and name HB1  ))     5.18  3.38  0.78
 assign ((resid  34 and name HN   ))   ( (resid  80 and name HD1* ))     4.20  2.40  0.63
 assign ((resid  77 and name HE*  ))   ( (resid  80 and name HD1* ))     5.29  3.49  0.79
 assign ((resid  30 and name HA   ))   ( (resid  80 and name HG2* ))     4.53  2.73  0.68
 assign ((resid  30 and name HA   ))   ( (resid  80 and name HG11 ))     5.12  3.32  0.77
 assign ((resid  30 and name HA   ))   ( (resid  80 and name HG12 ))     5.12  3.32  0.77
 assign ((resid  79 and name HB*  ))   ( (resid  80 and name HA   ))     4.30  2.50  0.65
 assign ((resid  34 and name HA   ))   ( (resid  80 and name HG2* ))     3.43  1.63  0.51
 assign ((resid  34 and name HB1  ))   ( (resid  80 and name HG2* ))     3.93  2.13  0.59
 assign ((resid  34 and name HG1  ))   ( (resid  80 and name HG2* ))     3.76  1.96  0.56
 assign ((resid  34 and name HD2  ))   ( (resid  80 and name HG2* ))     4.33  2.53  0.65
 assign ((resid  37 and name HG   ))   ( (resid  80 and name HG2* ))     4.74  2.94  0.71
 assign ((resid  30 and name HB2  ))   ( (resid  80 and name HD1* ))     3.98  2.18  0.60
 assign ((resid  34 and name HG1  ))   ( (resid  80 and name HD1* ))     3.70  1.90  0.56
 assign ((resid  79 and name HB*  ))   ( (resid  80 and name HD1* ))     3.93  2.13  0.59
 assign ((resid  37 and name HD1* ))   ( (resid  81 and name HA   ))     4.01  2.21  0.60
 assign ((resid  81 and name HA   ))   ( (resid  84 and name HG1* ))     4.27  2.47  0.64
 assign ((resid  78 and name HA   ))   ( (resid  81 and name HD2* ))     5.93  4.13  0.89
 assign ((resid  81 and name HD2* ))   ( (resid 104 and name HG2* ))     4.82  3.02  0.72
 assign ((resid  81 and name HD1* ))   ( (resid 102 and name HG2* ))     4.42  2.62  0.66
 assign ((resid  81 and name HD2* ))   ( (resid  84 and name HN   ))     5.14  3.34  0.77
 assign ((resid  81 and name HD2* ))   ( (resid  97 and name HZ2  ))     4.47  2.67  0.67
 assign ((resid  81 and name HD2* ))   ( (resid  85 and name HD*  ))     3.97  2.17  0.60
 assign ((resid  77 and name HE*  ))   ( (resid  81 and name HD2* ))     3.79  1.99  0.57
 assign ((resid  77 and name HE*  ))   ( (resid  81 and name HD1* ))     3.65  1.85  0.55
 assign ((resid  81 and name HD1* ))   ( (resid  85 and name HE*  ))     4.07  2.27  0.61
 assign ((resid  81 and name HD1* ))   ( (resid  85 and name HZ   ))     5.05  3.25  0.76
 assign ((resid  38 and name HN   ))   ( (resid  84 and name HG2* ))     3.95  2.15  0.59
 assign ((resid  38 and name HN   ))   ( (resid  84 and name HG1* ))     4.05  2.25  0.61
 assign ((resid  81 and name HA   ))   ( (resid  84 and name HG2* ))     3.74  1.94  0.56
 assign ((resid  38 and name HA   ))   ( (resid  84 and name HG1* ))     3.58  1.78  0.54
 assign ((resid  84 and name HG1* ))   ( (resid  88 and name HG   ))     4.33  2.53  0.65
 assign ((resid  83 and name HB*  ))   ( (resid  84 and name HG2* ))     3.73  1.93  0.56
 assign ((resid  38 and name HG2  ))   ( (resid  84 and name HG2* ))     4.09  2.29  0.61
 assign ((resid  34 and name HA   ))   ( (resid  84 and name HG2* ))     3.62  1.82  0.54
 assign ((resid  37 and name HD1* ))   ( (resid  84 and name HA   ))     5.71  3.91  0.86
 assign ((resid  80 and name HG2* ))   ( (resid  84 and name HA   ))     6.00  4.20  0.90
 assign ((resid  84 and name HA   ))   ( (resid  88 and name HD1* ))     5.14  3.34  0.77
 assign ((resid  84 and name HA   ))   ( (resid  88 and name HD2* ))     5.58  3.78  0.84
 assign ((resid  37 and name HD1* ))   ( (resid  84 and name HB   ))     4.96  3.16  0.74
 assign ((resid  81 and name HD2* ))   ( (resid  84 and name HB   ))     4.19  2.39  0.63
 assign ((resid  80 and name HG2* ))   ( (resid  84 and name HG2* ))     3.00  1.20  0.45
 assign ((resid  81 and name HD1* ))   ( (resid  85 and name HD*  ))     5.54  3.74  0.83
 assign ((resid  86 and name HB*  ))   ( (resid  89 and name HN   ))     4.92  3.12  0.74
 assign ((resid  83 and name HN   ))   ( (resid  86 and name HB*  ))     4.81  3.01  0.72
 assign ((resid  83 and name HB*  ))   ( (resid  86 and name HB*  ))     4.86  3.06  0.73
 assign ((resid  83 and name HE*  ))   ( (resid  86 and name HB*  ))     5.65  3.85  0.85
 assign ((resid  85 and name HB*  ))   ( (resid  86 and name HB*  ))     5.09  3.29  0.76
 assign ((resid  86 and name HB*  ))   ( (resid  87 and name HA   ))     4.46  2.66  0.67
 assign ((resid  88 and name HA   ))   ( (resid  90 and name HE*  ))     6.00  4.20  0.90
 assign ((resid  85 and name HD*  ))   ( (resid  88 and name HD1* ))     4.78  2.98  0.72
 assign ((resid  88 and name HD2* ))   ( (resid  90 and name HE*  ))     5.05  3.25  0.76
 assign ((resid  88 and name HD1* ))   ( (resid  90 and name HN   ))     5.77  3.97  0.87
 assign ((resid  38 and name HN   ))   ( (resid  88 and name HD2* ))     5.04  3.24  0.76
 assign ((resid  38 and name HA   ))   ( (resid  88 and name HD2* ))     4.38  2.58  0.66
 assign ((resid  38 and name HE1  ))   ( (resid  88 and name HD2* ))     4.47  2.67  0.67
 assign ((resid  38 and name HE2  ))   ( (resid  88 and name HD2* ))     4.47  2.67  0.67
 assign ((resid  41 and name HD1* ))   ( (resid  88 and name HG   ))     3.97  2.17  0.60
 assign ((resid  38 and name HG1  ))   ( (resid  88 and name HG   ))     4.72  2.92  0.71
 assign ((resid  41 and name HD1* ))   ( (resid  88 and name HD1* ))     2.75  0.95  0.41
 assign ((resid  84 and name HG1* ))   ( (resid  88 and name HD1* ))     3.49  1.69  0.52
 assign ((resid  41 and name HD1* ))   ( (resid  88 and name HD2* ))     3.94  2.14  0.59
 assign ((resid  85 and name HB*  ))   ( (resid  90 and name HB1  ))     4.29  2.49  0.64
 assign ((resid  85 and name HB*  ))   ( (resid  90 and name HB2  ))     4.29  2.49  0.64
 assign ((resid  90 and name HE*  ))   ( (resid 104 and name HG1* ))     5.02  3.22  0.75
 assign ((resid  38 and name HA   ))   ( (resid  85 and name HA   ))     6.00  4.20  0.90
 assign ((resid  95 and name HA   ))   ( (resid 104 and name HG1* ))     4.42  2.62  0.66
 assign ((resid  95 and name HG2* ))   ( (resid 104 and name HG1* ))     3.81  2.01  0.57
 assign ((resid  95 and name HB   ))   ( (resid 102 and name HG2* ))     4.84  3.04  0.73
 assign ((resid  85 and name HB*  ))   ( (resid  95 and name HG2* ))     4.21  2.41  0.63
 assign ((resid  86 and name HN   ))   ( (resid  95 and name HG2* ))     5.03  3.23  0.75
 assign ((resid  85 and name HD*  ))   ( (resid  95 and name HG2* ))     4.29  2.49  0.64
 assign ((resid  96 and name HB   ))   ( (resid 103 and name HN   ))     4.67  2.87  0.70
 assign ((resid  96 and name HG2* ))   ( (resid 103 and name HN   ))     4.47  2.67  0.67
 assign ((resid  96 and name HB   ))   ( (resid 103 and name HB   ))     4.16  2.36  0.62
 assign ((resid  96 and name HG2* ))   ( (resid  98 and name HB2  ))     5.04  3.24  0.76
 assign ((resid  95 and name HG1* ))   ( (resid  97 and name HZ2  ))     5.31  3.51  0.80
 assign ((resid  62 and name HG2* ))   ( (resid  97 and name HH2  ))     6.00  4.20  0.90
 assign ((resid  81 and name HD2* ))   ( (resid  97 and name HH2  ))     6.00  4.20  0.90
 assign ((resid  98 and name HB2  ))   ( (resid 101 and name HB   ))     5.63  3.83  0.84
 assign ((resid  59 and name HA   ))   ( (resid 101 and name HG2* ))     4.29  2.49  0.64
 assign ((resid 101 and name HG2* ))   ( (resid 103 and name HN   ))     4.58  2.78  0.69
 assign ((resid  60 and name HN   ))   ( (resid 101 and name HG2* ))     4.04  2.24  0.61
 assign ((resid  95 and name HG1* ))   ( (resid 102 and name HG2* ))     3.32  1.52  0.50
 assign ((resid  60 and name HA   ))   ( (resid 102 and name HG1* ))     4.99  3.19  0.75
 assign ((resid 101 and name HA   ))   ( (resid 102 and name HG1* ))     5.18  3.38  0.78
 assign ((resid  97 and name HA   ))   ( (resid 102 and name HG2* ))     4.51  2.71  0.68
 assign ((resid  85 and name HD*  ))   ( (resid 102 and name HG2* ))     4.71  2.91  0.71
 assign ((resid  85 and name HD*  ))   ( (resid 102 and name HG1* ))     5.66  3.86  0.85
 assign ((resid   6 and name HG2* ))   ( (resid  77 and name HZ   ))     4.41  2.61  0.66
 assign ((resid  96 and name HN   ))   ( (resid 103 and name HB   ))     4.78  2.98  0.72
 assign ((resid  59 and name HA   ))   ( (resid 103 and name HA   ))     3.76  1.96  0.56
 assign ((resid  96 and name HG2* ))   ( (resid 103 and name HB   ))     4.41  2.61  0.66
 assign ((resid  58 and name HD1* ))   ( (resid 104 and name HB   ))     4.58  2.78  0.69
 assign ((resid  58 and name HG2* ))   ( (resid 104 and name HB   ))     4.28  2.48  0.64
 assign ((resid  58 and name HB   ))   ( (resid 104 and name HB   ))     3.51  1.71  0.53
 assign ((resid  58 and name HB   ))   ( (resid 104 and name HG2* ))     4.33  2.53  0.65
 assign ((resid  60 and name HD1* ))   ( (resid 104 and name HG2* ))     4.05  2.25  0.61
 assign ((resid  95 and name HG2* ))   ( (resid 104 and name HG2* ))     3.67  1.87  0.55
 assign ((resid  41 and name HD1* ))   ( (resid 104 and name HG2* ))     5.08  3.28  0.76
 assign ((resid  58 and name HD1* ))   ( (resid 104 and name HG2* ))     5.42  3.62  0.81
 assign ((resid  60 and name HD1* ))   ( (resid 104 and name HG1* ))     4.07  2.27  0.61
 assign ((resid  58 and name HG2* ))   ( (resid 104 and name HG1* ))     3.97  2.17  0.60
 assign ((resid  58 and name HD1* ))   ( (resid 104 and name HG1* ))     4.05  2.25  0.61
 assign ((resid  85 and name HD*  ))   ( (resid 104 and name HG1* ))     4.77  2.97  0.72
 assign ((resid 104 and name HG1* ))   ( (resid 106 and name HN   ))     5.29  3.49  0.79
 assign ((resid 111 and name HA   ))   ( (resid 112 and name HA   ))     5.41  3.61  0.81
 assign ((resid 112 and name HA   ))   ( (resid 113 and name HG   ))     6.00  4.20  0.90
 assign ((resid 111 and name HG1* ))   ( (resid 112 and name HB2  ))     6.00  4.20  0.90
 assign ((resid 111 and name HG2* ))   ( (resid 112 and name HB2  ))     6.00  4.20  0.90
 assign ((resid 111 and name HB   ))   ( (resid 112 and name HB1  ))     5.50  3.70  0.83
 assign ((resid 111 and name HG1* ))   ( (resid 112 and name HB1  ))     6.00  4.20  0.90
 assign ((resid 111 and name HG2* ))   ( (resid 112 and name HB1  ))     6.00  4.20  0.90
 assign ((resid  61 and name HG*  ))   ( (resid 101 and name HA   ))     4.20  2.40  0.63
 assign ((resid   5 and name HA   ))   ( (resid  26 and name HA   ))     3.70  1.90  0.56
 assign ((resid   5 and name HA   ))   ( (resid  26 and name HD*  ))     5.13  3.33  0.77
 assign ((resid   7 and name HA   ))   ( (resid  24 and name HA   ))     3.21  1.41  0.48
 assign ((resid  13 and name HB   ))   ( (resid  14 and name HA   ))     4.84  3.04  0.73
 assign ((resid   9 and name HA   ))   ( (resid  22 and name HG2* ))     3.78  1.98  0.57
 assign ((resid  10 and name HA   ))   ( (resid  58 and name HG2* ))     4.35  2.55  0.65
 assign ((resid   7 and name HN   ))   ( (resid  62 and name HG1* ))     5.28  3.48  0.79
 assign ((resid  97 and name HA   ))   ( (resid 102 and name HA   ))     4.14  2.34  0.62
 assign ((resid  97 and name HA   ))   ( (resid 102 and name HG1* ))     4.87  3.07  0.73
 assign ((resid  95 and name HA   ))   ( (resid 104 and name HA   ))     4.28  2.48  0.64
 assign ((resid  95 and name HA   ))   ( (resid 104 and name HG2* ))     4.63  2.83  0.69
 assign ((resid 110 and name HA*  ))   ( (resid 111 and name HB   ))     6.00  4.20  0.90
 assign ((resid 109 and name HG*  ))   ( (resid 110 and name HA*  ))     4.78  2.98  0.72
 assign ((resid 108 and name HB*  ))   ( (resid 110 and name HA*  ))     5.72  3.92  0.86
 assign ((resid 110 and name HA*  ))   ( (resid 111 and name HG1* ))     6.00  4.20  0.90
 assign ((resid 110 and name HA*  ))   ( (resid 111 and name HG2* ))     4.41  2.61  0.66
 assign ((resid 111 and name HB   ))   ( (resid 112 and name HB2  ))     6.00  4.20  0.90
 assign ((resid  45 and name HE*  ))   ( (resid 108 and name HD2* ))     4.80  3.00  0.72
 assign ((resid  60 and name HD1* ))   ( (resid 102 and name HG2* ))     4.72  2.92  0.71
 assign ((resid  96 and name HG2* ))   ( (resid  98 and name HB1  ))     5.04  3.24  0.76
 assign ((resid   6 and name HB   ))   ( (resid  77 and name HE*  ))     6.00  4.20  0.90
 assign ((resid   6 and name HG2* ))   ( (resid  63 and name HN   ))     4.26  2.46  0.64
 assign ((resid   5 and name HA   ))   ( (resid   6 and name HG1* ))     4.07  2.27  0.61
 assign ((resid   6 and name HB   ))   ( (resid  62 and name HG2* ))     4.51  2.71  0.68
 assign ((resid   6 and name HB   ))   ( (resid  33 and name HD2* ))     4.96  3.16  0.74
 assign ((resid   6 and name HB   ))   ( (resid  62 and name HG1* ))     4.87  3.07  0.73
 assign ((resid   6 and name HG1* ))   ( (resid  62 and name HG2* ))     3.51  1.71  0.53
 assign ((resid   6 and name HG1* ))   ( (resid  33 and name HD2* ))     2.99  1.19  0.45
 assign ((resid   6 and name HG2* ))   ( (resid   8 and name HG2* ))     2.91  1.11  0.44
 assign ((resid   6 and name HG2* ))   ( (resid  33 and name HG   ))     5.26  3.46  0.79
 assign ((resid   7 and name HB*  ))   ( (resid  22 and name HG2* ))     4.28  2.48  0.64
 assign ((resid   7 and name HA   ))   ( (resid  24 and name HN   ))     5.32  3.52  0.80
 assign ((resid   8 and name HG2* ))   ( (resid  23 and name HN   ))     4.86  3.06  0.73
 assign ((resid   8 and name HG1* ))   ( (resid  60 and name HA   ))     4.17  2.37  0.63
 assign ((resid   6 and name HG1* ))   ( (resid   8 and name HG2* ))     3.78  1.98  0.57
 assign ((resid   8 and name HG1* ))   ( (resid  40 and name HB   ))     4.37  2.57  0.66
 assign ((resid   8 and name HG1* ))   ( (resid  40 and name HG1* ))     3.74  1.94  0.56
 assign ((resid  11 and name HB1  ))   ( (resid  18 and name HG2* ))     4.59  2.79  0.69
 assign ((resid  11 and name HD*  ))   ( (resid  18 and name HG2* ))     3.29  1.49  0.49
 assign ((resid  10 and name HA   ))   ( (resid  11 and name HA   ))     4.60  2.80  0.69
 assign ((resid  10 and name HA   ))   ( (resid  11 and name HB2  ))     4.96  3.16  0.74
 assign ((resid  10 and name HA   ))   ( (resid  11 and name HB1  ))     4.96  3.16  0.74
 assign ((resid  12 and name HA   ))   ( (resid  58 and name HD1* ))     4.83  3.03  0.72
 assign ((resid  12 and name HD1* ))   ( (resid  56 and name HB   ))     3.56  1.76  0.53
 assign ((resid  12 and name HD1* ))   ( (resid  48 and name HB   ))     4.49  2.69  0.67
 assign ((resid  12 and name HD1* ))   ( (resid  48 and name HG1* ))     3.66  1.86  0.55
 assign ((resid  12 and name HG2* ))   ( (resid  58 and name HD1* ))     4.88  3.08  0.73
 assign ((resid  12 and name HA   ))   ( (resid  13 and name HB   ))     4.67  2.87  0.70
 assign ((resid  13 and name HG2* ))   ( (resid  14 and name HA   ))     4.98  3.18  0.75
 assign ((resid  14 and name HA   ))   ( (resid  19 and name HE*  ))     6.00  4.20  0.90
 assign ((resid   9 and name HA   ))   ( (resid  10 and name HA   ))     4.73  2.93  0.71
 assign ((resid  23 and name HA   ))   ( (resid  24 and name HA   ))     5.06  3.26  0.76
 assign ((resid  14 and name HA   ))   ( (resid  48 and name HG2* ))     4.76  2.96  0.71
 assign ((resid  13 and name HG2* ))   ( (resid  17 and name HA   ))     4.41  2.61  0.66
 assign ((resid  11 and name HD*  ))   ( (resid  18 and name HB   ))     6.00  4.20  0.90
 assign ((resid  11 and name HB2  ))   ( (resid  18 and name HG2* ))     4.59  2.79  0.69
 assign ((resid  18 and name HG2* ))   ( (resid  20 and name HB2  ))     4.62  2.82  0.69
 assign ((resid  13 and name HA   ))   ( (resid  18 and name HA   ))     3.81  2.01  0.57
 assign ((resid  11 and name HA   ))   ( (resid  18 and name HG2* ))     3.84  2.04  0.58
 assign ((resid  12 and name HG2* ))   ( (resid  20 and name HA   ))     5.19  3.39  0.78
 assign ((resid  18 and name HG2* ))   ( (resid  20 and name HG1  ))     4.49  2.69  0.67
 assign ((resid  11 and name HG1  ))   ( (resid  20 and name HB2  ))     4.39  2.59  0.66
 assign ((resid  11 and name HG2  ))   ( (resid  20 and name HB2  ))     4.39  2.59  0.66
 assign ((resid  11 and name HG2  ))   ( (resid  20 and name HB1  ))     4.39  2.59  0.66
 assign ((resid  11 and name HG1  ))   ( (resid  20 and name HB1  ))     4.39  2.59  0.66
 assign ((resid  18 and name HG2* ))   ( (resid  20 and name HB1  ))     4.62  2.82  0.69
 assign ((resid  12 and name HN   ))   ( (resid  20 and name HB2  ))     4.68  2.88  0.70
 assign ((resid  12 and name HN   ))   ( (resid  20 and name HB1  ))     4.68  2.88  0.70
 assign ((resid  21 and name HB2  ))   ( (resid  23 and name HE*  ))     4.21  2.41  0.63
 assign ((resid   7 and name HG2  ))   ( (resid  22 and name HG2* ))     3.94  2.14  0.59
 assign ((resid  22 and name HG2* ))   ( (resid  23 and name HA   ))     4.49  2.69  0.67
 assign ((resid  22 and name HA   ))   ( (resid  23 and name HD*  ))     4.58  2.78  0.69
 assign ((resid   9 and name HN   ))   ( (resid  22 and name HG2* ))     4.68  2.88  0.70
 assign ((resid  21 and name HN   ))   ( (resid  22 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  23 and name HB2  ))   ( (resid  25 and name HD1* ))     5.16  3.36  0.77
 assign ((resid   8 and name HB   ))   ( (resid  23 and name HA   ))     5.00  3.20  0.75
 assign ((resid  23 and name HA   ))   ( (resid  25 and name HD2* ))     4.69  2.89  0.70
 assign ((resid   5 and name HD*  ))   ( (resid  24 and name HB2  ))     5.00  3.20  0.75
 assign ((resid   5 and name HD*  ))   ( (resid  24 and name HB1  ))     5.00  3.20  0.75
 assign ((resid   5 and name HG*  ))   ( (resid  24 and name HG1  ))     4.71  2.91  0.71
 assign ((resid   5 and name HE*  ))   ( (resid  24 and name HG2  ))     4.44  2.64  0.67
 assign ((resid   5 and name HE*  ))   ( (resid  24 and name HG1  ))     4.44  2.64  0.67
 assign ((resid  27 and name HB*  ))   ( (resid  32 and name HB1  ))     4.33  2.53  0.65
 assign ((resid  26 and name HA   ))   ( (resid  27 and name HA   ))     4.98  3.18  0.75
 assign ((resid  27 and name HB*  ))   ( (resid  36 and name HN   ))     5.08  3.28  0.76
 assign ((resid  26 and name HD*  ))   ( (resid  28 and name HA   ))     5.37  3.57  0.81
 assign ((resid  27 and name HA   ))   ( (resid  28 and name HA   ))     4.59  2.79  0.69
 assign ((resid   3 and name HA1  ))   ( (resid  28 and name HA   ))     3.88  2.08  0.58
 assign ((resid   3 and name HA2  ))   ( (resid  28 and name HA   ))     3.88  2.08  0.58
 assign ((resid  28 and name HG2* ))   ( (resid  29 and name HD*  ))     5.99  4.19  0.90
 assign ((resid  57 and name HD*  ))   ( (resid 103 and name HG2* ))     4.11  2.31  0.62
 assign ((resid  28 and name HG1* ))   ( (resid  29 and name HG2  ))     3.56  1.76  0.53
 assign ((resid  27 and name HB*  ))   ( (resid  32 and name HG2  ))     4.23  2.43  0.63
 assign ((resid  28 and name HG1* ))   ( (resid  32 and name HG2  ))     5.27  3.47  0.79
 assign ((resid  27 and name HB*  ))   ( (resid  33 and name HB1  ))     3.88  2.08  0.58
 assign ((resid  33 and name HG   ))   ( (resid  80 and name HG2* ))     4.59  2.79  0.69
 assign ((resid   6 and name HG1* ))   ( (resid  33 and name HD1* ))     4.07  2.27  0.61
 assign ((resid  27 and name HB*  ))   ( (resid  33 and name HD2* ))     3.72  1.92  0.56
 assign ((resid  33 and name HD1* ))   ( (resid  36 and name HA   ))     4.70  2.90  0.70
 assign ((resid  34 and name HG2  ))   ( (resid  80 and name HD1* ))     3.70  1.90  0.56
 assign ((resid  34 and name HG2  ))   ( (resid  80 and name HG2* ))     3.76  1.96  0.56
 assign ((resid  34 and name HD2  ))   ( (resid  80 and name HD1* ))     4.32  2.52  0.65
 assign ((resid  33 and name HD1* ))   ( (resid  34 and name HA   ))     4.28  2.48  0.64
 assign ((resid  25 and name HD2* ))   ( (resid  36 and name HB1  ))     4.02  2.22  0.60
 assign ((resid  25 and name HD1* ))   ( (resid  36 and name HB1  ))     4.08  2.28  0.61
 assign ((resid  33 and name HD1* ))   ( (resid  36 and name HD2  ))     4.06  2.26  0.61
 assign ((resid  37 and name HA   ))   ( (resid  40 and name HG2* ))     3.54  1.74  0.53
 assign ((resid  33 and name HD1* ))   ( (resid  37 and name HD1* ))     2.72  0.92  0.41
 assign ((resid   8 and name HG1* ))   ( (resid  37 and name HD2* ))     3.27  1.47  0.49
 assign ((resid  33 and name HD1* ))   ( (resid  37 and name HD2* ))     3.56  1.76  0.53
 assign ((resid  33 and name HG   ))   ( (resid  37 and name HD2* ))     4.90  3.10  0.74
 assign ((resid  37 and name HD2* ))   ( (resid  40 and name HB   ))     3.96  2.16  0.59
 assign ((resid  33 and name HG   ))   ( (resid  37 and name HD1* ))     4.15  2.35  0.62
 assign ((resid  37 and name HD2* ))   ( (resid  81 and name HA   ))     4.75  2.95  0.71
 assign ((resid   8 and name HB   ))   ( (resid  40 and name HG1* ))     4.78  2.98  0.72
 assign ((resid  10 and name HB   ))   ( (resid  40 and name HG1* ))     4.98  3.18  0.75
 assign ((resid  40 and name HG1* ))   ( (resid  41 and name HG   ))     4.35  2.55  0.65
 assign ((resid  25 and name HG   ))   ( (resid  40 and name HG1* ))     5.47  3.67  0.82
 assign ((resid  39 and name HN   ))   ( (resid  40 and name HA   ))     5.68  3.88  0.85
 assign ((resid  39 and name HN   ))   ( (resid  40 and name HG2* ))     5.29  3.49  0.79
 assign ((resid  39 and name HN   ))   ( (resid  84 and name HG1* ))     5.77  3.97  0.87
 assign ((resid  37 and name HN   ))   ( (resid  40 and name HG2* ))     5.26  3.46  0.79
 assign ((resid  37 and name HN   ))   ( (resid  84 and name HG1* ))     5.54  3.74  0.83
 assign ((resid  41 and name HD1* ))   ( (resid  84 and name HN   ))     6.00  4.20  0.90
 assign ((resid  41 and name HD2* ))   ( (resid  45 and name HN   ))     5.33  3.53  0.80
 assign ((resid  41 and name HG   ))   ( (resid  44 and name HN   ))     6.00  4.20  0.90
 assign ((resid  40 and name HB   ))   ( (resid  41 and name HD1* ))     4.81  3.01  0.72
 assign ((resid  41 and name HD1* ))   ( (resid  84 and name HG1* ))     3.27  1.47  0.49
 assign ((resid  40 and name HG1* ))   ( (resid  41 and name HD1* ))     4.64  2.84  0.70
 assign ((resid  94 and name HB2  ))   ( (resid  95 and name HG2* ))     4.76  2.96  0.71
 assign ((resid  94 and name HA   ))   ( (resid  95 and name HA   ))     4.82  3.02  0.72
 assign ((resid  92 and name HA   ))   ( (resid  95 and name HB   ))     4.39  2.59  0.66
 assign ((resid  92 and name HA   ))   ( (resid  95 and name HG2* ))     3.96  2.16  0.59
 assign ((resid  94 and name HA   ))   ( (resid  95 and name HG2* ))     4.68  2.88  0.70
 assign ((resid  94 and name HB1  ))   ( (resid  95 and name HG2* ))     4.76  2.96  0.71
 assign ((resid  96 and name HB   ))   ( (resid 103 and name HG2* ))     4.70  2.90  0.70
 assign ((resid  95 and name HG1* ))   ( (resid  96 and name HG2* ))     5.19  3.39  0.78
 assign ((resid  95 and name HG1* ))   ( (resid  96 and name HA   ))     4.10  2.30  0.62
 assign ((resid  96 and name HG2* ))   ( (resid  97 and name HA   ))     4.25  2.45  0.64
 assign ((resid  96 and name HG2* ))   ( (resid  98 and name HN   ))     4.61  2.81  0.69
 assign ((resid  98 and name HB1  ))   ( (resid 101 and name HB   ))     5.63  3.83  0.84
 assign ((resid 100 and name HB2  ))   ( (resid 101 and name HN   ))     4.92  3.12  0.74
 assign ((resid 101 and name HG2* ))   ( (resid 103 and name HA   ))     4.31  2.51  0.65
 assign ((resid  61 and name HA   ))   ( (resid 101 and name HG2* ))     4.31  2.51  0.65
 assign ((resid  61 and name HG*  ))   ( (resid 101 and name HG2* ))     3.91  2.11  0.59
 assign ((resid  61 and name HB1  ))   ( (resid 101 and name HG2* ))     5.36  3.56  0.80
 assign ((resid 101 and name HA   ))   ( (resid 102 and name HA   ))     5.02  3.22  0.75
 assign ((resid 102 and name HA   ))   ( (resid 103 and name HB   ))     5.13  3.33  0.77
 assign ((resid  58 and name HG2* ))   ( (resid 103 and name HA   ))     5.21  3.41  0.78
 assign ((resid 103 and name HA   ))   ( (resid 104 and name HG1* ))     5.65  3.85  0.85
 assign ((resid 107 and name HG*  ))   ( (resid 108 and name HB*  ))     4.81  3.01  0.72
 assign ((resid 107 and name HG*  ))   ( (resid 108 and name HD1* ))     7.00  5.20  1.05
 assign ((resid 107 and name HG*  ))   ( (resid 108 and name HD2* ))     7.00  5.20  1.05
 assign ((resid  49 and name HD*  ))   ( (resid 108 and name HD2* ))     4.04  2.24  0.61
 assign ((resid  49 and name HB*  ))   ( (resid 108 and name HD2* ))     5.05  3.25  0.76
 assign ((resid  45 and name HE*  ))   ( (resid 108 and name HD1* ))     4.23  2.43  0.63
 assign ((resid  49 and name HB*  ))   ( (resid 108 and name HB*  ))     4.63  2.83  0.69
 assign ((resid  45 and name HE*  ))   ( (resid 108 and name HB*  ))     5.62  3.82  0.84
 assign ((resid  49 and name HA   ))   ( (resid 108 and name HD2* ))     5.31  3.51  0.80
 assign ((resid  49 and name HE*  ))   ( (resid 108 and name HD2* ))     4.64  2.84  0.70
 assign ((resid  49 and name HE*  ))   ( (resid 108 and name HD1* ))     4.72  2.92  0.71
 assign ((resid 108 and name HD2* ))   ( (resid 109 and name HA   ))     6.00  4.20  0.90
 assign ((resid 108 and name HD2* ))   ( (resid 109 and name HB2  ))     6.00  4.20  0.90
 assign ((resid 108 and name HD2* ))   ( (resid 109 and name HB1  ))     6.00  4.20  0.90
 assign ((resid  41 and name HD2* ))   ( (resid  85 and name HA   ))     5.21  3.41  0.78
 assign ((resid  40 and name HA   ))   ( (resid  43 and name HG1  ))     4.65  2.85  0.70
 assign ((resid  40 and name HA   ))   ( (resid  43 and name HG2  ))     4.65  2.85  0.70
 assign ((resid  56 and name HG1* ))   ( (resid  57 and name HN   ))     3.86  2.06  0.58
 assign ((resid  56 and name HG2* ))   ( (resid  57 and name HN   ))     4.04  2.24  0.61
 assign ((resid  13 and name HN   ))   ( (resid  56 and name HG2* ))     5.32  3.52  0.80
 assign ((resid  57 and name HB*  ))   ( (resid 103 and name HG2* ))     4.59  2.79  0.69
 assign ((resid  57 and name HG2  ))   ( (resid 103 and name HG2* ))     4.13  2.33  0.62
 assign ((resid  12 and name HA   ))   ( (resid  58 and name HB   ))     6.00  4.20  0.90
 assign ((resid  57 and name HA   ))   ( (resid  58 and name HB   ))     6.00  4.20  0.90
 assign ((resid  12 and name HA   ))   ( (resid  58 and name HG2* ))     4.12  2.32  0.62
 assign ((resid  58 and name HG2* ))   ( (resid  60 and name HN   ))     4.26  2.46  0.64
 assign ((resid  11 and name HB2  ))   ( (resid  59 and name HB1  ))     4.73  2.93  0.71
 assign ((resid  60 and name HG2* ))   ( (resid 102 and name HG1* ))     3.57  1.77  0.54
 assign ((resid  40 and name HG1* ))   ( (resid  60 and name HD1* ))     4.85  3.05  0.73
 assign ((resid  40 and name HG1* ))   ( (resid  60 and name HG2* ))     5.16  3.36  0.77
 assign ((resid  60 and name HG2* ))   ( (resid 104 and name HG1* ))     6.00  4.20  0.90
 assign ((resid  10 and name HA   ))   ( (resid  60 and name HG12 ))     4.98  3.18  0.75
 assign ((resid  10 and name HA   ))   ( (resid  60 and name HD1* ))     4.71  2.91  0.71
 assign ((resid  60 and name HG2* ))   ( (resid  85 and name HZ   ))     5.22  3.42  0.78
 assign ((resid  60 and name HG2* ))   ( (resid  77 and name HZ   ))     5.59  3.79  0.84
 assign ((resid   8 and name HG2* ))   ( (resid  62 and name HB   ))     5.08  3.28  0.76
 assign ((resid  62 and name HB   ))   ( (resid  81 and name HD1* ))     5.28  3.48  0.79
 assign ((resid   8 and name HA   ))   ( (resid  62 and name HB   ))     6.00  4.20  0.90
 assign ((resid  95 and name HG1* ))   ( (resid 103 and name HN   ))     5.09  3.29  0.76
 assign ((resid  62 and name HG1* ))   ( (resid  77 and name HD*  ))     4.26  2.46  0.64
 assign ((resid  62 and name HG1* ))   ( (resid  77 and name HE*  ))     4.45  2.65  0.67
 assign ((resid  62 and name HG1* ))   ( (resid  77 and name HZ   ))     5.43  3.63  0.81
 assign ((resid  85 and name HZ   ))   ( (resid  95 and name HG1* ))     4.85  3.05  0.73
 assign ((resid  62 and name HB   ))   ( (resid  64 and name HD2  ))     7.00  5.20  1.05
 assign ((resid   7 and name HN   ))   ( (resid  63 and name HG*  ))     4.76  2.96  0.71
 assign ((resid   7 and name HB*  ))   ( (resid  63 and name HG*  ))     4.16  2.36  0.62
 assign ((resid  45 and name HE*  ))   ( (resid  48 and name HG2* ))     2.87  1.07  0.43
 assign ((resid  46 and name HA   ))   ( (resid  48 and name HN   ))     4.86  3.06  0.73
 assign ((resid  47 and name HA   ))   ( (resid  51 and name HD2* ))     5.08  3.28  0.76
 assign ((resid  47 and name HB2  ))   ( (resid  51 and name HD2* ))     5.30  3.50  0.80
 assign ((resid  47 and name HB1  ))   ( (resid  51 and name HD2* ))     5.30  3.50  0.80
 assign ((resid  47 and name HG2  ))   ( (resid  48 and name HG1* ))     4.81  3.01  0.72
 assign ((resid  47 and name HG1  ))   ( (resid  48 and name HG1* ))     4.81  3.01  0.72
 assign ((resid  47 and name HD2  ))   ( (resid  48 and name HG1* ))     5.33  3.53  0.80
 assign ((resid  47 and name HD1  ))   ( (resid  48 and name HG1* ))     5.33  3.53  0.80
 assign ((resid  48 and name HD1* ))   ( (resid  56 and name HB   ))     5.84  4.04  0.88
 assign ((resid  48 and name HG2* ))   ( (resid  49 and name HE*  ))     5.98  4.18  0.90
 assign ((resid  48 and name HG2* ))   ( (resid  51 and name HG   ))     4.27  2.47  0.64
 assign ((resid  48 and name HG2* ))   ( (resid  51 and name HN   ))     4.95  3.15  0.74
 assign ((resid  31 and name HA   ))   ( (resid  34 and name HG2  ))     4.81  3.01  0.72
 assign ((resid  48 and name HG2* ))   ( (resid  49 and name HA   ))     3.93  2.13  0.59
 assign ((resid  49 and name HA   ))   ( (resid 108 and name HD1* ))     4.00  2.20  0.60
 assign ((resid  31 and name HA   ))   ( (resid  80 and name HG2* ))     4.44  2.64  0.67
 assign ((resid  48 and name HG2* ))   ( (resid  49 and name HG2  ))     4.70  2.90  0.70
 assign ((resid  49 and name HG2  ))   ( (resid 108 and name HD1* ))     4.39  2.59  0.66
 assign ((resid  49 and name HG2  ))   ( (resid 108 and name HD2* ))     4.85  3.05  0.73
 assign ((resid  48 and name HG2* ))   ( (resid  49 and name HG1  ))     4.70  2.90  0.70
 assign ((resid  49 and name HG1  ))   ( (resid 108 and name HD1* ))     4.39  2.59  0.66
 assign ((resid  49 and name HG1  ))   ( (resid 108 and name HD2* ))     4.85  3.05  0.73
 assign ((resid  48 and name HG2* ))   ( (resid  49 and name HD*  ))     5.56  3.76  0.83
 assign ((resid  49 and name HD*  ))   ( (resid 108 and name HD1* ))     4.45  2.65  0.67
 assign ((resid  48 and name HB   ))   ( (resid  51 and name HD1* ))     5.05  3.25  0.76
 assign ((resid  48 and name HD1* ))   ( (resid  51 and name HD1* ))     3.56  1.76  0.53
 assign ((resid  19 and name HE*  ))   ( (resid  51 and name HD2* ))     4.75  2.95  0.71
 assign ((resid  48 and name HG2* ))   ( (resid  52 and name HA1  ))     6.00  4.20  0.90
 assign ((resid  51 and name HD2* ))   ( (resid  52 and name HA1  ))     6.00  4.20  0.90
 assign ((resid  64 and name HB*  ))   ( (resid  70 and name HB*  ))     4.91  3.11  0.74
 assign ((resid  67 and name HB*  ))   ( (resid  70 and name HN   ))     5.21  3.41  0.78
 assign ((resid  68 and name HB*  ))   ( (resid  71 and name HB*  ))     5.51  3.71  0.83
 assign ((resid  71 and name HB*  ))   ( (resid  74 and name HB*  ))     5.76  3.96  0.86
 assign ((resid  70 and name HB*  ))   ( (resid  74 and name HB*  ))     4.46  2.66  0.67
 assign ((resid  64 and name HD2  ))   ( (resid  70 and name HA   ))     5.09  3.29  0.76
 assign ((resid  78 and name HA   ))   ( (resid  97 and name HH2  ))     4.16  2.36  0.62
 assign ((resid  78 and name HB*  ))   ( (resid  97 and name HH2  ))     4.42  2.62  0.66
 assign ((resid  78 and name HB*  ))   ( (resid  97 and name HZ3  ))     5.14  3.34  0.77
 assign ((resid  78 and name HB*  ))   ( (resid  81 and name HN   ))     4.95  3.15  0.74
 assign ((resid  12 and name HG2* ))   ( (resid  45 and name HE*  ))     4.53  2.73  0.68
 assign ((resid  79 and name HA   ))   ( (resid  80 and name HD1* ))     4.98  3.18  0.75
 assign ((resid  34 and name HA   ))   ( (resid  80 and name HD1* ))     5.18  3.38  0.78
 assign ((resid  81 and name HD2* ))   ( (resid  84 and name HA   ))     6.00  4.20  0.90
 assign ((resid  81 and name HD2* ))   ( (resid  85 and name HB*  ))     5.10  3.30  0.77
 assign ((resid  77 and name HB2  ))   ( (resid  81 and name HD1* ))     4.91  3.11  0.74
 assign ((resid  80 and name HG2* ))   ( (resid  83 and name HB*  ))     4.38  2.58  0.66
 assign ((resid  84 and name HG1* ))   ( (resid  85 and name HD*  ))     4.81  3.01  0.72
 assign ((resid  84 and name HG1* ))   ( (resid  85 and name HE*  ))     5.11  3.31  0.77
 assign ((resid  37 and name HN   ))   ( (resid  84 and name HG2* ))     4.42  2.62  0.66
 assign ((resid  42 and name HN   ))   ( (resid  84 and name HG1* ))     5.49  3.69  0.82
 assign ((resid  34 and name HA   ))   ( (resid  84 and name HG1* ))     4.80  3.00  0.72
 assign ((resid  36 and name HA   ))   ( (resid  40 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  37 and name HA   ))   ( (resid  84 and name HG2* ))     5.09  3.29  0.76
 assign ((resid  35 and name HA   ))   ( (resid  84 and name HG2* ))     5.17  3.37  0.78
 assign ((resid  84 and name HG1* ))   ( (resid  85 and name HA   ))     4.59  2.79  0.69
 assign ((resid  25 and name HD2* ))   ( (resid  40 and name HG2* ))     3.03  1.23  0.45
 assign ((resid  38 and name HG1  ))   ( (resid  84 and name HG2* ))     4.09  2.29  0.61
 assign ((resid   6 and name HA   ))   ( (resid  62 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  85 and name HB*  ))   ( (resid  88 and name HD1* ))     4.96  3.16  0.74
 assign ((resid  60 and name HB   ))   ( (resid  85 and name HZ   ))     5.09  3.29  0.76
 assign ((resid  87 and name HG1  ))   ( (resid  88 and name HN   ))     5.42  3.62  0.81
 assign ((resid  38 and name HG2  ))   ( (resid  88 and name HG   ))     4.72  2.92  0.71
 assign ((resid  84 and name HG1* ))   ( (resid  88 and name HD2* ))     4.07  2.27  0.61
 assign ((resid  41 and name HA   ))   ( (resid  88 and name HD2* ))     5.95  4.15  0.89
 assign ((resid  90 and name HB2  ))   ( (resid 104 and name HG1* ))     5.17  3.37  0.78
 assign ((resid  90 and name HB1  ))   ( (resid 104 and name HG1* ))     5.17  3.37  0.78
 assign ((resid  94 and name HA   ))   ( (resid 104 and name HG1* ))     5.31  3.51  0.80
 assign ((resid  94 and name HA   ))   ( (resid 104 and name HG2* ))     5.69  3.89  0.85
 assign ((resid   4 and name HA   ))   ( (resid   5 and name HB1  ))     5.27  3.47  0.79
 assign ((resid   4 and name HA   ))   ( (resid   5 and name HB2  ))     5.27  3.47  0.79
 assign ((resid  33 and name HD1* ))   ( (resid  36 and name HD1  ))     4.06  2.26  0.61
 assign ((resid  34 and name HD1  ))   ( (resid  80 and name HD1* ))     4.32  2.52  0.65
 assign ((resid  34 and name HD1  ))   ( (resid  80 and name HG2* ))     4.33  2.53  0.65
 assign ((resid   6 and name HG2* ))   ( (resid  62 and name HG2* ))     2.40  0.60  0.36
 assign ((resid  12 and name HD1* ))   ( (resid  49 and name HN   ))     5.67  3.87  0.85
 assign ((resid  10 and name HG1* ))   ( (resid  40 and name HG1* ))     4.50  2.70  0.68
 assign ((resid  10 and name HG2* ))   ( (resid  40 and name HG1* ))     4.50  2.70  0.68
 assign ((resid  81 and name HD2* ))   ( (resid 102 and name HG2* ))     4.77  2.97  0.72
 assign ((resid  95 and name HG2* ))   ( (resid 102 and name HG2* ))     4.73  2.93  0.71
 assign ((resid   6 and name HG2* ))   ( (resid  25 and name HG   ))     4.63  2.83  0.69
 assign ((resid  57 and name HG1  ))   ( (resid 103 and name HG2* ))     4.13  2.33  0.62
 assign ((resid  11 and name HD*  ))   ( (resid  59 and name HB2  ))     5.03  3.23  0.75
 assign ((resid  12 and name HG2* ))   ( (resid  48 and name HG1* ))     3.16  1.36  0.47
 assign ((resid   9 and name HG1  ))   ( (resid  22 and name HA   ))     5.33  3.53  0.80
 assign ((resid  10 and name HN   ))   ( (resid  23 and name HE*  ))     5.05  3.25  0.76
 assign ((resid  25 and name HD2* ))   ( (resid  40 and name HG1* ))     3.77  1.97  0.57
 assign ((resid  25 and name HD1* ))   ( (resid  40 and name HG1* ))     4.18  2.38  0.63
 assign ((resid  28 and name HG1* ))   ( (resid  29 and name HB1  ))     4.57  2.77  0.69
 assign ((resid  33 and name HD1* ))   ( (resid  37 and name HG   ))     2.97  1.17  0.45
 assign ((resid  31 and name HA   ))   ( (resid  34 and name HG1  ))     4.81  3.01  0.72
 assign ((resid  37 and name HD2* ))   ( (resid  77 and name HD*  ))     5.23  3.43  0.78
 assign ((resid  40 and name HG1* ))   ( (resid  41 and name HD2* ))     4.01  2.21  0.60
 assign ((resid  45 and name HA   ))   ( (resid  48 and name HG1* ))     3.87  2.07  0.58
 assign ((resid  12 and name HG2* ))   ( (resid  48 and name HD1* ))     3.63  1.83  0.54
 assign ((resid   5 and name HD*  ))   ( (resid  24 and name HA   ))     5.18  3.38  0.78
 assign ((resid   5 and name HD*  ))   ( (resid  26 and name HE*  ))     5.85  4.05  0.88
 assign ((resid  12 and name HB   ))   ( (resid  58 and name HG2* ))     4.82  3.02  0.72
 assign ((resid   5 and name HD*  ))   ( (resid   6 and name HG1* ))     5.26  3.46  0.79
 assign ((resid   6 and name HG1* ))   ( (resid  25 and name HG   ))     5.47  3.67  0.82
 assign ((resid  10 and name HA   ))   ( (resid  60 and name HG2* ))     5.12  3.32  0.77
 assign ((resid  61 and name HD*  ))   ( (resid 101 and name HG2* ))     3.76  1.96  0.56
 assign ((resid  66 and name HB2  ))   ( (resid  69 and name HG*  ))     5.39  3.59  0.81
 assign ((resid  66 and name HB1  ))   ( (resid  69 and name HG*  ))     5.39  3.59  0.81
 assign ((resid  70 and name HB*  ))   ( (resid  71 and name HN   ))     4.88  3.08  0.73
 assign ((resid  71 and name HN   ))   ( (resid  71 and name HD*  ))     4.82  3.02  0.72
 assign ((resid  74 and name HB*  ))   ( (resid  97 and name HZ3  ))     5.26  3.46  0.79
 assign ((resid   8 and name HG1* ))   ( (resid  77 and name HZ   ))     5.72  3.92  0.86
 assign ((resid  80 and name HG2* ))   ( (resid  81 and name HA   ))     4.06  2.26  0.61
 assign ((resid  37 and name HD1* ))   ( (resid  81 and name HG   ))     4.20  2.40  0.63
 assign ((resid   9 and name HG2  ))   ( (resid  22 and name HA   ))     5.33  3.53  0.80
 assign ((resid  85 and name HD*  ))   ( (resid  90 and name HB1  ))     4.93  3.13  0.74
 assign ((resid  10 and name HG2* ))   ( (resid  60 and name HA   ))     4.93  3.13  0.74
 assign ((resid  10 and name HG1* ))   ( (resid  60 and name HA   ))     4.93  3.13  0.74
 assign ((resid  10 and name HA   ))   ( (resid  60 and name HA   ))     3.86  2.06  0.58
 assign ((resid  60 and name HB   ))   ( (resid 102 and name HG1* ))     3.33  1.53  0.50
 assign ((resid  23 and name HB2  ))   ( (resid  25 and name HG   ))     5.11  3.31  0.77
 assign ((resid   6 and name HG1* ))   ( (resid  25 and name HB2  ))     5.10  3.30  0.77
 assign ((resid   6 and name HG1* ))   ( (resid  25 and name HB1  ))     5.10  3.30  0.77
 assign ((resid  30 and name HB2  ))   ( (resid  80 and name HG11 ))     5.44  3.64  0.82
 assign ((resid  30 and name HB1  ))   ( (resid  80 and name HG11 ))     5.44  3.64  0.82
 assign ((resid  30 and name HB2  ))   ( (resid  80 and name HG12 ))     5.44  3.64  0.82
 assign ((resid  30 and name HB1  ))   ( (resid  80 and name HG12 ))     5.44  3.64  0.82
 assign ((resid  27 and name HB*  ))   ( (resid  36 and name HE*  ))     4.21  2.41  0.63
 assign ((resid  33 and name HD2* ))   ( (resid  36 and name HE*  ))     4.01  2.21  0.60
 assign ((resid  37 and name HD2* ))   ( (resid  81 and name HG   ))     3.94  2.14  0.59
 assign ((resid   6 and name HA   ))   ( (resid  63 and name HB1  ))     4.51  2.71  0.68
 assign ((resid  60 and name HG2* ))   ( (resid  62 and name HG1* ))     5.44  3.64  0.82
 assign ((resid   8 and name HB   ))   ( (resid  60 and name HG2* ))     5.51  3.71  0.83
 assign ((resid   6 and name HA   ))   ( (resid  63 and name HB2  ))     4.51  2.71  0.68
 assign ((resid  64 and name HB*  ))   ( (resid  70 and name HG1  ))     4.67  2.87  0.70
 assign ((resid  64 and name HB*  ))   ( (resid  70 and name HG2  ))     4.67  2.87  0.70
 assign ((resid  76 and name HD*  ))   ( (resid  77 and name HD*  ))     5.31  3.51  0.80
 assign ((resid  62 and name HG1* ))   ( (resid  81 and name HD1* ))     5.46  3.66  0.82
 assign ((resid  10 and name HA   ))   ( (resid  61 and name HN   ))     4.49  2.69  0.67
 assign ((resid  12 and name HG2* ))   ( (resid  58 and name HA   ))     5.19  3.39  0.78
 assign ((resid  12 and name HD1* ))   ( (resid  58 and name HA   ))     4.40  2.60  0.66
 assign ((resid  12 and name HD1* ))   ( (resid  58 and name HB   ))     4.53  2.73  0.68
 assign ((resid  42 and name HA   ))   ( (resid  45 and name HB2  ))     4.06  2.26  0.61
 assign ((resid  42 and name HA   ))   ( (resid  45 and name HB1  ))     4.06  2.26  0.61
 assign ((resid  45 and name HA   ))   ( (resid  48 and name HN   ))     4.58  2.78  0.69
 assign ((resid  54 and name HA   ))   ( (resid  54 and name HE*  ))     5.00  3.20  0.75
 assign ((resid  45 and name HE*  ))   ( (resid  56 and name HG1* ))     3.83  2.03  0.57
 assign ((resid  45 and name HE*  ))   ( (resid  56 and name HG2* ))     3.92  2.12  0.59
 assign ((resid  13 and name HN   ))   ( (resid  56 and name HG1* ))     4.50  2.70  0.68
 assign ((resid  55 and name HA   ))   ( (resid  56 and name HG1* ))     3.90  2.10  0.59
 assign ((resid  55 and name HA   ))   ( (resid  56 and name HG2* ))     4.06  2.26  0.61
 assign ((resid   9 and name HB1  ))   ( (resid  61 and name HB2  ))     4.68  2.88  0.70
 assign ((resid   9 and name HB2  ))   ( (resid  61 and name HB1  ))     4.68  2.88  0.70
 assign ((resid   9 and name HB2  ))   ( (resid  61 and name HB2  ))     4.68  2.88  0.70
 assign ((resid  72 and name HG*  ))   ( (resid  73 and name HA   ))     5.84  4.04  0.88
 assign ((resid  73 and name HA   ))   ( (resid  76 and name HD*  ))     4.53  2.73  0.68
 assign ((resid   8 and name HG1* ))   ( (resid  62 and name HA   ))     4.72  2.92  0.71
 assign ((resid   8 and name HG2* ))   ( (resid  62 and name HA   ))     5.19  3.39  0.78
 assign ((resid  81 and name HG   ))   ( (resid  97 and name HH2  ))     5.38  3.58  0.81
 assign ((resid   9 and name HB1  ))   ( (resid  61 and name HB1  ))     4.68  2.88  0.70
 assign ((resid  25 and name HD1* ))   ( (resid  40 and name HB   ))     4.25  2.45  0.64
 assign ((resid  97 and name HE1  ))   ( (resid 102 and name HG1* ))     5.10  3.30  0.77
 assign ((resid 108 and name HD2* ))   ( (resid 109 and name HG*  ))     5.24  3.44  0.79
 assign ((resid  48 and name HB   ))   ( (resid 108 and name HD1* ))     6.00  4.20  0.90
 assign ((resid 108 and name HD1* ))   ( (resid 109 and name HG*  ))     6.00  4.20  0.90
 assign ((resid 108 and name HD1* ))   ( (resid 110 and name HA*  ))     6.00  4.20  0.90
 assign ((resid 108 and name HD2* ))   ( (resid 110 and name HA*  ))     6.00  4.20  0.90
 assign ((resid  41 and name HD2* ))   ( (resid  85 and name HZ   ))     4.97  3.17  0.75
 assign ((resid  41 and name HD1* ))   ( (resid  85 and name HZ   ))     4.78  2.98  0.72
 assign ((resid  45 and name HE*  ))   ( (resid  48 and name HG1* ))     3.99  2.19  0.60
 assign ((resid  50 and name HD*  ))   ( (resid  51 and name HA   ))     5.00  3.20  0.75
 assign ((resid  60 and name HD1* ))   ( (resid  61 and name HN   ))     5.17  3.37  0.78
 assign ((resid  59 and name HA   ))   ( (resid 103 and name HG2* ))     4.60  2.80  0.69
 assign ((resid  14 and name HA   ))   ( (resid  56 and name HG2* ))     5.95  4.15  0.89
 assign ((resid  56 and name HG2* ))   ( (resid  57 and name HA   ))     4.62  2.82  0.69
 assign ((resid  12 and name HA   ))   ( (resid  56 and name HG1* ))     5.90  4.10  0.89
 assign ((resid  56 and name HG1* ))   ( (resid  57 and name HA   ))     6.00  4.20  0.90
 assign ((resid  59 and name HA   ))   ( (resid  60 and name HD1* ))     5.26  3.46  0.79
 assign ((resid  11 and name HA   ))   ( (resid  20 and name HB2  ))     4.11  2.31  0.62
 assign ((resid  19 and name HA   ))   ( (resid  19 and name HD*  ))     3.67  1.87  0.55
 assign ((resid  23 and name HA   ))   ( (resid  23 and name HD*  ))     3.45  1.65  0.52
 assign ((resid  26 and name HA   ))   ( (resid  26 and name HD*  ))     3.20  1.40  0.48
 assign ((resid  64 and name HA   ))   ( (resid  64 and name HD2  ))     5.75  3.95  0.86
 assign ((resid  90 and name HA   ))   ( (resid  90 and name HD*  ))     3.86  2.06  0.58
 assign ((resid  13 and name HA   ))   ( (resid  19 and name HD*  ))     4.37  2.57  0.66
 assign ((resid  14 and name HN   ))   ( (resid  19 and name HD*  ))     4.36  2.56  0.65
 assign ((resid  14 and name HN   ))   ( (resid  19 and name HE*  ))     4.23  2.43  0.63
 assign ((resid  13 and name HA   ))   ( (resid  19 and name HE*  ))     4.54  2.74  0.68
 assign ((resid  18 and name HA   ))   ( (resid  19 and name HD*  ))     4.01  2.21  0.60
 assign ((resid  17 and name HE*  ))   ( (resid  19 and name HE*  ))     5.00  3.20  0.75
 assign ((resid  17 and name HB2  ))   ( (resid  19 and name HE*  ))     3.77  1.97  0.57
 assign ((resid  17 and name HD*  ))   ( (resid  19 and name HE*  ))     5.00  3.20  0.75
 assign ((resid  19 and name HE*  ))   ( (resid  51 and name HD1* ))     3.31  1.51  0.50
 assign ((resid  19 and name HD*  ))   ( (resid  51 and name HD1* ))     4.29  2.49  0.64
 assign ((resid  19 and name HD*  ))   ( (resid  48 and name HD1* ))     3.70  1.90  0.56
 assign ((resid  10 and name HB   ))   ( (resid  23 and name HD*  ))     4.41  2.61  0.66
 assign ((resid   8 and name HB   ))   ( (resid  23 and name HD*  ))     3.61  1.81  0.54
 assign ((resid  23 and name HD*  ))   ( (resid  40 and name HB   ))     4.50  2.70  0.68
 assign ((resid  22 and name HG2* ))   ( (resid  23 and name HD*  ))     5.15  3.35  0.77
 assign ((resid  23 and name HD*  ))   ( (resid  40 and name HG1* ))     3.56  1.76  0.53
 assign ((resid  23 and name HD*  ))   ( (resid  40 and name HG2* ))     3.80  2.00  0.57
 assign ((resid  23 and name HD*  ))   ( (resid  25 and name HD1* ))     4.52  2.72  0.68
 assign ((resid  23 and name HA   ))   ( (resid  23 and name HE*  ))     4.66  2.86  0.70
 assign ((resid  21 and name HD2  ))   ( (resid  23 and name HE*  ))     4.38  2.58  0.66
 assign ((resid  10 and name HB   ))   ( (resid  23 and name HE*  ))     3.47  1.67  0.52
 assign ((resid   8 and name HB   ))   ( (resid  23 and name HE*  ))     5.66  3.86  0.85
 assign ((resid  21 and name HB1  ))   ( (resid  23 and name HE*  ))     4.21  2.41  0.63
 assign ((resid  21 and name HG1  ))   ( (resid  23 and name HE*  ))     4.25  2.45  0.64
 assign ((resid  10 and name HG1* ))   ( (resid  23 and name HE*  ))     3.87  2.07  0.58
 assign ((resid  10 and name HG2* ))   ( (resid  23 and name HE*  ))     3.87  2.07  0.58
 assign ((resid   8 and name HG1* ))   ( (resid  23 and name HE*  ))     4.19  2.39  0.63
 assign ((resid  23 and name HE*  ))   ( (resid  40 and name HG1* ))     3.53  1.73  0.53
 assign ((resid   3 and name HA2  ))   ( (resid  26 and name HE*  ))     5.05  3.25  0.76
 assign ((resid  26 and name HD*  ))   ( (resid  27 and name HA   ))     4.04  2.24  0.61
 assign ((resid   5 and name HB2  ))   ( (resid  26 and name HD*  ))     4.03  2.23  0.60
 assign ((resid   5 and name HB1  ))   ( (resid  26 and name HD*  ))     4.03  2.23  0.60
 assign ((resid  26 and name HD*  ))   ( (resid  27 and name HB*  ))     4.67  2.87  0.70
 assign ((resid   5 and name HG*  ))   ( (resid  26 and name HD*  ))     3.43  1.63  0.51
 assign ((resid   4 and name HG*  ))   ( (resid  26 and name HD*  ))     6.00  4.20  0.90
 assign ((resid  26 and name HD*  ))   ( (resid  28 and name HG2* ))     4.29  2.49  0.64
 assign ((resid   5 and name HG*  ))   ( (resid  26 and name HE*  ))     6.00  4.20  0.90
 assign ((resid  26 and name HE*  ))   ( (resid  28 and name HG2* ))     3.40  1.60  0.51
 assign ((resid   4 and name HD*  ))   ( (resid  26 and name HE*  ))     6.00  4.20  0.90
 assign ((resid  62 and name HB   ))   ( (resid  77 and name HD*  ))     5.07  3.27  0.76
 assign ((resid  77 and name HD*  ))   ( (resid  80 and name HB   ))     5.36  3.56  0.80
 assign ((resid  77 and name HD*  ))   ( (resid  81 and name HD1* ))     4.30  2.50  0.65
 assign ((resid  62 and name HG2* ))   ( (resid  77 and name HD*  ))     4.09  2.29  0.61
 assign ((resid  37 and name HD1* ))   ( (resid  77 and name HD*  ))     4.58  2.78  0.69
 assign ((resid  77 and name HA   ))   ( (resid  77 and name HE*  ))     4.79  2.99  0.72
 assign ((resid  62 and name HB   ))   ( (resid  77 and name HE*  ))     4.71  2.91  0.71
 assign ((resid  62 and name HG2* ))   ( (resid  77 and name HE*  ))     3.75  1.95  0.56
 assign ((resid  37 and name HD1* ))   ( (resid  77 and name HE*  ))     4.13  2.33  0.62
 assign ((resid  77 and name HE*  ))   ( (resid  80 and name HG2* ))     4.52  2.72  0.68
 assign ((resid   8 and name HG2* ))   ( (resid  77 and name HZ   ))     3.85  2.05  0.58
 assign ((resid  62 and name HG2* ))   ( (resid  77 and name HZ   ))     3.64  1.84  0.55
 assign ((resid  37 and name HD1* ))   ( (resid  77 and name HZ   ))     3.85  2.05  0.58
 assign ((resid  60 and name HD1* ))   ( (resid  85 and name HD*  ))     4.18  2.38  0.63
 assign ((resid  41 and name HD1* ))   ( (resid  85 and name HD*  ))     4.22  2.42  0.63
 assign ((resid  81 and name HD2* ))   ( (resid  85 and name HE*  ))     3.79  1.99  0.57
 assign ((resid  85 and name HE*  ))   ( (resid  95 and name HG1* ))     4.15  2.35  0.62
 assign ((resid  85 and name HE*  ))   ( (resid 102 and name HG1* ))     4.13  2.33  0.62
 assign ((resid  60 and name HD1* ))   ( (resid  85 and name HZ   ))     3.47  1.67  0.52
 assign ((resid  81 and name HD2* ))   ( (resid  85 and name HZ   ))     3.49  1.69  0.52
 assign ((resid  85 and name HZ   ))   ( (resid 102 and name HG1* ))     3.77  1.97  0.57
 assign ((resid  85 and name HE*  ))   ( (resid 102 and name HG2* ))     4.34  2.54  0.65
 assign ((resid  85 and name HE*  ))   ( (resid 104 and name HG1* ))     4.91  3.11  0.74
 assign ((resid  85 and name HZ   ))   ( (resid 102 and name HG2* ))     4.44  2.64  0.67
 assign ((resid  85 and name HZ   ))   ( (resid 104 and name HG1* ))     5.05  3.25  0.76
 assign ((resid  85 and name HA   ))   ( (resid  90 and name HD*  ))     3.97  2.17  0.60
 assign ((resid  85 and name HB*  ))   ( (resid  90 and name HD*  ))     4.16  2.36  0.62
 assign ((resid  88 and name HB1  ))   ( (resid  90 and name HD*  ))     4.41  2.61  0.66
 assign ((resid  88 and name HB2  ))   ( (resid  90 and name HD*  ))     4.41  2.61  0.66
 assign ((resid  45 and name HE*  ))   ( (resid  90 and name HE*  ))     4.94  3.14  0.74
 assign ((resid  88 and name HB1  ))   ( (resid  90 and name HE*  ))     4.00  2.20  0.60
 assign ((resid  88 and name HB2  ))   ( (resid  90 and name HE*  ))     4.00  2.20  0.60
 assign ((resid  88 and name HD1* ))   ( (resid  90 and name HD*  ))     4.05  2.25  0.61
 assign ((resid  41 and name HD2* ))   ( (resid  90 and name HD*  ))     4.91  3.11  0.74
 assign ((resid  90 and name HD*  ))   ( (resid  95 and name HG2* ))     5.15  3.35  0.77
 assign ((resid  90 and name HD*  ))   ( (resid 104 and name HG1* ))     4.03  2.23  0.60
 assign ((resid  88 and name HD1* ))   ( (resid  90 and name HE*  ))     3.33  1.53  0.50
 assign ((resid  41 and name HD2* ))   ( (resid  90 and name HE*  ))     3.53  1.73  0.53
 assign ((resid  90 and name HE*  ))   ( (resid 104 and name HG2* ))     5.30  3.50  0.80
 assign ((resid  97 and name HN   ))   ( (resid  97 and name HD1  ))     4.28  2.48  0.64
 assign ((resid  95 and name HG1* ))   ( (resid  97 and name HD1  ))     3.65  1.85  0.55
 assign ((resid  97 and name HD1  ))   ( (resid 102 and name HG2* ))     4.12  2.32  0.62
 assign ((resid  85 and name HE*  ))   ( (resid  97 and name HZ2  ))     5.17  3.37  0.78
 assign ((resid  78 and name HA   ))   ( (resid  97 and name HZ2  ))     3.67  1.87  0.55
 assign ((resid  74 and name HA   ))   ( (resid  97 and name HH2  ))     4.44  2.64  0.67
 assign ((resid  78 and name HB*  ))   ( (resid  97 and name HZ2  ))     3.99  2.19  0.60
 assign ((resid  81 and name HD1* ))   ( (resid  97 and name HZ2  ))     3.72  1.92  0.56
 assign ((resid  97 and name HZ2  ))   ( (resid 102 and name HG1* ))     4.59  2.79  0.69
 assign ((resid  62 and name HB   ))   ( (resid  97 and name HH2  ))     5.30  3.50  0.80
 assign ((resid  74 and name HB*  ))   ( (resid  97 and name HH2  ))     5.01  3.21  0.75
 assign ((resid  81 and name HD1* ))   ( (resid  97 and name HH2  ))     3.60  1.80  0.54
 assign ((resid  97 and name HH2  ))   ( (resid 102 and name HG1* ))     4.98  3.18  0.75
 assign ((resid  12 and name HG2* ))   ( (resid  19 and name HD*  ))     3.56  1.76  0.53
 assign ((resid  18 and name HG2* ))   ( (resid  19 and name HD*  ))     4.74  2.94  0.71
 assign ((resid  17 and name HB1  ))   ( (resid  19 and name HE*  ))     3.77  1.97  0.57
 assign ((resid  19 and name HE*  ))   ( (resid  48 and name HD1* ))     4.01  2.21  0.60
 assign ((resid  12 and name HG2* ))   ( (resid  19 and name HE*  ))     4.08  2.28  0.61
 assign ((resid   8 and name HN   ))   ( (resid  23 and name HD*  ))     5.03  3.23  0.75
 assign ((resid   8 and name HA   ))   ( (resid  23 and name HD*  ))     5.68  3.88  0.85
 assign ((resid   9 and name HA   ))   ( (resid  23 and name HD*  ))     5.95  4.15  0.89
 assign ((resid  21 and name HG2  ))   ( (resid  23 and name HE*  ))     4.25  2.45  0.64
 assign ((resid  26 and name HD*  ))   ( (resid  27 and name HN   ))     4.07  2.27  0.61
 assign ((resid   5 and name HN   ))   ( (resid  26 and name HD*  ))     4.24  2.44  0.64
 assign ((resid   4 and name HA   ))   ( (resid  26 and name HE*  ))     4.48  2.68  0.67
 assign ((resid  26 and name HE*  ))   ( (resid  28 and name HB   ))     6.00  4.20  0.90
 assign ((resid  85 and name HA   ))   ( (resid  90 and name HE*  ))     4.47  2.67  0.67
 assign ((resid  41 and name HD1* ))   ( (resid  90 and name HD*  ))     4.26  2.46  0.64
 assign ((resid  41 and name HD1* ))   ( (resid  90 and name HE*  ))     3.73  1.93  0.56
 assign ((resid  58 and name HD1* ))   ( (resid  90 and name HE*  ))     4.24  2.44  0.64
 assign ((resid  97 and name HZ2  ))   ( (resid 102 and name HG2* ))     4.40  2.60  0.66
 assign ((resid  23 and name HN   ))   ( (resid  23 and name HD*  ))     3.65  1.85  0.55
 assign ((resid  60 and name HG12 ))   ( (resid  85 and name HZ   ))     5.20  3.40  0.78
 assign ((resid  85 and name HZ   ))   ( (resid 104 and name HG2* ))     4.48  2.68  0.67
 assign ((resid  82 and name HA   ))   ( (resid  85 and name HD*  ))     4.86  3.06  0.73
 assign ((resid  85 and name HD*  ))   ( (resid  90 and name HB2  ))     4.93  3.13  0.74
 assign ((resid  81 and name HD1* ))   ( (resid  97 and name HZ3  ))     5.70  3.90  0.86
 assign ((resid  33 and name HG   ))   ( (resid  77 and name HD*  ))     5.53  3.73  0.83
 assign ((resid  33 and name HG   ))   ( (resid  77 and name HE*  ))     4.72  2.92  0.71
 assign ((resid  10 and name HN   ))   ( (resid  23 and name HD*  ))     4.53  2.73  0.68
 assign ((resid  85 and name HD*  ))   ( (resid 104 and name HG2* ))     4.70  2.90  0.70
 assign ((resid  85 and name HE*  ))   ( (resid 104 and name HG2* ))     4.49  2.69  0.67
 assign ((resid  85 and name HD*  ))   ( (resid  90 and name HE*  ))     4.53  2.73  0.68
 assign ((resid  14 and name SG   ))   ( (resid  53 and name SG   ))     2.05  0.30  0.31
 assign ((resid  14 and name SG   ))   ( (resid  53 and name CB   ))     3.05  1.30  0.46
 assign ((resid  14 and name CB   ))   ( (resid  53 and name SG   ))     3.05  1.30  0.46
 assign ((resid   3 and name HA*  ))   ( (resid  26 and name HD*  ))     4.96  3.16  0.74
 assign ((resid   3 and name HA*  ))   ( (resid  26 and name HE*  ))     4.19  2.39  0.63
 assign ((resid   3 and name HA*  ))   ( (resid  28 and name HA   ))     3.25  1.45  0.49
 assign ((resid   3 and name HA*  ))   ( (resid  28 and name HG1* ))     4.08  2.28  0.61
 assign ((resid   3 and name HA*  ))   ( (resid  28 and name HG2* ))     4.52  2.72  0.68
 assign ((resid   4 and name HA   ))   ( (resid   5 and name HB*  ))     4.43  2.63  0.66
 assign ((resid   4 and name HB*  ))   ( (resid   4 and name HD*  ))     2.92  1.12  0.44
 assign ((resid   4 and name HB*  ))   ( (resid   4 and name HE*  ))     3.29  1.49  0.49
 assign ((resid   4 and name HB*  ))   ( (resid   5 and name HN   ))     3.55  1.75  0.53
 assign ((resid   4 and name HB*  ))   ( (resid  26 and name HE*  ))     6.00  4.20  0.90
 assign ((resid   5 and name HA   ))   ( (resid  26 and name HB*  ))     4.26  2.46  0.64
 assign ((resid   5 and name HB*  ))   ( (resid   5 and name HD*  ))     2.53  0.73  0.38
 assign ((resid   5 and name HB*  ))   ( (resid   5 and name HE*  ))     3.55  1.75  0.53
 assign ((resid   5 and name HB*  ))   ( (resid   6 and name HN   ))     4.05  2.25  0.61
 assign ((resid   5 and name HB*  ))   ( (resid  26 and name HD*  ))     3.22  1.42  0.48
 assign ((resid   5 and name HB*  ))   ( (resid  26 and name HE*  ))     5.00  3.20  0.75
 assign ((resid   5 and name HG*  ))   ( (resid  24 and name HB*  ))     4.20  2.40  0.63
 assign ((resid   5 and name HG*  ))   ( (resid  24 and name HG*  ))     4.15  2.35  0.62
 assign ((resid   5 and name HD*  ))   ( (resid   7 and name HG*  ))     6.00  4.20  0.90
 assign ((resid   5 and name HD*  ))   ( (resid  24 and name HB*  ))     3.38  1.58  0.51
 assign ((resid   5 and name HD*  ))   ( (resid  24 and name HG*  ))     5.00  3.20  0.75
 assign ((resid   5 and name HE*  ))   ( (resid   7 and name HG*  ))     4.42  2.62  0.66
 assign ((resid   5 and name HE*  ))   ( (resid  24 and name HB*  ))     4.68  2.88  0.70
 assign ((resid   5 and name HE*  ))   ( (resid  24 and name HG*  ))     3.89  2.09  0.58
 assign ((resid   6 and name HN   ))   ( (resid  26 and name HB*  ))     4.53  2.73  0.68
 assign ((resid   6 and name HA   ))   ( (resid  63 and name HB*  ))     3.93  2.13  0.59
 assign ((resid   6 and name HG1* ))   ( (resid  25 and name HB*  ))     4.40  2.60  0.66
 assign ((resid   6 and name HG1* ))   ( (resid  63 and name HB*  ))     4.93  3.13  0.74
 assign ((resid   6 and name HG2* ))   ( (resid  25 and name HB*  ))     4.13  2.33  0.62
 assign ((resid   6 and name HG2* ))   ( (resid  63 and name HB*  ))     3.43  1.63  0.51
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HG*  ))     3.75  1.95  0.56
 assign ((resid   7 and name HN   ))   ( (resid  63 and name HB*  ))     3.81  2.01  0.57
 assign ((resid   7 and name HA   ))   ( (resid   7 and name HG*  ))     3.47  1.67  0.52
 assign ((resid   7 and name HA   ))   ( (resid  24 and name HG*  ))     4.23  2.43  0.63
 assign ((resid   7 and name HB*  ))   ( (resid   7 and name HG*  ))     2.35  0.55  0.35
 assign ((resid   7 and name HB*  ))   ( (resid  24 and name HE*  ))     5.08  3.28  0.76
 assign ((resid   7 and name HB*  ))   ( (resid  63 and name HB*  ))     3.04  1.24  0.46
 assign ((resid   7 and name HG*  ))   ( (resid   8 and name HN   ))     3.92  2.12  0.59
 assign ((resid   7 and name HG*  ))   ( (resid  22 and name HG2* ))     3.14  1.34  0.47
 assign ((resid   7 and name HG*  ))   ( (resid  24 and name HG*  ))     3.52  1.72  0.53
 assign ((resid   7 and name HG*  ))   ( (resid  24 and name HE*  ))     4.69  2.89  0.70
 assign ((resid   7 and name HG*  ))   ( (resid  63 and name HD*  ))     5.81  4.01  0.87
 assign ((resid   8 and name HN   ))   ( (resid  23 and name HB*  ))     4.25  2.45  0.64
 assign ((resid   8 and name HB   ))   ( (resid  10 and name HG*  ))     4.25  2.45  0.64
 assign ((resid   8 and name HB   ))   ( (resid  23 and name HB*  ))     3.49  1.69  0.52
 assign ((resid   8 and name HG1* ))   ( (resid   9 and name HB*  ))     4.72  2.92  0.71
 assign ((resid   8 and name HG1* ))   ( (resid  23 and name HB*  ))     4.27  2.47  0.64
 assign ((resid   8 and name HG1* ))   ( (resid  60 and name HG1* ))     4.09  2.29  0.61
 assign ((resid   8 and name HG2* ))   ( (resid  23 and name HB*  ))     4.27  2.47  0.64
 assign ((resid   8 and name HG2* ))   ( (resid  25 and name HB*  ))     4.01  2.21  0.60
 assign ((resid   9 and name HN   ))   ( (resid   9 and name HB*  ))     3.15  1.35  0.47
 assign ((resid   9 and name HN   ))   ( (resid   9 and name HG*  ))     3.40  1.60  0.51
 assign ((resid   9 and name HA   ))   ( (resid   9 and name HG*  ))     3.37  1.57  0.51
 assign ((resid   9 and name HA   ))   ( (resid   9 and name HE*  ))     4.67  2.87  0.70
 assign ((resid   9 and name HA   ))   ( (resid  61 and name HB*  ))     5.81  4.01  0.87
 assign ((resid   9 and name HB*  ))   ( (resid   9 and name HG*  ))     2.23  0.43  0.33
 assign ((resid   9 and name HB*  ))   ( (resid   9 and name HE*  ))     3.45  1.65  0.52
 assign ((resid   9 and name HB*  ))   ( (resid  10 and name HN   ))     3.80  2.00  0.57
 assign ((resid   9 and name HB*  ))   ( (resid  22 and name HA   ))     5.21  3.41  0.78
 assign ((resid   9 and name HB*  ))   ( (resid  22 and name HG2* ))     4.74  2.94  0.71
 assign ((resid   9 and name HB*  ))   ( (resid  60 and name HA   ))     5.51  3.71  0.83
 assign ((resid   9 and name HB*  ))   ( (resid  61 and name HN   ))     3.88  2.08  0.58
 assign ((resid   9 and name HB*  ))   ( (resid  61 and name HB*  ))     3.02  1.22  0.45
 assign ((resid   9 and name HB*  ))   ( (resid  61 and name HG*  ))     4.93  3.13  0.74
 assign ((resid   9 and name HB*  ))   ( (resid  61 and name HD*  ))     4.22  2.42  0.63
 assign ((resid   9 and name HG*  ))   ( (resid   9 and name HE*  ))     3.07  1.27  0.46
 assign ((resid   9 and name HG*  ))   ( (resid  10 and name HN   ))     4.08  2.28  0.61
 assign ((resid   9 and name HG*  ))   ( (resid  22 and name HA   ))     4.57  2.77  0.69
 assign ((resid   9 and name HG*  ))   ( (resid  22 and name HG2* ))     3.90  2.10  0.59
 assign ((resid  10 and name HN   ))   ( (resid  10 and name HG*  ))     3.40  1.60  0.51
 assign ((resid  10 and name HA   ))   ( (resid  11 and name HB*  ))     4.32  2.52  0.65
 assign ((resid  10 and name HA   ))   ( (resid  60 and name HG1* ))     4.18  2.38  0.63
 assign ((resid  10 and name HB   ))   ( (resid  21 and name HB*  ))     5.18  3.38  0.78
 assign ((resid  10 and name HG*  ))   ( (resid  11 and name HN   ))     3.38  1.58  0.51
 assign ((resid  10 and name HG*  ))   ( (resid  11 and name HA   ))     4.47  2.67  0.67
 assign ((resid  10 and name HG*  ))   ( (resid  12 and name HB   ))     3.92  2.12  0.59
 assign ((resid  10 and name HG*  ))   ( (resid  21 and name HN   ))     5.05  3.25  0.76
 assign ((resid  10 and name HG*  ))   ( (resid  23 and name HN   ))     5.12  3.32  0.77
 assign ((resid  10 and name HG*  ))   ( (resid  23 and name HD*  ))     3.28  1.48  0.49
 assign ((resid  10 and name HG*  ))   ( (resid  23 and name HE*  ))     3.11  1.31  0.47
 assign ((resid  10 and name HG*  ))   ( (resid  40 and name HB   ))     4.67  2.87  0.70
 assign ((resid  10 and name HG*  ))   ( (resid  40 and name HG1* ))     3.58  1.78  0.54
 assign ((resid  10 and name HG*  ))   ( (resid  40 and name HG2* ))     4.56  2.76  0.68
 assign ((resid  10 and name HG*  ))   ( (resid  41 and name HA   ))     4.06  2.26  0.61
 assign ((resid  10 and name HG*  ))   ( (resid  44 and name HB*  ))     3.93  2.13  0.59
 assign ((resid  10 and name HG*  ))   ( (resid  44 and name HG*  ))     3.57  1.77  0.54
 assign ((resid  10 and name HG*  ))   ( (resid  44 and name HD*  ))     4.84  3.04  0.73
 assign ((resid  10 and name HG*  ))   ( (resid  60 and name HA   ))     4.12  2.32  0.62
 assign ((resid  10 and name HG*  ))   ( (resid  60 and name HG1* ))     3.33  1.53  0.50
 assign ((resid  10 and name HG*  ))   ( (resid  61 and name HN   ))     4.54  2.74  0.68
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HB*  ))     3.27  1.47  0.49
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HG*  ))     4.24  2.44  0.64
 assign ((resid  11 and name HN   ))   ( (resid  58 and name HG1* ))     5.51  3.71  0.83
 assign ((resid  11 and name HN   ))   ( (resid  59 and name HB*  ))     4.01  2.21  0.60
 assign ((resid  11 and name HA   ))   ( (resid  11 and name HG*  ))     3.74  1.94  0.56
 assign ((resid  11 and name HA   ))   ( (resid  20 and name HB*  ))     3.56  1.76  0.53
 assign ((resid  11 and name HA   ))   ( (resid  20 and name HG*  ))     4.21  2.41  0.63
 assign ((resid  11 and name HB*  ))   ( (resid  11 and name HD*  ))     2.49  0.69  0.37
 assign ((resid  11 and name HB*  ))   ( (resid  11 and name HE*  ))     3.06  1.26  0.46
 assign ((resid  11 and name HB*  ))   ( (resid  12 and name HN   ))     4.10  2.30  0.62
 assign ((resid  11 and name HB*  ))   ( (resid  18 and name HG2* ))     3.90  2.10  0.59
 assign ((resid  11 and name HB*  ))   ( (resid  20 and name HA   ))     5.14  3.34  0.77
 assign ((resid  11 and name HB*  ))   ( (resid  20 and name HG*  ))     4.43  2.63  0.66
 assign ((resid  11 and name HB*  ))   ( (resid  59 and name HB*  ))     3.35  1.55  0.50
 assign ((resid  11 and name HG*  ))   ( (resid  12 and name HN   ))     4.83  3.03  0.72
 assign ((resid  11 and name HG*  ))   ( (resid  18 and name HG2* ))     3.67  1.87  0.55
 assign ((resid  11 and name HG*  ))   ( (resid  20 and name HA   ))     4.36  2.56  0.65
 assign ((resid  11 and name HG*  ))   ( (resid  20 and name HB*  ))     3.30  1.50  0.50
 assign ((resid  11 and name HG*  ))   ( (resid  20 and name HG*  ))     3.50  1.70  0.53
 assign ((resid  11 and name HD*  ))   ( (resid  20 and name HB*  ))     4.32  2.52  0.65
 assign ((resid  11 and name HD*  ))   ( (resid  20 and name HG*  ))     4.76  2.96  0.71
 assign ((resid  11 and name HD*  ))   ( (resid  59 and name HB*  ))     4.31  2.51  0.65
 assign ((resid  11 and name HE*  ))   ( (resid  20 and name HB*  ))     4.27  2.47  0.64
 assign ((resid  11 and name HE*  ))   ( (resid  20 and name HG*  ))     5.00  3.20  0.75
 assign ((resid  12 and name HN   ))   ( (resid  12 and name HG1* ))     4.45  2.65  0.67
 assign ((resid  12 and name HN   ))   ( (resid  19 and name HB*  ))     5.04  3.24  0.76
 assign ((resid  12 and name HB   ))   ( (resid  19 and name HB*  ))     5.29  3.49  0.79
 assign ((resid  12 and name HB   ))   ( (resid  58 and name HG1* ))     3.83  2.03  0.57
 assign ((resid  12 and name HG2* ))   ( (resid  14 and name HB*  ))     4.67  2.87  0.70
 assign ((resid  12 and name HG2* ))   ( (resid  19 and name HB*  ))     4.52  2.72  0.68
 assign ((resid  12 and name HG2* ))   ( (resid  44 and name HG*  ))     3.53  1.73  0.53
 assign ((resid  12 and name HG1* ))   ( (resid  13 and name HN   ))     3.65  1.85  0.55
 assign ((resid  12 and name HG1* ))   ( (resid  14 and name HB*  ))     5.02  3.22  0.75
 assign ((resid  12 and name HG1* ))   ( (resid  19 and name HD*  ))     4.45  2.65  0.67
 assign ((resid  12 and name HG1* ))   ( (resid  45 and name HA   ))     5.36  3.56  0.80
 assign ((resid  12 and name HG1* ))   ( (resid  48 and name HD1* ))     4.61  2.81  0.69
 assign ((resid  12 and name HG1* ))   ( (resid  56 and name HG1* ))     4.32  2.52  0.65
 assign ((resid  12 and name HG1* ))   ( (resid  58 and name HB   ))     5.81  4.01  0.87
 assign ((resid  12 and name HG1* ))   ( (resid  58 and name HG1* ))     3.59  1.79  0.54
 assign ((resid  12 and name HG1* ))   ( (resid  58 and name HD1* ))     4.59  2.79  0.69
 assign ((resid  12 and name HD1* ))   ( (resid  44 and name HB*  ))     4.09  2.29  0.61
 assign ((resid  12 and name HD1* ))   ( (resid  58 and name HG1* ))     3.30  1.50  0.50
 assign ((resid  13 and name HN   ))   ( (resid  58 and name HG1* ))     5.28  3.48  0.79
 assign ((resid  13 and name HB   ))   ( (resid  57 and name HG*  ))     5.59  3.79  0.84
 assign ((resid  13 and name HG2* ))   ( (resid  14 and name HB*  ))     5.10  3.30  0.77
 assign ((resid  13 and name HG2* ))   ( (resid  16 and name HA*  ))     3.96  2.16  0.59
 assign ((resid  14 and name HN   ))   ( (resid  14 and name HB*  ))     3.58  1.78  0.54
 assign ((resid  14 and name HN   ))   ( (resid  17 and name HB*  ))     4.56  2.76  0.68
 assign ((resid  14 and name HB*  ))   ( (resid  19 and name HD*  ))     4.33  2.53  0.65
 assign ((resid  14 and name HB*  ))   ( (resid  19 and name HE*  ))     3.41  1.61  0.51
 assign ((resid  14 and name HB*  ))   ( (resid  48 and name HG2* ))     4.14  2.34  0.62
 assign ((resid  14 and name HB*  ))   ( (resid  48 and name HG1* ))     5.10  3.30  0.77
 assign ((resid  14 and name HB*  ))   ( (resid  48 and name HD1* ))     4.24  2.44  0.64
 assign ((resid  14 and name HB*  ))   ( (resid  51 and name HD1* ))     3.44  1.64  0.52
 assign ((resid  14 and name HB*  ))   ( (resid  56 and name HG1* ))     3.63  1.83  0.54
 assign ((resid  14 and name HB*  ))   ( (resid  56 and name HG2* ))     5.81  4.01  0.87
 assign ((resid  15 and name HB*  ))   ( (resid  51 and name HD1* ))     4.79  2.99  0.72
 assign ((resid  17 and name HN   ))   ( (resid  17 and name HB*  ))     3.23  1.43  0.48
 assign ((resid  17 and name HN   ))   ( (resid  17 and name HG*  ))     3.47  1.67  0.52
 assign ((resid  17 and name HA   ))   ( (resid  17 and name HG*  ))     3.42  1.62  0.51
 assign ((resid  17 and name HB*  ))   ( (resid  17 and name HD*  ))     2.47  0.67  0.37
 assign ((resid  17 and name HB*  ))   ( (resid  17 and name HE*  ))     4.00  2.20  0.60
 assign ((resid  17 and name HB*  ))   ( (resid  18 and name HN   ))     3.51  1.71  0.53
 assign ((resid  17 and name HB*  ))   ( (resid  19 and name HD*  ))     4.21  2.41  0.63
 assign ((resid  17 and name HB*  ))   ( (resid  19 and name HE*  ))     3.22  1.42  0.48
 assign ((resid  17 and name HG*  ))   ( (resid  17 and name HE*  ))     3.32  1.52  0.50
 assign ((resid  17 and name HG*  ))   ( (resid  18 and name HN   ))     4.48  2.68  0.67
 assign ((resid  18 and name HG2* ))   ( (resid  20 and name HB*  ))     3.96  2.16  0.59
 assign ((resid  18 and name HG2* ))   ( (resid  20 and name HG*  ))     3.87  2.07  0.58
 assign ((resid  19 and name HN   ))   ( (resid  19 and name HB*  ))     3.41  1.61  0.51
 assign ((resid  19 and name HB*  ))   ( (resid  48 and name HD1* ))     4.57  2.77  0.69
 assign ((resid  20 and name HA   ))   ( (resid  20 and name HG*  ))     3.69  1.89  0.55
 assign ((resid  20 and name HA   ))   ( (resid  21 and name HB*  ))     5.39  3.59  0.81
 assign ((resid  20 and name HB*  ))   ( (resid  20 and name HG*  ))     2.24  0.44  0.34
 assign ((resid  20 and name HB*  ))   ( (resid  21 and name HN   ))     3.63  1.83  0.54
 assign ((resid  20 and name HG*  ))   ( (resid  21 and name HN   ))     4.14  2.34  0.62
 assign ((resid  21 and name HN   ))   ( (resid  21 and name HG*  ))     4.78  2.98  0.72
 assign ((resid  21 and name HA   ))   ( (resid  21 and name HG*  ))     3.48  1.68  0.52
 assign ((resid  21 and name HB*  ))   ( (resid  21 and name HD*  ))     2.97  1.17  0.45
 assign ((resid  21 and name HB*  ))   ( (resid  22 and name HN   ))     3.78  1.98  0.57
 assign ((resid  21 and name HB*  ))   ( (resid  23 and name HD*  ))     4.38  2.58  0.66
 assign ((resid  21 and name HB*  ))   ( (resid  23 and name HE*  ))     3.36  1.56  0.50
 assign ((resid  21 and name HB*  ))   ( (resid  44 and name HD*  ))     4.29  2.49  0.64
 assign ((resid  21 and name HG*  ))   ( (resid  22 and name HN   ))     3.57  1.77  0.54
 assign ((resid  21 and name HD*  ))   ( (resid  22 and name HN   ))     4.85  3.05  0.73
 assign ((resid  21 and name HD*  ))   ( (resid  23 and name HD*  ))     5.33  3.53  0.80
 assign ((resid  22 and name HG2* ))   ( (resid  24 and name HG*  ))     4.37  2.57  0.66
 assign ((resid  22 and name HG2* ))   ( (resid  24 and name HE*  ))     4.64  2.84  0.70
 assign ((resid  23 and name HN   ))   ( (resid  23 and name HB*  ))     3.51  1.71  0.53
 assign ((resid  23 and name HB*  ))   ( (resid  24 and name HN   ))     3.72  1.92  0.56
 assign ((resid  23 and name HB*  ))   ( (resid  24 and name HB*  ))     5.61  3.81  0.84
 assign ((resid  23 and name HB*  ))   ( (resid  25 and name HG   ))     4.27  2.47  0.64
 assign ((resid  23 and name HB*  ))   ( (resid  25 and name HD1* ))     4.43  2.63  0.66
 assign ((resid  23 and name HB*  ))   ( (resid  25 and name HD2* ))     3.46  1.66  0.52
 assign ((resid  23 and name HB*  ))   ( (resid  40 and name HG1* ))     5.33  3.53  0.80
 assign ((resid  23 and name HE*  ))   ( (resid  44 and name HB*  ))     5.73  3.93  0.86
 assign ((resid  23 and name HE*  ))   ( (resid  44 and name HG*  ))     4.52  2.72  0.68
 assign ((resid  23 and name HE*  ))   ( (resid  44 and name HD*  ))     3.98  2.18  0.60
 assign ((resid  24 and name HN   ))   ( (resid  24 and name HB*  ))     3.39  1.59  0.51
 assign ((resid  24 and name HN   ))   ( (resid  24 and name HG*  ))     3.81  2.01  0.57
 assign ((resid  24 and name HB*  ))   ( (resid  24 and name HE*  ))     4.62  2.82  0.69
 assign ((resid  24 and name HB*  ))   ( (resid  25 and name HN   ))     3.67  1.87  0.55
 assign ((resid  24 and name HG*  ))   ( (resid  25 and name HN   ))     4.27  2.47  0.64
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HB*  ))     3.16  1.36  0.47
 assign ((resid  25 and name HB*  ))   ( (resid  25 and name HG   ))     2.51  0.71  0.38
 assign ((resid  25 and name HB*  ))   ( (resid  25 and name HD1* ))     2.88  1.08  0.43
 assign ((resid  25 and name HB*  ))   ( (resid  25 and name HD2* ))     3.01  1.21  0.45
 assign ((resid  25 and name HB*  ))   ( (resid  33 and name HD1* ))     3.04  1.24  0.46
 assign ((resid  25 and name HB*  ))   ( (resid  33 and name HD2* ))     3.16  1.36  0.47
 assign ((resid  25 and name HB*  ))   ( (resid  36 and name HB*  ))     4.00  2.20  0.60
 assign ((resid  25 and name HB*  ))   ( (resid  36 and name HD*  ))     3.37  1.57  0.51
 assign ((resid  25 and name HB*  ))   ( (resid  62 and name HG2* ))     5.64  3.84  0.85
 assign ((resid  25 and name HB*  ))   ( (resid  77 and name HE*  ))     5.81  4.01  0.87
 assign ((resid  25 and name HB*  ))   ( (resid  77 and name HZ   ))     5.16  3.36  0.77
 assign ((resid  25 and name HD1* ))   ( (resid  36 and name HB*  ))     3.51  1.71  0.53
 assign ((resid  25 and name HD1* ))   ( (resid  36 and name HG*  ))     4.73  2.93  0.71
 assign ((resid  25 and name HD2* ))   ( (resid  36 and name HB*  ))     3.35  1.55  0.50
 assign ((resid  25 and name HD2* ))   ( (resid  36 and name HD*  ))     3.54  1.74  0.53
 assign ((resid  26 and name HB*  ))   ( (resid  27 and name HN   ))     3.98  2.18  0.60
 assign ((resid  27 and name HA   ))   ( (resid  36 and name HD*  ))     4.38  2.58  0.66
 assign ((resid  27 and name HB*  ))   ( (resid  32 and name HB*  ))     3.55  1.75  0.53
 assign ((resid  27 and name HB*  ))   ( (resid  32 and name HG*  ))     3.71  1.91  0.56
 assign ((resid  27 and name HB*  ))   ( (resid  33 and name HB*  ))     3.08  1.28  0.46
 assign ((resid  27 and name HB*  ))   ( (resid  36 and name HG*  ))     3.87  2.07  0.58
 assign ((resid  28 and name HB   ))   ( (resid  29 and name HG*  ))     3.82  2.02  0.57
 assign ((resid  28 and name HG1* ))   ( (resid  29 and name HG*  ))     3.06  1.26  0.46
 assign ((resid  28 and name HG1* ))   ( (resid  32 and name HB*  ))     5.75  3.95  0.86
 assign ((resid  28 and name HG1* ))   ( (resid  32 and name HG*  ))     4.54  2.74  0.68
 assign ((resid  28 and name HG2* ))   ( (resid  29 and name HG*  ))     4.77  2.97  0.72
 assign ((resid  28 and name HG2* ))   ( (resid  32 and name HB*  ))     5.13  3.33  0.77
 assign ((resid  28 and name HG2* ))   ( (resid  32 and name HG*  ))     5.40  3.60  0.81
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HB*  ))     3.53  1.73  0.53
 assign ((resid  29 and name HN   ))   ( (resid  32 and name HB*  ))     3.67  1.87  0.55
 assign ((resid  29 and name HN   ))   ( (resid  32 and name HG*  ))     3.65  1.85  0.55
 assign ((resid  29 and name HA   ))   ( (resid  29 and name HG*  ))     3.37  1.57  0.51
 assign ((resid  29 and name HB*  ))   ( (resid  31 and name HN   ))     5.08  3.28  0.76
 assign ((resid  29 and name HB*  ))   ( (resid  31 and name HG*  ))     4.28  2.48  0.64
 assign ((resid  29 and name HB*  ))   ( (resid  32 and name HN   ))     3.62  1.82  0.54
 assign ((resid  29 and name HB*  ))   ( (resid  32 and name HB*  ))     4.80  3.00  0.72
 assign ((resid  29 and name HB*  ))   ( (resid  32 and name HG*  ))     3.14  1.34  0.47
 assign ((resid  29 and name HG*  ))   ( (resid  32 and name HN   ))     4.26  2.46  0.64
 assign ((resid  29 and name HG*  ))   ( (resid  32 and name HG*  ))     5.00  3.20  0.75
 assign ((resid  29 and name HD*  ))   ( (resid  31 and name HG*  ))     5.00  3.20  0.75
 assign ((resid  29 and name HD*  ))   ( (resid  32 and name HG*  ))     5.27  3.47  0.79
 assign ((resid  30 and name HA   ))   ( (resid  80 and name HG1* ))     4.48  2.68  0.67
 assign ((resid  30 and name HB*  ))   ( (resid  80 and name HG1* ))     4.17  2.37  0.63
 assign ((resid  31 and name HN   ))   ( (resid  31 and name HG*  ))     4.44  2.64  0.67
 assign ((resid  31 and name HA   ))   ( (resid  31 and name HG*  ))     3.32  1.52  0.50
 assign ((resid  31 and name HA   ))   ( (resid  34 and name HB*  ))     4.32  2.52  0.65
 assign ((resid  31 and name HA   ))   ( (resid  34 and name HG*  ))     4.09  2.29  0.61
 assign ((resid  31 and name HA   ))   ( (resid  34 and name HD*  ))     3.51  1.71  0.53
 assign ((resid  31 and name HA   ))   ( (resid  34 and name HE*  ))     4.99  3.19  0.75
 assign ((resid  31 and name HG*  ))   ( (resid  32 and name HN   ))     3.90  2.10  0.59
 assign ((resid  32 and name HN   ))   ( (resid  32 and name HB*  ))     2.99  1.19  0.45
 assign ((resid  32 and name HN   ))   ( (resid  32 and name HG*  ))     3.29  1.49  0.49
 assign ((resid  32 and name HN   ))   ( (resid  33 and name HB*  ))     4.55  2.75  0.68
 assign ((resid  32 and name HA   ))   ( (resid  32 and name HG*  ))     3.19  1.39  0.48
 assign ((resid  32 and name HA   ))   ( (resid  35 and name HG*  ))     4.28  2.48  0.64
 assign ((resid  32 and name HB*  ))   ( (resid  32 and name HG*  ))     2.13  0.33  0.32
 assign ((resid  32 and name HB*  ))   ( (resid  33 and name HN   ))     3.61  1.81  0.54
 assign ((resid  32 and name HB*  ))   ( (resid  36 and name HG*  ))     4.61  2.81  0.69
 assign ((resid  32 and name HB*  ))   ( (resid  36 and name HE*  ))     4.01  2.21  0.60
 assign ((resid  32 and name HG*  ))   ( (resid  33 and name HN   ))     4.52  2.72  0.68
 assign ((resid  33 and name HN   ))   ( (resid  33 and name HB*  ))     2.91  1.11  0.44
 assign ((resid  33 and name HN   ))   ( (resid  35 and name HG*  ))     5.81  4.01  0.87
 assign ((resid  33 and name HN   ))   ( (resid  36 and name HG*  ))     4.46  2.66  0.67
 assign ((resid  33 and name HA   ))   ( (resid  36 and name HB*  ))     3.20  1.40  0.48
 assign ((resid  33 and name HA   ))   ( (resid  36 and name HG*  ))     3.55  1.75  0.53
 assign ((resid  33 and name HA   ))   ( (resid  36 and name HD*  ))     4.54  2.74  0.68
 assign ((resid  33 and name HB*  ))   ( (resid  33 and name HD2* ))     2.89  1.09  0.43
 assign ((resid  33 and name HB*  ))   ( (resid  34 and name HN   ))     3.11  1.31  0.47
 assign ((resid  33 and name HB*  ))   ( (resid  34 and name HG*  ))     4.02  2.22  0.60
 assign ((resid  33 and name HB*  ))   ( (resid  77 and name HE*  ))     4.92  3.12  0.74
 assign ((resid  33 and name HB*  ))   ( (resid  80 and name HG1* ))     3.70  1.90  0.56
 assign ((resid  33 and name HG   ))   ( (resid  80 and name HG1* ))     5.32  3.52  0.80
 assign ((resid  33 and name HD1* ))   ( (resid  34 and name HG*  ))     5.19  3.39  0.78
 assign ((resid  33 and name HD1* ))   ( (resid  36 and name HB*  ))     4.59  2.79  0.69
 assign ((resid  33 and name HD1* ))   ( (resid  36 and name HD*  ))     3.54  1.74  0.53
 assign ((resid  33 and name HD2* ))   ( (resid  36 and name HB*  ))     4.39  2.59  0.66
 assign ((resid  33 and name HD2* ))   ( (resid  36 and name HG*  ))     3.59  1.79  0.54
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HB*  ))     2.88  1.08  0.43
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HG*  ))     3.26  1.46  0.49
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HD*  ))     3.75  1.95  0.56
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HE*  ))     5.09  3.29  0.76
 assign ((resid  34 and name HA   ))   ( (resid  37 and name HB*  ))     3.83  2.03  0.57
 assign ((resid  34 and name HA   ))   ( (resid  38 and name HG*  ))     4.40  2.60  0.66
 assign ((resid  34 and name HB*  ))   ( (resid  34 and name HD*  ))     2.60  0.80  0.39
 assign ((resid  34 and name HB*  ))   ( (resid  34 and name HE*  ))     3.06  1.26  0.46
 assign ((resid  34 and name HB*  ))   ( (resid  35 and name HA   ))     4.15  2.35  0.62
 assign ((resid  34 and name HB*  ))   ( (resid  37 and name HB*  ))     4.94  3.14  0.74
 assign ((resid  34 and name HB*  ))   ( (resid  37 and name HD1* ))     5.40  3.60  0.81
 assign ((resid  34 and name HB*  ))   ( (resid  80 and name HG2* ))     3.41  1.61  0.51
 assign ((resid  34 and name HB*  ))   ( (resid  84 and name HG2* ))     3.89  2.09  0.58
 assign ((resid  34 and name HG*  ))   ( (resid  34 and name HD*  ))     2.29  0.49  0.34
 assign ((resid  34 and name HG*  ))   ( (resid  34 and name HE*  ))     2.98  1.18  0.45
 assign ((resid  34 and name HG*  ))   ( (resid  35 and name HN   ))     4.28  2.48  0.64
 assign ((resid  34 and name HG*  ))   ( (resid  80 and name HB   ))     4.55  2.75  0.68
 assign ((resid  34 and name HG*  ))   ( (resid  80 and name HG2* ))     3.14  1.34  0.47
 assign ((resid  34 and name HG*  ))   ( (resid  84 and name HN   ))     4.89  3.09  0.73
 assign ((resid  34 and name HG*  ))   ( (resid  84 and name HA   ))     5.32  3.52  0.80
 assign ((resid  34 and name HG*  ))   ( (resid  84 and name HG2* ))     3.42  1.62  0.51
 assign ((resid  34 and name HD*  ))   ( (resid  35 and name HN   ))     4.59  2.79  0.69
 assign ((resid  34 and name HD*  ))   ( (resid  80 and name HN   ))     5.81  4.01  0.87
 assign ((resid  34 and name HD*  ))   ( (resid  80 and name HG2* ))     3.77  1.97  0.57
 assign ((resid  34 and name HE*  ))   ( (resid  80 and name HD1* ))     4.64  2.84  0.70
 assign ((resid  34 and name HE*  ))   ( (resid  83 and name HB*  ))     4.02  2.22  0.60
 assign ((resid  35 and name HN   ))   ( (resid  35 and name HG*  ))     3.04  1.24  0.46
 assign ((resid  35 and name HN   ))   ( (resid  38 and name HG*  ))     5.62  3.82  0.84
 assign ((resid  35 and name HN   ))   ( (resid  38 and name HD*  ))     4.29  2.49  0.64
 assign ((resid  35 and name HA   ))   ( (resid  35 and name HG*  ))     3.65  1.85  0.55
 assign ((resid  35 and name HA   ))   ( (resid  38 and name HB*  ))     3.30  1.50  0.50
 assign ((resid  35 and name HA   ))   ( (resid  38 and name HG*  ))     4.23  2.43  0.63
 assign ((resid  35 and name HA   ))   ( (resid  38 and name HD*  ))     3.13  1.33  0.47
 assign ((resid  35 and name HA   ))   ( (resid  38 and name HE*  ))     4.89  3.09  0.73
 assign ((resid  35 and name HB*  ))   ( (resid  36 and name HG*  ))     4.81  3.01  0.72
 assign ((resid  35 and name HG*  ))   ( (resid  36 and name HN   ))     3.81  2.01  0.57
 assign ((resid  35 and name HG*  ))   ( (resid  36 and name HA   ))     4.35  2.55  0.65
 assign ((resid  35 and name HG*  ))   ( (resid  36 and name HG*  ))     4.19  2.39  0.63
 assign ((resid  35 and name HG*  ))   ( (resid  36 and name HE*  ))     3.99  2.19  0.60
 assign ((resid  36 and name HN   ))   ( (resid  36 and name HB*  ))     2.92  1.12  0.44
 assign ((resid  36 and name HN   ))   ( (resid  36 and name HG*  ))     2.96  1.16  0.44
 assign ((resid  36 and name HN   ))   ( (resid  36 and name HD*  ))     4.53  2.73  0.68
 assign ((resid  36 and name HA   ))   ( (resid  36 and name HG*  ))     3.08  1.28  0.46
 assign ((resid  36 and name HA   ))   ( (resid  36 and name HD*  ))     3.88  2.08  0.58
 assign ((resid  36 and name HA   ))   ( (resid  39 and name HG*  ))     3.93  2.13  0.59
 assign ((resid  36 and name HB*  ))   ( (resid  36 and name HG*  ))     2.36  0.56  0.35
 assign ((resid  36 and name HB*  ))   ( (resid  36 and name HD*  ))     2.52  0.72  0.38
 assign ((resid  36 and name HB*  ))   ( (resid  36 and name HE*  ))     3.66  1.86  0.55
 assign ((resid  36 and name HB*  ))   ( (resid  37 and name HN   ))     2.85  1.05  0.43
 assign ((resid  36 and name HB*  ))   ( (resid  37 and name HG   ))     4.02  2.22  0.60
 assign ((resid  36 and name HG*  ))   ( (resid  36 and name HD*  ))     2.33  0.53  0.35
 assign ((resid  36 and name HG*  ))   ( (resid  36 and name HE*  ))     2.92  1.12  0.44
 assign ((resid  36 and name HG*  ))   ( (resid  37 and name HN   ))     3.81  2.01  0.57
 assign ((resid  37 and name HN   ))   ( (resid  37 and name HB*  ))     3.26  1.46  0.49
 assign ((resid  37 and name HB*  ))   ( (resid  37 and name HD1* ))     3.21  1.41  0.48
 assign ((resid  37 and name HB*  ))   ( (resid  37 and name HD2* ))     3.06  1.26  0.46
 assign ((resid  37 and name HB*  ))   ( (resid  38 and name HN   ))     3.14  1.34  0.47
 assign ((resid  37 and name HB*  ))   ( (resid  41 and name HD1* ))     4.04  2.24  0.61
 assign ((resid  37 and name HB*  ))   ( (resid  81 and name HD2* ))     4.61  2.81  0.69
 assign ((resid  37 and name HB*  ))   ( (resid  84 and name HG1* ))     3.72  1.92  0.56
 assign ((resid  37 and name HB*  ))   ( (resid  84 and name HG2* ))     3.55  1.75  0.53
 assign ((resid  37 and name HD1* ))   ( (resid  77 and name HB*  ))     5.65  3.85  0.85
 assign ((resid  37 and name HD1* ))   ( (resid  80 and name HG1* ))     5.81  4.01  0.87
 assign ((resid  38 and name HN   ))   ( (resid  38 and name HB*  ))     2.97  1.17  0.45
 assign ((resid  38 and name HN   ))   ( (resid  38 and name HG*  ))     3.15  1.35  0.47
 assign ((resid  38 and name HN   ))   ( (resid  38 and name HD*  ))     3.72  1.92  0.56
 assign ((resid  38 and name HN   ))   ( (resid  41 and name HB*  ))     5.15  3.35  0.77
 assign ((resid  38 and name HA   ))   ( (resid  38 and name HD*  ))     4.51  2.71  0.68
 assign ((resid  38 and name HA   ))   ( (resid  41 and name HB*  ))     3.44  1.64  0.52
 assign ((resid  38 and name HB*  ))   ( (resid  38 and name HD*  ))     2.71  0.91  0.41
 assign ((resid  38 and name HB*  ))   ( (resid  38 and name HE*  ))     3.73  1.93  0.56
 assign ((resid  38 and name HB*  ))   ( (resid  39 and name HN   ))     3.22  1.42  0.48
 assign ((resid  38 and name HB*  ))   ( (resid  42 and name HB*  ))     5.61  3.81  0.84
 assign ((resid  38 and name HB*  ))   ( (resid  88 and name HD1* ))     4.91  3.11  0.74
 assign ((resid  38 and name HB*  ))   ( (resid  88 and name HD2* ))     3.25  1.45  0.49
 assign ((resid  38 and name HG*  ))   ( (resid  38 and name HD*  ))     2.24  0.44  0.34
 assign ((resid  38 and name HG*  ))   ( (resid  38 and name HE*  ))     3.08  1.28  0.46
 assign ((resid  38 and name HG*  ))   ( (resid  39 and name HN   ))     4.33  2.53  0.65
 assign ((resid  38 and name HG*  ))   ( (resid  41 and name HD1* ))     4.69  2.89  0.70
 assign ((resid  38 and name HG*  ))   ( (resid  84 and name HA   ))     3.85  2.05  0.58
 assign ((resid  38 and name HG*  ))   ( (resid  84 and name HG2* ))     3.28  1.48  0.49
 assign ((resid  38 and name HG*  ))   ( (resid  87 and name HB*  ))     4.55  2.75  0.68
 assign ((resid  38 and name HG*  ))   ( (resid  88 and name HD1* ))     4.08  2.28  0.61
 assign ((resid  38 and name HG*  ))   ( (resid  88 and name HD2* ))     3.69  1.89  0.55
 assign ((resid  38 and name HD*  ))   ( (resid  84 and name HG1* ))     5.02  3.22  0.75
 assign ((resid  38 and name HD*  ))   ( (resid  84 and name HG2* ))     4.53  2.73  0.68
 assign ((resid  38 and name HD*  ))   ( (resid  87 and name HB*  ))     4.86  3.06  0.73
 assign ((resid  38 and name HD*  ))   ( (resid  88 and name HD2* ))     5.76  3.96  0.86
 assign ((resid  38 and name HE*  ))   ( (resid  84 and name HA   ))     3.99  2.19  0.60
 assign ((resid  38 and name HE*  ))   ( (resid  87 and name HB*  ))     3.69  1.89  0.55
 assign ((resid  38 and name HE*  ))   ( (resid  88 and name HN   ))     5.49  3.69  0.82
 assign ((resid  38 and name HE*  ))   ( (resid  88 and name HG   ))     5.21  3.41  0.78
 assign ((resid  38 and name HE*  ))   ( (resid  88 and name HD2* ))     3.88  2.08  0.58
 assign ((resid  39 and name HN   ))   ( (resid  39 and name HG*  ))     3.54  1.74  0.53
 assign ((resid  39 and name HA   ))   ( (resid  39 and name HG*  ))     3.32  1.52  0.50
 assign ((resid  39 and name HA   ))   ( (resid  42 and name HB*  ))     3.45  1.65  0.52
 assign ((resid  39 and name HB*  ))   ( (resid  42 and name HB*  ))     5.81  4.01  0.87
 assign ((resid  39 and name HG*  ))   ( (resid  39 and name HE*  ))     2.73  0.93  0.41
 assign ((resid  39 and name HG*  ))   ( (resid  40 and name HN   ))     4.11  2.31  0.62
 assign ((resid  40 and name HN   ))   ( (resid  41 and name HB*  ))     5.46  3.66  0.82
 assign ((resid  40 and name HA   ))   ( (resid  43 and name HB*  ))     3.66  1.86  0.55
 assign ((resid  40 and name HG1* ))   ( (resid  43 and name HB*  ))     5.39  3.59  0.81
 assign ((resid  40 and name HG1* ))   ( (resid  44 and name HG*  ))     5.01  3.21  0.75
 assign ((resid  41 and name HN   ))   ( (resid  41 and name HB*  ))     2.94  1.14  0.44
 assign ((resid  41 and name HA   ))   ( (resid  44 and name HB*  ))     3.61  1.81  0.54
 assign ((resid  41 and name HB*  ))   ( (resid  41 and name HG   ))     2.50  0.70  0.38
 assign ((resid  41 and name HB*  ))   ( (resid  41 and name HD1* ))     2.85  1.05  0.43
 assign ((resid  41 and name HB*  ))   ( (resid  41 and name HD2* ))     2.89  1.09  0.43
 assign ((resid  41 and name HB*  ))   ( (resid  42 and name HA   ))     4.62  2.82  0.69
 assign ((resid  41 and name HB*  ))   ( (resid  44 and name HN   ))     5.28  3.48  0.79
 assign ((resid  41 and name HB*  ))   ( (resid  88 and name HD1* ))     3.40  1.60  0.51
 assign ((resid  41 and name HD1* ))   ( (resid  45 and name HG*  ))     5.01  3.21  0.75
 assign ((resid  42 and name HN   ))   ( (resid  42 and name HB*  ))     3.06  1.26  0.46
 assign ((resid  42 and name HA   ))   ( (resid  45 and name HG*  ))     4.24  2.44  0.64
 assign ((resid  43 and name HN   ))   ( (resid  43 and name HB*  ))     3.39  1.59  0.51
 assign ((resid  43 and name HN   ))   ( (resid  43 and name HG*  ))     3.74  1.94  0.56
 assign ((resid  43 and name HA   ))   ( (resid  43 and name HG*  ))     3.23  1.43  0.48
 assign ((resid  43 and name HA   ))   ( (resid  46 and name HB*  ))     3.53  1.73  0.53
 assign ((resid  43 and name HB*  ))   ( (resid  43 and name HG*  ))     2.31  0.51  0.35
 assign ((resid  43 and name HB*  ))   ( (resid  44 and name HN   ))     3.33  1.53  0.50
 assign ((resid  43 and name HB*  ))   ( (resid  44 and name HA   ))     5.32  3.52  0.80
 assign ((resid  43 and name HB*  ))   ( (resid  46 and name HB*  ))     5.61  3.81  0.84
 assign ((resid  43 and name HG*  ))   ( (resid  44 and name HN   ))     4.39  2.59  0.66
 assign ((resid  44 and name HN   ))   ( (resid  44 and name HB*  ))     3.41  1.61  0.51
 assign ((resid  44 and name HN   ))   ( (resid  47 and name HD*  ))     5.81  4.01  0.87
 assign ((resid  44 and name HA   ))   ( (resid  44 and name HG*  ))     3.64  1.84  0.55
 assign ((resid  44 and name HA   ))   ( (resid  44 and name HD*  ))     3.37  1.57  0.51
 assign ((resid  44 and name HA   ))   ( (resid  47 and name HD*  ))     3.85  2.05  0.58
 assign ((resid  44 and name HB*  ))   ( (resid  45 and name HN   ))     3.73  1.93  0.56
 assign ((resid  45 and name HN   ))   ( (resid  45 and name HG*  ))     3.65  1.85  0.55
 assign ((resid  45 and name HN   ))   ( (resid  46 and name HB*  ))     4.61  2.81  0.69
 assign ((resid  45 and name HA   ))   ( (resid  45 and name HG*  ))     3.72  1.92  0.56
 assign ((resid  45 and name HB*  ))   ( (resid  45 and name HE*  ))     2.36  0.56  0.35
 assign ((resid  45 and name HB*  ))   ( (resid  46 and name HN   ))     3.65  1.85  0.55
 assign ((resid  45 and name HG*  ))   ( (resid  45 and name HE*  ))     3.41  1.61  0.51
 assign ((resid  45 and name HG*  ))   ( (resid  46 and name HN   ))     5.03  3.23  0.75
 assign ((resid  45 and name HE*  ))   ( (resid  49 and name HG*  ))     4.51  2.71  0.68
 assign ((resid  46 and name HN   ))   ( (resid  46 and name HB*  ))     3.27  1.47  0.49
 assign ((resid  46 and name HN   ))   ( (resid  47 and name HG*  ))     5.76  3.96  0.86
 assign ((resid  46 and name HN   ))   ( (resid  47 and name HD*  ))     3.40  1.60  0.51
 assign ((resid  46 and name HA   ))   ( (resid  49 and name HG*  ))     4.86  3.06  0.73
 assign ((resid  46 and name HB*  ))   ( (resid  47 and name HA   ))     4.11  2.31  0.62
 assign ((resid  46 and name HB*  ))   ( (resid  47 and name HB*  ))     4.48  2.68  0.67
 assign ((resid  46 and name HB*  ))   ( (resid  47 and name HG*  ))     4.02  2.22  0.60
 assign ((resid  46 and name HB*  ))   ( (resid  47 and name HD*  ))     2.67  0.87  0.40
 assign ((resid  46 and name HB*  ))   ( (resid  49 and name HD*  ))     5.81  4.01  0.87
 assign ((resid  47 and name HA   ))   ( (resid  50 and name HB*  ))     2.86  1.06  0.43
 assign ((resid  47 and name HA   ))   ( (resid  50 and name HG*  ))     4.32  2.52  0.65
 assign ((resid  47 and name HB*  ))   ( (resid  48 and name HA   ))     4.19  2.39  0.63
 assign ((resid  47 and name HB*  ))   ( (resid  48 and name HD1* ))     4.98  3.18  0.75
 assign ((resid  47 and name HB*  ))   ( (resid  50 and name HE*  ))     4.40  2.60  0.66
 assign ((resid  47 and name HB*  ))   ( (resid  51 and name HD1* ))     5.02  3.22  0.75
 assign ((resid  47 and name HB*  ))   ( (resid  51 and name HD2* ))     4.44  2.64  0.67
 assign ((resid  47 and name HG*  ))   ( (resid  48 and name HN   ))     3.86  2.06  0.58
 assign ((resid  47 and name HG*  ))   ( (resid  48 and name HA   ))     4.74  2.94  0.71
 assign ((resid  47 and name HG*  ))   ( (resid  48 and name HG2* ))     5.69  3.89  0.85
 assign ((resid  47 and name HG*  ))   ( (resid  48 and name HG1* ))     4.19  2.39  0.63
 assign ((resid  47 and name HG*  ))   ( (resid  48 and name HD1* ))     5.06  3.26  0.76
 assign ((resid  47 and name HG*  ))   ( (resid  51 and name HD1* ))     5.81  4.01  0.87
 assign ((resid  47 and name HD*  ))   ( (resid  48 and name HN   ))     4.08  2.28  0.61
 assign ((resid  47 and name HD*  ))   ( (resid  48 and name HG1* ))     4.60  2.80  0.69
 assign ((resid  47 and name HD*  ))   ( (resid  49 and name HN   ))     5.81  4.01  0.87
 assign ((resid  48 and name HA   ))   ( (resid  51 and name HB*  ))     4.18  2.38  0.63
 assign ((resid  48 and name HG2* ))   ( (resid  49 and name HG*  ))     4.05  2.25  0.61
 assign ((resid  48 and name HG2* ))   ( (resid  53 and name HB*  ))     4.66  2.86  0.70
 assign ((resid  49 and name HN   ))   ( (resid  49 and name HG*  ))     3.30  1.50  0.50
 assign ((resid  49 and name HA   ))   ( (resid  49 and name HG*  ))     3.26  1.46  0.49
 assign ((resid  49 and name HG*  ))   ( (resid 108 and name HD1* ))     3.77  1.97  0.57
 assign ((resid  49 and name HG*  ))   ( (resid 108 and name HD2* ))     4.21  2.41  0.63
 assign ((resid  50 and name HN   ))   ( (resid  50 and name HB*  ))     3.38  1.58  0.51
 assign ((resid  50 and name HN   ))   ( (resid  50 and name HG*  ))     4.24  2.44  0.64
 assign ((resid  50 and name HA   ))   ( (resid  50 and name HG*  ))     3.22  1.42  0.48
 assign ((resid  50 and name HB*  ))   ( (resid  50 and name HD*  ))     2.90  1.10  0.44
 assign ((resid  50 and name HB*  ))   ( (resid  51 and name HN   ))     3.81  2.01  0.57
 assign ((resid  50 and name HB*  ))   ( (resid  51 and name HG   ))     4.56  2.76  0.68
 assign ((resid  50 and name HG*  ))   ( (resid  50 and name HD*  ))     2.38  0.58  0.36
 assign ((resid  50 and name HG*  ))   ( (resid  51 and name HD2* ))     5.69  3.89  0.85
 assign ((resid  51 and name HN   ))   ( (resid  51 and name HB*  ))     3.03  1.23  0.45
 assign ((resid  51 and name HA   ))   ( (resid  52 and name HA*  ))     5.09  3.29  0.76
 assign ((resid  51 and name HB*  ))   ( (resid  51 and name HD2* ))     2.95  1.15  0.44
 assign ((resid  51 and name HB*  ))   ( (resid  52 and name HA*  ))     4.72  2.92  0.71
 assign ((resid  52 and name HN   ))   ( (resid  53 and name HB*  ))     5.60  3.80  0.84
 assign ((resid  53 and name HB*  ))   ( (resid  54 and name HA   ))     4.93  3.13  0.74
 assign ((resid  53 and name HB*  ))   ( (resid  55 and name HN   ))     5.25  3.45  0.79
 assign ((resid  53 and name HB*  ))   ( (resid  55 and name HA   ))     5.20  3.40  0.78
 assign ((resid  53 and name HB*  ))   ( (resid  56 and name HG1* ))     3.29  1.49  0.49
 assign ((resid  53 and name HB*  ))   ( (resid  56 and name HG2* ))     4.46  2.66  0.67
 assign ((resid  54 and name HA   ))   ( (resid  54 and name HG*  ))     3.41  1.61  0.51
 assign ((resid  54 and name HB*  ))   ( (resid  54 and name HD*  ))     2.86  1.06  0.43
 assign ((resid  54 and name HB*  ))   ( (resid  54 and name HE*  ))     3.60  1.80  0.54
 assign ((resid  54 and name HG*  ))   ( (resid  55 and name HN   ))     4.38  2.58  0.66
 assign ((resid  55 and name HN   ))   ( (resid  55 and name HB*  ))     3.32  1.52  0.50
 assign ((resid  55 and name HN   ))   ( (resid  55 and name HG*  ))     4.70  2.90  0.70
 assign ((resid  55 and name HA   ))   ( (resid  55 and name HG*  ))     3.18  1.38  0.48
 assign ((resid  55 and name HB*  ))   ( (resid  55 and name HD*  ))     3.01  1.21  0.45
 assign ((resid  55 and name HG*  ))   ( (resid  56 and name HN   ))     3.65  1.85  0.55
 assign ((resid  55 and name HG*  ))   ( (resid  56 and name HG1* ))     6.00  4.20  0.90
 assign ((resid  55 and name HG*  ))   ( (resid  56 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  55 and name HG*  ))   ( (resid 105 and name HB*  ))     4.95  3.15  0.74
 assign ((resid  55 and name HD*  ))   ( (resid 105 and name HB*  ))     4.63  2.83  0.69
 assign ((resid  55 and name HD*  ))   ( (resid 105 and name HG*  ))     6.00  4.20  0.90
 assign ((resid  56 and name HG2* ))   ( (resid  58 and name HG1* ))     3.77  1.97  0.57
 assign ((resid  56 and name HG2* ))   ( (resid 106 and name HA*  ))     5.18  3.38  0.78
 assign ((resid  57 and name HA   ))   ( (resid  57 and name HG*  ))     3.73  1.93  0.56
 assign ((resid  57 and name HG*  ))   ( (resid  58 and name HN   ))     3.96  2.16  0.59
 assign ((resid  57 and name HG*  ))   ( (resid  59 and name HN   ))     5.54  3.74  0.83
 assign ((resid  58 and name HN   ))   ( (resid  58 and name HG1* ))     3.69  1.89  0.55
 assign ((resid  58 and name HA   ))   ( (resid  58 and name HG1* ))     3.73  1.93  0.56
 assign ((resid  58 and name HA   ))   ( (resid  59 and name HB*  ))     5.04  3.24  0.76
 assign ((resid  58 and name HB   ))   ( (resid  60 and name HG1* ))     5.81  4.01  0.87
 assign ((resid  58 and name HG2* ))   ( (resid  58 and name HG1* ))     2.82  1.02  0.42
 assign ((resid  58 and name HG2* ))   ( (resid  60 and name HG1* ))     3.16  1.36  0.47
 assign ((resid  58 and name HG1* ))   ( (resid  59 and name HN   ))     4.30  2.50  0.65
 assign ((resid  58 and name HG1* ))   ( (resid 104 and name HG2* ))     5.81  4.01  0.87
 assign ((resid  58 and name HD1* ))   ( (resid  60 and name HG1* ))     4.95  3.15  0.74
 assign ((resid  59 and name HN   ))   ( (resid  60 and name HG1* ))     4.55  2.75  0.68
 assign ((resid  59 and name HB*  ))   ( (resid  60 and name HN   ))     3.73  1.93  0.56
 assign ((resid  59 and name HB*  ))   ( (resid  60 and name HA   ))     5.81  4.01  0.87
 assign ((resid  59 and name HB*  ))   ( (resid 101 and name HG2* ))     3.64  1.84  0.55
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HG1* ))     4.01  2.21  0.60
 assign ((resid  60 and name HA   ))   ( (resid  60 and name HG1* ))     3.64  1.84  0.55
 assign ((resid  60 and name HA   ))   ( (resid  61 and name HB*  ))     4.19  2.39  0.63
 assign ((resid  60 and name HG2* ))   ( (resid  60 and name HG1* ))     2.96  1.16  0.44
 assign ((resid  60 and name HG2* ))   ( (resid  61 and name HB*  ))     4.44  2.64  0.67
 assign ((resid  60 and name HG1* ))   ( (resid  85 and name HZ   ))     4.45  2.65  0.67
 assign ((resid  60 and name HD1* ))   ( (resid  81 and name HB*  ))     5.10  3.30  0.77
 assign ((resid  61 and name HB*  ))   ( (resid  61 and name HD*  ))     3.01  1.21  0.45
 assign ((resid  61 and name HB*  ))   ( (resid  62 and name HN   ))     4.10  2.30  0.62
 assign ((resid  61 and name HB*  ))   ( (resid 101 and name HG2* ))     4.65  2.85  0.70
 assign ((resid  62 and name HB   ))   ( (resid  77 and name HB*  ))     5.16  3.36  0.77
 assign ((resid  62 and name HG1* ))   ( (resid  63 and name HB*  ))     4.34  2.54  0.65
 assign ((resid  62 and name HG1* ))   ( (resid  77 and name HB*  ))     4.82  3.02  0.72
 assign ((resid  62 and name HG2* ))   ( (resid  63 and name HB*  ))     5.81  4.01  0.87
 assign ((resid  62 and name HG2* ))   ( (resid  77 and name HB*  ))     4.21  2.41  0.63
 assign ((resid  63 and name HB*  ))   ( (resid  63 and name HE*  ))     3.48  1.68  0.52
 assign ((resid  64 and name HB*  ))   ( (resid  70 and name HG*  ))     4.06  2.26  0.61
 assign ((resid  66 and name HB*  ))   ( (resid  69 and name HN   ))     4.53  2.73  0.68
 assign ((resid  66 and name HB*  ))   ( (resid  69 and name HB*  ))     3.68  1.88  0.55
 assign ((resid  66 and name HB*  ))   ( (resid  69 and name HG*  ))     4.61  2.81  0.69
 assign ((resid  67 and name HA   ))   ( (resid  70 and name HG*  ))     3.64  1.84  0.55
 assign ((resid  67 and name HB*  ))   ( (resid  70 and name HG*  ))     3.58  1.78  0.54
 assign ((resid  68 and name HB*  ))   ( (resid  69 and name HB*  ))     4.65  2.85  0.70
 assign ((resid  69 and name HB*  ))   ( (resid  69 and name HG*  ))     2.43  0.63  0.36
 assign ((resid  69 and name HB*  ))   ( (resid  70 and name HN   ))     3.35  1.55  0.50
 assign ((resid  69 and name HB*  ))   ( (resid  72 and name HN   ))     5.81  4.01  0.87
 assign ((resid  70 and name HN   ))   ( (resid  70 and name HG*  ))     3.67  1.87  0.55
 assign ((resid  70 and name HA   ))   ( (resid  70 and name HG*  ))     3.70  1.90  0.56
 assign ((resid  70 and name HA   ))   ( (resid  73 and name HB*  ))     4.19  2.39  0.63
 assign ((resid  70 and name HA   ))   ( (resid  73 and name HG*  ))     4.25  2.45  0.64
 assign ((resid  71 and name HN   ))   ( (resid  71 and name HG*  ))     5.31  3.51  0.80
 assign ((resid  71 and name HA   ))   ( (resid  71 and name HG*  ))     3.47  1.67  0.52
 assign ((resid  71 and name HG*  ))   ( (resid  71 and name HE*  ))     3.41  1.61  0.51
 assign ((resid  71 and name HG*  ))   ( (resid  72 and name HN   ))     5.33  3.53  0.80
 assign ((resid  73 and name HN   ))   ( (resid  73 and name HB*  ))     3.56  1.76  0.53
 assign ((resid  73 and name HN   ))   ( (resid  73 and name HG*  ))     4.13  2.33  0.62
 assign ((resid  73 and name HA   ))   ( (resid  73 and name HG*  ))     3.73  1.93  0.56
 assign ((resid  73 and name HA   ))   ( (resid  76 and name HB*  ))     3.67  1.87  0.55
 assign ((resid  73 and name HA   ))   ( (resid  76 and name HG*  ))     5.81  4.01  0.87
 assign ((resid  73 and name HB*  ))   ( (resid  73 and name HG*  ))     2.34  0.54  0.35
 assign ((resid  74 and name HB*  ))   ( (resid  77 and name HB*  ))     5.29  3.49  0.79
 assign ((resid  75 and name HA   ))   ( (resid  75 and name HG*  ))     3.61  1.81  0.54
 assign ((resid  75 and name HG*  ))   ( (resid  75 and name HE*  ))     3.23  1.43  0.48
 assign ((resid  75 and name HG*  ))   ( (resid  78 and name HB*  ))     3.97  2.17  0.60
 assign ((resid  76 and name HN   ))   ( (resid  76 and name HB*  ))     3.21  1.41  0.48
 assign ((resid  76 and name HN   ))   ( (resid  76 and name HG*  ))     4.00  2.20  0.60
 assign ((resid  76 and name HA   ))   ( (resid  76 and name HG*  ))     3.39  1.59  0.51
 assign ((resid  76 and name HB*  ))   ( (resid  76 and name HD*  ))     2.86  1.06  0.43
 assign ((resid  76 and name HB*  ))   ( (resid  76 and name HE*  ))     3.91  2.11  0.59
 assign ((resid  76 and name HB*  ))   ( (resid  77 and name HN   ))     3.23  1.43  0.48
 assign ((resid  76 and name HB*  ))   ( (resid  77 and name HB*  ))     5.61  3.81  0.84
 assign ((resid  76 and name HB*  ))   ( (resid  77 and name HD*  ))     5.05  3.25  0.76
 assign ((resid  76 and name HB*  ))   ( (resid  78 and name HN   ))     5.43  3.63  0.81
 assign ((resid  76 and name HG*  ))   ( (resid  76 and name HE*  ))     3.65  1.85  0.55
 assign ((resid  76 and name HG*  ))   ( (resid  77 and name HN   ))     4.22  2.42  0.63
 assign ((resid  76 and name HG*  ))   ( (resid  77 and name HD*  ))     5.50  3.70  0.83
 assign ((resid  77 and name HA   ))   ( (resid  80 and name HG1* ))     3.85  2.05  0.58
 assign ((resid  77 and name HB*  ))   ( (resid  78 and name HN   ))     3.49  1.69  0.52
 assign ((resid  77 and name HB*  ))   ( (resid  81 and name HB*  ))     5.61  3.81  0.84
 assign ((resid  77 and name HB*  ))   ( (resid  97 and name HH2  ))     4.38  2.58  0.66
 assign ((resid  77 and name HE*  ))   ( (resid  80 and name HG1* ))     5.16  3.36  0.77
 assign ((resid  78 and name HA   ))   ( (resid  81 and name HB*  ))     3.99  2.19  0.60
 assign ((resid  78 and name HB*  ))   ( (resid  81 and name HB*  ))     4.64  2.84  0.70
 assign ((resid  79 and name HA   ))   ( (resid  82 and name HB*  ))     3.48  1.68  0.52
 assign ((resid  79 and name HB*  ))   ( (resid  82 and name HB*  ))     4.40  2.60  0.66
 assign ((resid  80 and name HN   ))   ( (resid  80 and name HG1* ))     2.99  1.19  0.45
 assign ((resid  80 and name HA   ))   ( (resid  83 and name HG*  ))     4.36  2.56  0.65
 assign ((resid  80 and name HG2* ))   ( (resid  80 and name HG1* ))     3.03  1.23  0.45
 assign ((resid  80 and name HG1* ))   ( (resid  81 and name HN   ))     4.86  3.06  0.73
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HB*  ))     3.13  1.33  0.47
 assign ((resid  81 and name HB*  ))   ( (resid  81 and name HD1* ))     3.02  1.22  0.45
 assign ((resid  81 and name HB*  ))   ( (resid  81 and name HD2* ))     3.14  1.34  0.47
 assign ((resid  81 and name HB*  ))   ( (resid  82 and name HN   ))     3.81  2.01  0.57
 assign ((resid  81 and name HB*  ))   ( (resid  85 and name HD*  ))     4.71  2.91  0.71
 assign ((resid  81 and name HB*  ))   ( (resid  85 and name HE*  ))     4.65  2.85  0.70
 assign ((resid  81 and name HB*  ))   ( (resid  85 and name HZ   ))     5.55  3.75  0.83
 assign ((resid  81 and name HB*  ))   ( (resid  97 and name HE1  ))     5.07  3.27  0.76
 assign ((resid  81 and name HB*  ))   ( (resid  97 and name HZ2  ))     3.86  2.06  0.58
 assign ((resid  82 and name HB*  ))   ( (resid  83 and name HB*  ))     4.60  2.80  0.69
 assign ((resid  82 and name HB*  ))   ( (resid  83 and name HG*  ))     4.79  2.99  0.72
 assign ((resid  82 and name HB*  ))   ( (resid  86 and name HB*  ))     5.81  4.01  0.87
 assign ((resid  83 and name HN   ))   ( (resid  83 and name HG*  ))     3.26  1.46  0.49
 assign ((resid  83 and name HA   ))   ( (resid  83 and name HG*  ))     3.12  1.32  0.47
 assign ((resid  83 and name HG*  ))   ( (resid  83 and name HE*  ))     3.04  1.24  0.46
 assign ((resid  83 and name HG*  ))   ( (resid  84 and name HN   ))     5.31  3.51  0.80
 assign ((resid  83 and name HG*  ))   ( (resid  87 and name HG*  ))     5.62  3.82  0.84
 assign ((resid  84 and name HA   ))   ( (resid  87 and name HG*  ))     4.92  3.12  0.74
 assign ((resid  85 and name HA   ))   ( (resid  88 and name HB*  ))     4.10  2.30  0.62
 assign ((resid  85 and name HA   ))   ( (resid  90 and name HB*  ))     4.69  2.89  0.70
 assign ((resid  85 and name HB*  ))   ( (resid  90 and name HB*  ))     3.68  1.88  0.55
 assign ((resid  85 and name HD*  ))   ( (resid  90 and name HB*  ))     4.31  2.51  0.65
 assign ((resid  85 and name HE*  ))   ( (resid  90 and name HB*  ))     5.81  4.01  0.87
 assign ((resid  86 and name HN   ))   ( (resid  87 and name HB*  ))     4.59  2.79  0.69
 assign ((resid  86 and name HB*  ))   ( (resid  87 and name HB*  ))     5.08  3.28  0.76
 assign ((resid  86 and name HB*  ))   ( (resid  87 and name HG*  ))     3.93  2.13  0.59
 assign ((resid  87 and name HN   ))   ( (resid  87 and name HG*  ))     3.19  1.39  0.48
 assign ((resid  87 and name HA   ))   ( (resid  87 and name HG*  ))     2.93  1.13  0.44
 assign ((resid  87 and name HB*  ))   ( (resid  87 and name HG*  ))     2.30  0.50  0.34
 assign ((resid  87 and name HB*  ))   ( (resid  88 and name HN   ))     3.52  1.72  0.53
 assign ((resid  87 and name HB*  ))   ( (resid  88 and name HD2* ))     4.21  2.41  0.63
 assign ((resid  88 and name HN   ))   ( (resid  88 and name HB*  ))     3.35  1.55  0.50
 assign ((resid  88 and name HB*  ))   ( (resid  88 and name HD2* ))     3.18  1.38  0.48
 assign ((resid  88 and name HB*  ))   ( (resid  89 and name HN   ))     3.96  2.16  0.59
 assign ((resid  88 and name HB*  ))   ( (resid  90 and name HN   ))     4.48  2.68  0.67
 assign ((resid  88 and name HB*  ))   ( (resid  90 and name HD*  ))     3.74  1.94  0.56
 assign ((resid  88 and name HD1* ))   ( (resid  89 and name HA*  ))     5.81  4.01  0.87
 assign ((resid  90 and name HN   ))   ( (resid  90 and name HB*  ))     3.21  1.41  0.48
 assign ((resid  90 and name HB*  ))   ( (resid  91 and name HN   ))     3.97  2.17  0.60
 assign ((resid  90 and name HB*  ))   ( (resid  95 and name HG2* ))     3.99  2.19  0.60
 assign ((resid  90 and name HB*  ))   ( (resid 104 and name HG1* ))     4.41  2.61  0.66
 assign ((resid  90 and name HD*  ))   ( (resid 106 and name HA*  ))     4.68  2.88  0.70
 assign ((resid  90 and name HE*  ))   ( (resid 106 and name HA*  ))     5.03  3.23  0.75
 assign ((resid  93 and name HB*  ))   ( (resid  94 and name HB*  ))     5.81  4.01  0.87
 assign ((resid  94 and name HN   ))   ( (resid  94 and name HB*  ))     3.61  1.81  0.54
 assign ((resid  94 and name HB*  ))   ( (resid  95 and name HG1* ))     5.67  3.87  0.85
 assign ((resid  94 and name HB*  ))   ( (resid  95 and name HG2* ))     4.19  2.39  0.63
 assign ((resid  94 and name HB*  ))   ( (resid 104 and name HG1* ))     5.35  3.55  0.80
 assign ((resid  94 and name HB*  ))   ( (resid 104 and name HG2* ))     4.91  3.11  0.74
 assign ((resid  94 and name HB*  ))   ( (resid 105 and name HN   ))     4.27  2.47  0.64
 assign ((resid  96 and name HA   ))   ( (resid  97 and name HB*  ))     4.48  2.68  0.67
 assign ((resid  97 and name HN   ))   ( (resid  97 and name HB*  ))     3.61  1.81  0.54
 assign ((resid  97 and name HB*  ))   ( (resid 102 and name HA   ))     5.60  3.80  0.84
 assign ((resid  98 and name HB*  ))   ( (resid 101 and name HN   ))     5.09  3.29  0.76
 assign ((resid  98 and name HB*  ))   ( (resid 101 and name HB   ))     4.83  3.03  0.72
 assign ((resid  98 and name HB*  ))   ( (resid 101 and name HG2* ))     5.39  3.59  0.81
 assign ((resid 100 and name HB*  ))   ( (resid 101 and name HN   ))     4.06  2.26  0.61
 assign ((resid 103 and name HG2* ))   ( (resid 105 and name HB*  ))     5.32  3.52  0.80
 assign ((resid 105 and name HN   ))   ( (resid 105 and name HB*  ))     3.64  1.84  0.55
 assign ((resid 105 and name HN   ))   ( (resid 105 and name HG*  ))     4.69  2.89  0.70
 assign ((resid 105 and name HA   ))   ( (resid 105 and name HG*  ))     3.70  1.90  0.56
 assign ((resid 105 and name HB*  ))   ( (resid 105 and name HG*  ))     2.33  0.53  0.35
 assign ((resid 105 and name HB*  ))   ( (resid 106 and name HN   ))     3.63  1.83  0.54
 assign ((resid 105 and name HB*  ))   ( (resid 106 and name HA*  ))     5.39  3.59  0.81
 assign ((resid 105 and name HG*  ))   ( (resid 106 and name HN   ))     4.17  2.37  0.63
 assign ((resid 106 and name HA*  ))   ( (resid 107 and name HB*  ))     5.18  3.38  0.78
 assign ((resid 106 and name HA*  ))   ( (resid 107 and name HG*  ))     5.69  3.89  0.85
 assign ((resid 107 and name HB*  ))   ( (resid 107 and name HE*  ))     4.13  2.33  0.62
 assign ((resid 107 and name HB*  ))   ( (resid 108 and name HN   ))     3.87  2.07  0.58
 assign ((resid 107 and name HB*  ))   ( (resid 108 and name HA   ))     4.87  3.07  0.73
 assign ((resid 108 and name HB*  ))   ( (resid 109 and name HB*  ))     4.76  2.96  0.71
 assign ((resid 108 and name HD2* ))   ( (resid 109 and name HB*  ))     4.50  2.70  0.68
 assign ((resid 109 and name HN   ))   ( (resid 109 and name HB*  ))     3.61  1.81  0.54
 assign ((resid 109 and name HB*  ))   ( (resid 110 and name HN   ))     4.44  2.64  0.67
 assign ((resid 109 and name HB*  ))   ( (resid 110 and name HA*  ))     5.69  3.89  0.85
 assign ((resid 110 and name HA*  ))   ( (resid 111 and name HG*  ))     3.84  2.04  0.58
 assign ((resid 111 and name HN   ))   ( (resid 111 and name HG*  ))     3.03  1.23  0.45
 assign ((resid 111 and name HA   ))   ( (resid 111 and name HG*  ))     2.99  1.19  0.45
 assign ((resid 111 and name HG*  ))   ( (resid 112 and name HN   ))     4.02  2.22  0.60
 assign ((resid 112 and name HA   ))   ( (resid 113 and name HB*  ))     5.81  4.01  0.87
 assign ((resid 112 and name HB*  ))   ( (resid 113 and name HN   ))     3.90  2.10  0.59
 assign ((resid 113 and name HN   ))   ( (resid 113 and name HB*  ))     2.94  1.14  0.44
 assign ((resid 113 and name HB*  ))   ( (resid 113 and name HG   ))     2.52  0.72  0.38
 assign ((resid 113 and name HB*  ))   ( (resid 113 and name HD1* ))     2.72  0.92  0.41
 assign ((resid 113 and name HB*  ))   ( (resid 113 and name HD2* ))     2.84  1.04  0.43
 assign ((resid 113 and name HB*  ))   ( (resid 114 and name HG*  ))     5.12  3.32  0.77
 assign ((resid 113 and name HD1* ))   ( (resid 114 and name HG*  ))     6.00  4.20  0.90
 assign ((resid 114 and name HN   ))   ( (resid 114 and name HG*  ))     3.60  1.80  0.54
 assign ((resid 114 and name HA   ))   ( (resid 114 and name HG*  ))     3.48  1.68  0.52
 assign ((resid 114 and name HB*  ))   ( (resid 114 and name HG*  ))     2.41  0.61  0.36
 assign ((resid  14 and name SG   ))   ( (resid  53 and name SG   ))     2.05  0.05  0.31
 assign ((resid  14 and name SG   ))   ( (resid  53 and name CB   ))     3.05  0.05  0.46
 assign ((resid  14 and name CB   ))   ( (resid  53 and name SG   ))     3.05  0.05  0.46
 assign ((resid   8 and name HN   ))   ( (resid  23 and name O    ))     1.90  0.10  0.28
 assign ((resid   8 and name N    ))   ( (resid  23 and name O    ))     2.85  0.15  0.43
 assign ((resid   9 and name HN   ))   ( (resid  61 and name O    ))     1.90  0.10  0.28
 assign ((resid   9 and name N    ))   ( (resid  61 and name O    ))     2.85  0.15  0.43
 assign ((resid  11 and name HN   ))   ( (resid  59 and name O    ))     1.90  0.10  0.28
 assign ((resid  11 and name N    ))   ( (resid  59 and name O    ))     2.85  0.15  0.43
 assign ((resid  12 and name O    ))   ( (resid  19 and name HN   ))     1.90  0.10  0.28
 assign ((resid  12 and name O    ))   ( (resid  19 and name N    ))     2.85  0.15  0.43
 assign ((resid   8 and name O    ))   ( (resid  23 and name HN   ))     1.90  0.10  0.28
 assign ((resid   8 and name O    ))   ( (resid  23 and name N    ))     2.85  0.15  0.43
 assign ((resid   6 and name O    ))   ( (resid  25 and name HN   ))     1.90  0.10  0.28
 assign ((resid   6 and name O    ))   ( (resid  25 and name N    ))     2.85  0.15  0.43
 assign ((resid  33 and name O    ))   ( (resid  37 and name HN   ))     1.90  0.10  0.28
 assign ((resid  33 and name O    ))   ( (resid  37 and name N    ))     2.85  0.15  0.43
 assign ((resid  34 and name O    ))   ( (resid  38 and name HN   ))     1.90  0.10  0.28
 assign ((resid  34 and name O    ))   ( (resid  38 and name N    ))     2.85  0.15  0.43
 assign ((resid  35 and name O    ))   ( (resid  39 and name HN   ))     1.90  0.10  0.28
 assign ((resid  35 and name O    ))   ( (resid  39 and name N    ))     2.85  0.15  0.43
 assign ((resid  36 and name O    ))   ( (resid  40 and name HN   ))     1.90  0.10  0.28
 assign ((resid  36 and name O    ))   ( (resid  40 and name N    ))     2.85  0.15  0.43
 assign ((resid  37 and name O    ))   ( (resid  41 and name HN   ))     1.90  0.10  0.28
 assign ((resid  37 and name O    ))   ( (resid  41 and name N    ))     2.85  0.15  0.43
 assign ((resid  38 and name O    ))   ( (resid  42 and name HN   ))     1.90  0.10  0.28
 assign ((resid  38 and name O    ))   ( (resid  42 and name N    ))     2.85  0.15  0.43
 assign ((resid  48 and name O    ))   ( (resid  52 and name HN   ))     1.90  0.10  0.28
 assign ((resid  48 and name O    ))   ( (resid  52 and name N    ))     2.85  0.15  0.43
 assign ((resid  58 and name HN   ))   ( (resid 104 and name O    ))     1.90  0.10  0.28
 assign ((resid  58 and name N    ))   ( (resid 104 and name O    ))     2.85  0.15  0.43
 assign ((resid  11 and name O    ))   ( (resid  59 and name HN   ))     1.90  0.10  0.28
 assign ((resid  11 and name O    ))   ( (resid  59 and name N    ))     2.85  0.15  0.43
 assign ((resid  69 and name O    ))   ( (resid  73 and name HN   ))     1.90  0.10  0.28
 assign ((resid  69 and name O    ))   ( (resid  73 and name N    ))     2.85  0.15  0.43
 assign ((resid  70 and name O    ))   ( (resid  74 and name HN   ))     1.90  0.10  0.28
 assign ((resid  70 and name O    ))   ( (resid  74 and name N    ))     2.85  0.15  0.43
 assign ((resid  72 and name O    ))   ( (resid  76 and name HN   ))     1.90  0.10  0.28
 assign ((resid  72 and name O    ))   ( (resid  76 and name N    ))     2.85  0.15  0.43
 assign ((resid  73 and name O    ))   ( (resid  77 and name HN   ))     1.90  0.10  0.28
 assign ((resid  73 and name O    ))   ( (resid  77 and name N    ))     2.85  0.15  0.43
 assign ((resid  74 and name O    ))   ( (resid  78 and name HN   ))     1.90  0.10  0.28
 assign ((resid  74 and name O    ))   ( (resid  78 and name N    ))     2.85  0.15  0.43
 assign ((resid  77 and name O    ))   ( (resid  81 and name HN   ))     1.90  0.10  0.28
 assign ((resid  77 and name O    ))   ( (resid  81 and name N    ))     2.85  0.15  0.43
 assign ((resid  78 and name O    ))   ( (resid  82 and name HN   ))     1.90  0.10  0.28
 assign ((resid  78 and name O    ))   ( (resid  82 and name N    ))     2.85  0.15  0.43
 assign ((resid  81 and name O    ))   ( (resid  85 and name HN   ))     1.90  0.10  0.28
 assign ((resid  81 and name O    ))   ( (resid  85 and name N    ))     2.85  0.15  0.43
 assign ((resid  58 and name O    ))   ( (resid 104 and name HN   ))     1.90  0.10  0.28
 assign ((resid  58 and name O    ))   ( (resid 104 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   3 and name C   )   (resid   4 and name N   )
          (resid   4 and name CA  )   (resid   4 and name C   )   1.0    -95.20    70.00   2 
   assign (resid   4 and name N   )   (resid   4 and name CA  )
          (resid   4 and name C   )   (resid   5 and name N   )   1.0    135.80    51.80   2 
   assign (resid   4 and name C   )   (resid   5 and name N   )
          (resid   5 and name CA  )   (resid   5 and name C   )   1.0   -102.45    35.45   2 
   assign (resid   5 and name N   )   (resid   5 and name CA  )
          (resid   5 and name C   )   (resid   6 and name N   )   1.0    133.55    39.65   2 
   assign (resid   5 and name C   )   (resid   6 and name N   )
          (resid   6 and name CA  )   (resid   6 and name C   )   1.0   -121.15    20.45   2 
   assign (resid   6 and name N   )   (resid   6 and name CA  )
          (resid   6 and name C   )   (resid   7 and name N   )   1.0    131.70    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   -114.25    26.45   2 
   assign (resid   7 and name N   )   (resid   7 and name CA  )
          (resid   7 and name C   )   (resid   8 and name N   )   1.0    139.35    22.85   2 
   assign (resid   7 and name C   )   (resid   8 and name N   )
          (resid   8 and name CA  )   (resid   8 and name C   )   1.0   -117.20    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    129.55    21.25   2 
   assign (resid   8 and name C   )   (resid   9 and name N   )
          (resid   9 and name CA  )   (resid   9 and name C   )   1.0    -93.75    32.65   2 
   assign (resid   9 and name N   )   (resid   9 and name CA  )
          (resid   9 and name C   )   (resid  10 and name N   )   1.0    123.70    20.00   2 
   assign (resid   9 and name C   )   (resid  10 and name N   )
          (resid  10 and name CA  )   (resid  10 and name C   )   1.0   -114.50    20.40   2 
   assign (resid  10 and name N   )   (resid  10 and name CA  )
          (resid  10 and name C   )   (resid  11 and name N   )   1.0    119.60    20.00   2 
   assign (resid  10 and name C   )   (resid  11 and name N   )
          (resid  11 and name CA  )   (resid  11 and name C   )   1.0   -107.95    25.85   2 
   assign (resid  11 and name N   )   (resid  11 and name CA  )
          (resid  11 and name C   )   (resid  12 and name N   )   1.0    127.40    20.60   2 
   assign (resid  11 and name C   )   (resid  12 and name N   )
          (resid  12 and name CA  )   (resid  12 and name C   )   1.0   -118.00    23.60   2 
   assign (resid  12 and name N   )   (resid  12 and name CA  )
          (resid  12 and name C   )   (resid  13 and name N   )   1.0    126.80    20.00   2 
   assign (resid  12 and name C   )   (resid  13 and name N   )
          (resid  13 and name CA  )   (resid  13 and name C   )   1.0   -107.25    23.35   2 
   assign (resid  13 and name N   )   (resid  13 and name CA  )
          (resid  13 and name C   )   (resid  14 and name N   )   1.0    129.60    24.90   2 
   assign (resid  13 and name C   )   (resid  14 and name N   )
          (resid  14 and name CA  )   (resid  14 and name C   )   1.0   -140.85    26.15   2 
   assign (resid  14 and name N   )   (resid  14 and name CA  )
          (resid  14 and name C   )   (resid  15 and name N   )   1.0    152.30    45.50   2 
   assign (resid  16 and name C   )   (resid  17 and name N   )
          (resid  17 and name CA  )   (resid  17 and name C   )   1.0   -115.80    24.60   2 
   assign (resid  17 and name N   )   (resid  17 and name CA  )
          (resid  17 and name C   )   (resid  18 and name N   )   1.0    149.90    38.00   2 
   assign (resid  17 and name C   )   (resid  18 and name N   )
          (resid  18 and name CA  )   (resid  18 and name C   )   1.0    -96.30    24.10   2 
   assign (resid  18 and name N   )   (resid  18 and name CA  )
          (resid  18 and name C   )   (resid  19 and name N   )   1.0    120.80    20.00   2 
   assign (resid  18 and name C   )   (resid  19 and name N   )
          (resid  19 and name CA  )   (resid  19 and name C   )   1.0   -111.95    30.55   2 
   assign (resid  19 and name N   )   (resid  19 and name CA  )
          (resid  19 and name C   )   (resid  20 and name N   )   1.0    127.75    24.45   2 
   assign (resid  19 and name C   )   (resid  20 and name N   )
          (resid  20 and name CA  )   (resid  20 and name C   )   1.0   -126.85    23.25   2 
   assign (resid  20 and name N   )   (resid  20 and name CA  )
          (resid  20 and name C   )   (resid  21 and name N   )   1.0    144.75    20.65   2 
   assign (resid  20 and name C   )   (resid  21 and name N   )
          (resid  21 and name CA  )   (resid  21 and name C   )   1.0   -143.10    27.20   2 
   assign (resid  21 and name N   )   (resid  21 and name CA  )
          (resid  21 and name C   )   (resid  22 and name N   )   1.0    129.70    20.00   2 
   assign (resid  21 and name C   )   (resid  22 and name N   )
          (resid  22 and name CA  )   (resid  22 and name C   )   1.0   -105.10    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    126.70    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   -123.65    24.15   2 
   assign (resid  23 and name N   )   (resid  23 and name CA  )
          (resid  23 and name C   )   (resid  24 and name N   )   1.0    146.00    24.60   2 
   assign (resid  23 and name C   )   (resid  24 and name N   )
          (resid  24 and name CA  )   (resid  24 and name C   )   1.0    -93.30    23.80   2 
   assign (resid  24 and name N   )   (resid  24 and name CA  )
          (resid  24 and name C   )   (resid  25 and name N   )   1.0    131.70    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   -111.15    28.25   2 
   assign (resid  25 and name N   )   (resid  25 and name CA  )
          (resid  25 and name C   )   (resid  26 and name N   )   1.0    135.55    35.85   2 
   assign (resid  25 and name C   )   (resid  26 and name N   )
          (resid  26 and name CA  )   (resid  26 and name C   )   1.0   -109.15    43.05   2 
   assign (resid  26 and name N   )   (resid  26 and name CA  )
          (resid  26 and name C   )   (resid  27 and name N   )   1.0    139.05    24.05   2 
   assign (resid  26 and name C   )   (resid  27 and name N   )
          (resid  27 and name CA  )   (resid  27 and name C   )   1.0   -125.95    60.25   2 
   assign (resid  27 and name N   )   (resid  27 and name CA  )
          (resid  27 and name C   )   (resid  28 and name N   )   1.0    145.40    27.70   2 
   assign (resid  29 and name C   )   (resid  30 and name N   )
          (resid  30 and name CA  )   (resid  30 and name C   )   1.0    -57.90    20.00   2 
   assign (resid  30 and name N   )   (resid  30 and name CA  )
          (resid  30 and name C   )   (resid  31 and name N   )   1.0    -37.70    20.00   2 
   assign (resid  30 and name C   )   (resid  31 and name N   )
          (resid  31 and name CA  )   (resid  31 and name C   )   1.0    -64.50    20.00   2 
   assign (resid  31 and name N   )   (resid  31 and name CA  )
          (resid  31 and name C   )   (resid  32 and name N   )   1.0    -41.60    20.00   2 
   assign (resid  31 and name C   )   (resid  32 and name N   )
          (resid  32 and name CA  )   (resid  32 and name C   )   1.0    -67.10    20.00   2 
   assign (resid  32 and name N   )   (resid  32 and name CA  )
          (resid  32 and name C   )   (resid  33 and name N   )   1.0    -42.10    20.00   2 
   assign (resid  32 and name C   )   (resid  33 and name N   )
          (resid  33 and name CA  )   (resid  33 and name C   )   1.0    -63.70    20.00   2 
   assign (resid  33 and name N   )   (resid  33 and name CA  )
          (resid  33 and name C   )   (resid  34 and name N   )   1.0    -37.60    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    -60.10    20.00   2 
   assign (resid  34 and name N   )   (resid  34 and name CA  )
          (resid  34 and name C   )   (resid  35 and name N   )   1.0    -44.30    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    -63.10    20.00   2 
   assign (resid  35 and name N   )   (resid  35 and name CA  )
          (resid  35 and name C   )   (resid  36 and name N   )   1.0    -40.40    20.00   2 
   assign (resid  35 and name C   )   (resid  36 and name N   )
          (resid  36 and name CA  )   (resid  36 and name C   )   1.0    -64.60    20.00   2 
   assign (resid  36 and name N   )   (resid  36 and name CA  )
          (resid  36 and name C   )   (resid  37 and name N   )   1.0    -41.50    20.00   2 
   assign (resid  36 and name C   )   (resid  37 and name N   )
          (resid  37 and name CA  )   (resid  37 and name C   )   1.0    -62.50    20.00   2 
   assign (resid  37 and name N   )   (resid  37 and name CA  )
          (resid  37 and name C   )   (resid  38 and name N   )   1.0    -39.70    20.00   2 
   assign (resid  37 and name C   )   (resid  38 and name N   )
          (resid  38 and name CA  )   (resid  38 and name C   )   1.0    -57.70    20.00   2 
   assign (resid  38 and name N   )   (resid  38 and name CA  )
          (resid  38 and name C   )   (resid  39 and name N   )   1.0    -45.80    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    -62.20    20.00   2 
   assign (resid  39 and name N   )   (resid  39 and name CA  )
          (resid  39 and name C   )   (resid  40 and name N   )   1.0    -44.20    20.00   2 
   assign (resid  39 and name C   )   (resid  40 and name N   )
          (resid  40 and name CA  )   (resid  40 and name C   )   1.0    -65.00    20.00   2 
   assign (resid  40 and name N   )   (resid  40 and name CA  )
          (resid  40 and name C   )   (resid  41 and name N   )   1.0    -40.60    20.00   2 
   assign (resid  40 and name C   )   (resid  41 and name N   )
          (resid  41 and name CA  )   (resid  41 and name C   )   1.0    -60.50    20.00   2 
   assign (resid  41 and name N   )   (resid  41 and name CA  )
          (resid  41 and name C   )   (resid  42 and name N   )   1.0    -40.30    20.00   2 
   assign (resid  41 and name C   )   (resid  42 and name N   )
          (resid  42 and name CA  )   (resid  42 and name C   )   1.0    -65.10    20.00   2 
   assign (resid  42 and name N   )   (resid  42 and name CA  )
          (resid  42 and name C   )   (resid  43 and name N   )   1.0    -41.70    20.00   2 
   assign (resid  42 and name C   )   (resid  43 and name N   )
          (resid  43 and name CA  )   (resid  43 and name C   )   1.0    -65.60    20.00   2 
   assign (resid  43 and name N   )   (resid  43 and name CA  )
          (resid  43 and name C   )   (resid  44 and name N   )   1.0    -38.20    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    -73.30    23.60   2 
   assign (resid  44 and name N   )   (resid  44 and name CA  )
          (resid  44 and name C   )   (resid  45 and name N   )   1.0    -23.30    55.00   2 
   assign (resid  44 and name C   )   (resid  45 and name N   )
          (resid  45 and name CA  )   (resid  45 and name C   )   1.0    -88.75    21.35   2 
   assign (resid  45 and name N   )   (resid  45 and name CA  )
          (resid  45 and name C   )   (resid  46 and name N   )   1.0    -12.25    22.45   2 
   assign (resid  47 and name C   )   (resid  48 and name N   )
          (resid  48 and name CA  )   (resid  48 and name C   )   1.0    -71.10    30.00   2 
   assign (resid  48 and name N   )   (resid  48 and name CA  )
          (resid  48 and name C   )   (resid  49 and name N   )   1.0    -32.95    32.85   2 
   assign (resid  48 and name C   )   (resid  49 and name N   )
          (resid  49 and name CA  )   (resid  49 and name C   )   1.0    -66.50    20.00   2 
   assign (resid  49 and name N   )   (resid  49 and name CA  )
          (resid  49 and name C   )   (resid  50 and name N   )   1.0    -34.10    20.00   2 
   assign (resid  49 and name C   )   (resid  50 and name N   )
          (resid  50 and name CA  )   (resid  50 and name C   )   1.0    -67.80    20.00   2 
   assign (resid  50 and name N   )   (resid  50 and name CA  )
          (resid  50 and name C   )   (resid  51 and name N   )   1.0    -28.20    30.40   2 
   assign (resid  50 and name C   )   (resid  51 and name N   )
          (resid  51 and name CA  )   (resid  51 and name C   )   1.0    -94.10    22.10   2 
   assign (resid  51 and name N   )   (resid  51 and name CA  )
          (resid  51 and name C   )   (resid  52 and name N   )   1.0    -14.30    37.80   2 
   assign (resid  54 and name C   )   (resid  55 and name N   )
          (resid  55 and name CA  )   (resid  55 and name C   )   1.0   -112.20    70.00   2 
   assign (resid  55 and name N   )   (resid  55 and name CA  )
          (resid  55 and name C   )   (resid  56 and name N   )   1.0    151.55    26.75   2 
   assign (resid  55 and name C   )   (resid  56 and name N   )
          (resid  56 and name CA  )   (resid  56 and name C   )   1.0   -136.60    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    153.20    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   -126.40    25.40   2 
   assign (resid  57 and name N   )   (resid  57 and name CA  )
          (resid  57 and name C   )   (resid  58 and name N   )   1.0    127.50    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   -119.55    23.75   2 
   assign (resid  58 and name N   )   (resid  58 and name CA  )
          (resid  58 and name C   )   (resid  59 and name N   )   1.0    127.00    20.00   2 
   assign (resid  58 and name C   )   (resid  59 and name N   )
          (resid  59 and name CA  )   (resid  59 and name C   )   1.0   -120.70    25.20   2 
   assign (resid  59 and name N   )   (resid  59 and name CA  )
          (resid  59 and name C   )   (resid  60 and name N   )   1.0    131.00    24.70   2 
   assign (resid  59 and name C   )   (resid  60 and name N   )
          (resid  60 and name CA  )   (resid  60 and name C   )   1.0   -117.60    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    134.45    29.45   2 
   assign (resid  60 and name C   )   (resid  61 and name N   )
          (resid  61 and name CA  )   (resid  61 and name C   )   1.0   -107.45    39.75   2 
   assign (resid  61 and name N   )   (resid  61 and name CA  )
          (resid  61 and name C   )   (resid  62 and name N   )   1.0    125.60    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   -116.70    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    129.40    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   -102.80    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    124.05    22.75   2 
   assign (resid  63 and name C   )   (resid  64 and name N   )
          (resid  64 and name CA  )   (resid  64 and name C   )   1.0   -101.20    41.50   2 
   assign (resid  64 and name N   )   (resid  64 and name CA  )
          (resid  64 and name C   )   (resid  65 and name N   )   1.0    130.25    23.45   2 
   assign (resid  67 and name C   )   (resid  68 and name N   )
          (resid  68 and name CA  )   (resid  68 and name C   )   1.0    -64.95    20.55   2 
   assign (resid  68 and name N   )   (resid  68 and name CA  )
          (resid  68 and name C   )   (resid  69 and name N   )   1.0    -34.70    47.20   2 
   assign (resid  68 and name C   )   (resid  69 and name N   )
          (resid  69 and name CA  )   (resid  69 and name C   )   1.0    -63.70    20.00   2 
   assign (resid  69 and name N   )   (resid  69 and name CA  )
          (resid  69 and name C   )   (resid  70 and name N   )   1.0    -42.10    23.90   2 
   assign (resid  69 and name C   )   (resid  70 and name N   )
          (resid  70 and name CA  )   (resid  70 and name C   )   1.0    -60.70    20.00   2 
   assign (resid  70 and name N   )   (resid  70 and name CA  )
          (resid  70 and name C   )   (resid  71 and name N   )   1.0    -38.70    27.10   2 
   assign (resid  70 and name C   )   (resid  71 and name N   )
          (resid  71 and name CA  )   (resid  71 and name C   )   1.0    -62.40    20.00   2 
   assign (resid  71 and name N   )   (resid  71 and name CA  )
          (resid  71 and name C   )   (resid  72 and name N   )   1.0    -43.60    20.00   2 
   assign (resid  71 and name C   )   (resid  72 and name N   )
          (resid  72 and name CA  )   (resid  72 and name C   )   1.0    -62.80    20.00   2 
   assign (resid  72 and name N   )   (resid  72 and name CA  )
          (resid  72 and name C   )   (resid  73 and name N   )   1.0    -39.30    20.00   2 
   assign (resid  72 and name C   )   (resid  73 and name N   )
          (resid  73 and name CA  )   (resid  73 and name C   )   1.0    -67.20    20.00   2 
   assign (resid  73 and name N   )   (resid  73 and name CA  )
          (resid  73 and name C   )   (resid  74 and name N   )   1.0    -37.55    29.15   2 
   assign (resid  73 and name C   )   (resid  74 and name N   )
          (resid  74 and name CA  )   (resid  74 and name C   )   1.0    -61.30    20.00   2 
   assign (resid  74 and name N   )   (resid  74 and name CA  )
          (resid  74 and name C   )   (resid  75 and name N   )   1.0    -37.40    23.90   2 
   assign (resid  74 and name C   )   (resid  75 and name N   )
          (resid  75 and name CA  )   (resid  75 and name C   )   1.0    -62.10    20.00   2 
   assign (resid  75 and name N   )   (resid  75 and name CA  )
          (resid  75 and name C   )   (resid  76 and name N   )   1.0    -41.90    20.00   2 
   assign (resid  75 and name C   )   (resid  76 and name N   )
          (resid  76 and name CA  )   (resid  76 and name C   )   1.0    -62.50    20.00   2 
   assign (resid  76 and name N   )   (resid  76 and name CA  )
          (resid  76 and name C   )   (resid  77 and name N   )   1.0    -41.20    20.00   2 
   assign (resid  76 and name C   )   (resid  77 and name N   )
          (resid  77 and name CA  )   (resid  77 and name C   )   1.0    -66.10    20.00   2 
   assign (resid  77 and name N   )   (resid  77 and name CA  )
          (resid  77 and name C   )   (resid  78 and name N   )   1.0    -43.10    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    -61.35    19.95   2 
   assign (resid  78 and name N   )   (resid  78 and name CA  )
          (resid  78 and name C   )   (resid  79 and name N   )   1.0    -41.10    20.00   2 
   assign (resid  78 and name C   )   (resid  79 and name N   )
          (resid  79 and name CA  )   (resid  79 and name C   )   1.0    -63.30    20.00   2 
   assign (resid  79 and name N   )   (resid  79 and name CA  )
          (resid  79 and name C   )   (resid  80 and name N   )   1.0    -38.90    20.00   2 
   assign (resid  79 and name C   )   (resid  80 and name N   )
          (resid  80 and name CA  )   (resid  80 and name C   )   1.0    -65.90    20.00   2 
   assign (resid  80 and name N   )   (resid  80 and name CA  )
          (resid  80 and name C   )   (resid  81 and name N   )   1.0    -44.10    20.00   2 
   assign (resid  80 and name C   )   (resid  81 and name N   )
          (resid  81 and name CA  )   (resid  81 and name C   )   1.0    -63.60    20.00   2 
   assign (resid  81 and name N   )   (resid  81 and name CA  )
          (resid  81 and name C   )   (resid  82 and name N   )   1.0    -41.00    20.00   2 
   assign (resid  81 and name C   )   (resid  82 and name N   )
          (resid  82 and name CA  )   (resid  82 and name C   )   1.0    -63.60    20.00   2 
   assign (resid  82 and name N   )   (resid  82 and name CA  )
          (resid  82 and name C   )   (resid  83 and name N   )   1.0    -40.70    20.00   2 
   assign (resid  82 and name C   )   (resid  83 and name N   )
          (resid  83 and name CA  )   (resid  83 and name C   )   1.0    -67.90    20.00   2 
   assign (resid  83 and name N   )   (resid  83 and name CA  )
          (resid  83 and name C   )   (resid  84 and name N   )   1.0    -39.90    20.00   2 
   assign (resid  83 and name C   )   (resid  84 and name N   )
          (resid  84 and name CA  )   (resid  84 and name C   )   1.0    -62.70    20.00   2 
   assign (resid  84 and name N   )   (resid  84 and name CA  )
          (resid  84 and name C   )   (resid  85 and name N   )   1.0    -43.00    20.00   2 
   assign (resid  84 and name C   )   (resid  85 and name N   )
          (resid  85 and name CA  )   (resid  85 and name C   )   1.0    -62.60    20.00   2 
   assign (resid  85 and name N   )   (resid  85 and name CA  )
          (resid  85 and name C   )   (resid  86 and name N   )   1.0    -38.20    20.00   2 
   assign (resid  85 and name C   )   (resid  86 and name N   )
          (resid  86 and name CA  )   (resid  86 and name C   )   1.0    -69.40    20.00   2 
   assign (resid  86 and name N   )   (resid  86 and name CA  )
          (resid  86 and name C   )   (resid  87 and name N   )   1.0    -33.90    26.40   2 
   assign (resid  86 and name C   )   (resid  87 and name N   )
          (resid  87 and name CA  )   (resid  87 and name C   )   1.0    -64.60    20.00   2 
   assign (resid  87 and name N   )   (resid  87 and name CA  )
          (resid  87 and name C   )   (resid  88 and name N   )   1.0    -26.45    25.55   2 
   assign (resid  87 and name C   )   (resid  88 and name N   )
          (resid  88 and name CA  )   (resid  88 and name C   )   1.0    -85.20    20.40   2 
   assign (resid  88 and name N   )   (resid  88 and name CA  )
          (resid  88 and name C   )   (resid  89 and name N   )   1.0     -2.90    25.70   2 
   assign (resid  94 and name C   )   (resid  95 and name N   )
          (resid  95 and name CA  )   (resid  95 and name C   )   1.0    -97.05    48.95   2 
   assign (resid  95 and name N   )   (resid  95 and name CA  )
          (resid  95 and name C   )   (resid  96 and name N   )   1.0    131.60    29.00   2 
   assign (resid  95 and name C   )   (resid  96 and name N   )
          (resid  96 and name CA  )   (resid  96 and name C   )   1.0   -110.90    33.90   2 
   assign (resid  96 and name N   )   (resid  96 and name CA  )
          (resid  96 and name C   )   (resid  97 and name N   )   1.0    133.25    38.25   2 
   assign (resid  96 and name C   )   (resid  97 and name N   )
          (resid  97 and name CA  )   (resid  97 and name C   )   1.0   -101.60    35.10   2 
   assign (resid  97 and name N   )   (resid  97 and name CA  )
          (resid  97 and name C   )   (resid  98 and name N   )   1.0    130.30    20.00   2 
   assign (resid  97 and name C   )   (resid  98 and name N   )
          (resid  98 and name CA  )   (resid  98 and name C   )   1.0   -117.65    62.45   2 
   assign (resid  98 and name N   )   (resid  98 and name CA  )
          (resid  98 and name C   )   (resid  99 and name N   )   1.0    123.25    48.65   2 
   assign (resid 100 and name C   )   (resid 101 and name N   )
          (resid 101 and name CA  )   (resid 101 and name C   )   1.0   -121.80    21.50   2 
   assign (resid 101 and name N   )   (resid 101 and name CA  )
          (resid 101 and name C   )   (resid 102 and name N   )   1.0    129.20    20.00   2 
   assign (resid 101 and name C   )   (resid 102 and name N   )
          (resid 102 and name CA  )   (resid 102 and name C   )   1.0   -112.10    20.00   2 
   assign (resid 102 and name N   )   (resid 102 and name CA  )
          (resid 102 and name C   )   (resid 103 and name N   )   1.0    123.60    25.60   2 
   assign (resid 102 and name C   )   (resid 103 and name N   )
          (resid 103 and name CA  )   (resid 103 and name C   )   1.0   -113.10    20.00   2 
   assign (resid 103 and name N   )   (resid 103 and name CA  )
          (resid 103 and name C   )   (resid 104 and name N   )   1.0    120.80    20.00   2 
   assign (resid 103 and name C   )   (resid 104 and name N   )
          (resid 104 and name CA  )   (resid 104 and name C   )   1.0   -120.35    24.55   2 
   assign (resid 104 and name N   )   (resid 104 and name CA  )
          (resid 104 and name C   )   (resid 105 and name N   )   1.0    135.75    22.15   2 
   assign (resid 104 and name C   )   (resid 105 and name N   )
          (resid 105 and name CA  )   (resid 105 and name C   )   1.0   -120.35    33.05   2 
   assign (resid 105 and name N   )   (resid 105 and name CA  )
          (resid 105 and name C   )   (resid 106 and name N   )   1.0    143.70    29.80   2 
   assign (resid 105 and name C   )   (resid 106 and name N   )
          (resid 106 and name CA  )   (resid 106 and name C   )   1.0   -176.70    70.00   2 
   assign (resid 106 and name N   )   (resid 106 and name CA  )
          (resid 106 and name C   )   (resid 107 and name N   )   1.0    173.65    34.55   2 
   assign (resid 106 and name C   )   (resid 107 and name N   )
          (resid 107 and name CA  )   (resid 107 and name C   )   1.0    -95.10    60.90   2 
   assign (resid 107 and name N   )   (resid 107 and name CA  )
          (resid 107 and name C   )   (resid 108 and name N   )   1.0    133.75    28.95   2 
   assign (resid 107 and name C   )   (resid 108 and name N   )
          (resid 108 and name CA  )   (resid 108 and name C   )   1.0   -123.90    70.00   2 
   assign (resid 108 and name N   )   (resid 108 and name CA  )
          (resid 108 and name C   )   (resid 109 and name N   )   1.0    138.00    37.10   2 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1  20.086  -0.668  -5.151
    2    H2   MET   1           2H       MET   1  20.060  -2.317  -5.516
    3    H3   MET   1           3H       MET   1  21.202  -1.710  -4.430
    4    HA   MET   1           HA       MET   1  19.498  -1.113  -2.878
    5    HB2  MET   1           2HB      MET   1  17.621  -2.324  -4.956
    6    HB3  MET   1           3HB      MET   1  17.143  -2.006  -3.289
    7    HG2  MET   1           2HG      MET   1  16.383  -0.230  -4.787
    8    HG3  MET   1           3HG      MET   1  17.542   0.382  -3.604
    9    HE1  MET   1           3HE      MET   1  18.333   2.605  -6.731
   10    HE2  MET   1           1HE      MET   1  17.900   2.593  -5.022
   11    HE3  MET   1           2HE      MET   1  16.743   2.030  -6.232
   12    H    SER   2           H        SER   2  19.244  -2.506  -1.212
   13    HA   SER   2           HA       SER   2  20.263  -5.207  -1.417
   14    HB2  SER   2           2HB      SER   2  20.785  -3.792   0.545
   15    HB3  SER   2           3HB      SER   2  19.069  -3.658   0.932
   16    HG   SER   2           HG       SER   2  19.164  -5.535   1.867
   17    H    GLY   3           H        GLY   3  19.029  -7.072  -0.609
   18    HA2  GLY   3           2HA      GLY   3  16.339  -7.340  -1.526
   19    HA3  GLY   3           3HA      GLY   3  17.220  -8.480  -0.516
   20    H    LYS   4           H        LYS   4  15.087  -5.730  -0.537
   21    HA   LYS   4           HA       LYS   4  15.219  -5.264   2.317
   22    HB2  LYS   4           2HB      LYS   4  14.975  -3.415   0.633
   23    HB3  LYS   4           3HB      LYS   4  13.369  -4.011   0.244
   24    HG2  LYS   4           2HG      LYS   4  13.273  -2.059   1.743
   25    HG3  LYS   4           3HG      LYS   4  12.591  -3.494   2.516
   26    HD2  LYS   4           2HD      LYS   4  13.991  -2.213   4.096
   27    HD3  LYS   4           3HD      LYS   4  14.672  -3.813   3.804
   28    HE2  LYS   4           2HE      LYS   4  16.263  -2.734   2.143
   29    HE3  LYS   4           3HE      LYS   4  15.647  -1.164   2.666
   30    HZ1  LYS   4           3HZ      LYS   4  16.435  -1.582   4.872
   31    HZ2  LYS   4           1HZ      LYS   4  17.714  -1.840   3.802
   32    HZ3  LYS   4           2HZ      LYS   4  16.901  -3.156   4.482
   33    H    LYS   5           H        LYS   5  14.409  -7.009   3.405
   34    HA   LYS   5           HA       LYS   5  11.675  -7.943   3.007
   35    HB2  LYS   5           2HB      LYS   5  13.634  -9.393   3.839
   36    HB3  LYS   5           3HB      LYS   5  13.553  -8.517   5.354
   37    HG2  LYS   5           2HG      LYS   5  11.176 -10.051   4.252
   38    HG3  LYS   5           3HG      LYS   5  12.416 -10.827   5.231
   39    HD2  LYS   5           2HD      LYS   5  10.655  -8.506   6.122
   40    HD3  LYS   5           3HD      LYS   5  10.437 -10.197   6.574
   41    HE2  LYS   5           2HE      LYS   5  12.473 -10.206   7.848
   42    HE3  LYS   5           3HE      LYS   5  12.960  -8.636   7.212
   43    HZ1  LYS   5           3HZ      LYS   5  12.100  -8.477   9.458
   44    HZ2  LYS   5           1HZ      LYS   5  10.624  -9.127   8.963
   45    HZ3  LYS   5           2HZ      LYS   5  11.122  -7.627   8.372
   46    H    VAL   6           H        VAL   6  10.445  -6.116   3.260
   47    HA   VAL   6           HA       VAL   6  10.534  -4.619   5.814
   48    HB   VAL   6           HB       VAL   6  10.788  -3.182   3.848
   49   HG11  VAL   6          1HG1      VAL   6   9.743  -4.611   2.135
   50   HG12  VAL   6          2HG1      VAL   6   9.087  -2.973   2.087
   51   HG13  VAL   6          3HG1      VAL   6   8.147  -4.277   2.817
   52   HG21  VAL   6          3HG2      VAL   6   8.981  -1.588   4.207
   53   HG22  VAL   6          1HG2      VAL   6   9.498  -2.285   5.744
   54   HG23  VAL   6          2HG2      VAL   6   8.001  -2.835   4.983
   55    H    GLU   7           H        GLU   7   8.541  -4.194   6.947
   56    HA   GLU   7           HA       GLU   7   6.375  -6.138   6.456
   57    HB2  GLU   7           2HB      GLU   7   7.324  -4.699   8.943
   58    HB3  GLU   7           3HB      GLU   7   5.650  -5.227   8.840
   59    HG2  GLU   7           2HG      GLU   7   6.987  -6.872  10.032
   60    HG3  GLU   7           3HG      GLU   7   6.368  -7.548   8.538
   61    H    VAL   8           H        VAL   8   4.789  -5.359   5.340
   62    HA   VAL   8           HA       VAL   8   4.114  -2.479   5.314
   63    HB   VAL   8           HB       VAL   8   3.827  -4.605   3.131
   64   HG11  VAL   8          1HG1      VAL   8   2.929  -1.703   3.025
   65   HG12  VAL   8          2HG1      VAL   8   1.870  -3.115   3.047
   66   HG13  VAL   8          3HG1      VAL   8   2.930  -2.829   1.665
   67   HG21  VAL   8          3HG2      VAL   8   5.522  -2.078   3.213
   68   HG22  VAL   8          1HG2      VAL   8   5.410  -3.203   1.855
   69   HG23  VAL   8          2HG2      VAL   8   6.122  -3.731   3.382
   70    H    GLN   9           H        GLN   9   2.274  -2.090   6.409
   71    HA   GLN   9           HA       GLN   9   0.361  -4.280   6.931
   72    HB2  GLN   9           2HB      GLN   9   0.659  -1.613   8.396
   73    HB3  GLN   9           3HB      GLN   9  -0.354  -2.976   8.875
   74    HG2  GLN   9           2HG      GLN   9   1.723  -4.340   9.207
   75    HG3  GLN   9           3HG      GLN   9   2.682  -2.909   8.835
   76   HE21  GLN   9          1HE2      GLN   9   0.625  -4.446  11.187
   77   HE22  GLN   9          2HE2      GLN   9   0.962  -3.360  12.489
   78    H    VAL  10           H        VAL  10  -1.262  -4.234   5.449
   79    HA   VAL  10           HA       VAL  10  -2.227  -1.681   4.336
   80    HB   VAL  10           HB       VAL  10  -2.927  -4.553   3.540
   81   HG11  VAL  10          1HG1      VAL  10  -3.987  -3.554   1.535
   82   HG12  VAL  10          2HG1      VAL  10  -3.664  -1.938   2.169
   83   HG13  VAL  10          3HG1      VAL  10  -4.776  -3.013   3.021
   84   HG21  VAL  10          3HG2      VAL  10  -0.578  -4.010   3.019
   85   HG22  VAL  10          1HG2      VAL  10  -1.087  -2.550   2.164
   86   HG23  VAL  10          2HG2      VAL  10  -1.523  -4.142   1.534
   87    H    LYS  11           H        LYS  11  -3.720  -0.718   5.542
   88    HA   LYS  11           HA       LYS  11  -5.630  -2.265   7.202
   89    HB2  LYS  11           2HB      LYS  11  -3.970  -0.952   8.485
   90    HB3  LYS  11           3HB      LYS  11  -4.373   0.496   7.577
   91    HG2  LYS  11           2HG      LYS  11  -6.633   0.462   8.595
   92    HG3  LYS  11           3HG      LYS  11  -6.161  -0.950   9.549
   93    HD2  LYS  11           2HD      LYS  11  -4.370   0.359  10.628
   94    HD3  LYS  11           3HD      LYS  11  -4.777   1.764   9.636
   95    HE2  LYS  11           2HE      LYS  11  -5.709   2.039  11.857
   96    HE3  LYS  11           3HE      LYS  11  -7.012   1.828  10.692
   97    HZ1  LYS  11           3HZ      LYS  11  -5.957  -0.311  12.469
   98    HZ2  LYS  11           1HZ      LYS  11  -7.255  -0.457  11.400
   99    HZ3  LYS  11           2HZ      LYS  11  -7.373   0.566  12.741
  100    H    ILE  12           H        ILE  12  -7.535  -2.301   6.033
  101    HA   ILE  12           HA       ILE  12  -8.338   0.145   4.557
  102    HB   ILE  12           HB       ILE  12  -7.636  -1.473   2.916
  103   HG12  ILE  12          2HG1      ILE  12 -10.684  -1.403   3.013
  104   HG13  ILE  12          3HG1      ILE  12  -9.655  -0.121   2.387
  105   HG21  ILE  12          1HG2      ILE  12  -9.550  -3.490   4.132
  106   HG22  ILE  12          2HG2      ILE  12  -7.789  -3.548   4.231
  107   HG23  ILE  12          3HG2      ILE  12  -8.592  -3.725   2.668
  108   HD11  ILE  12          3HD1      ILE  12  -8.875  -1.640   0.626
  109   HD12  ILE  12          1HD1      ILE  12 -10.617  -1.382   0.594
  110   HD13  ILE  12          2HD1      ILE  12  -9.966  -2.888   1.240
  111    H    THR  13           H        THR  13 -10.241   0.942   5.035
  112    HA   THR  13           HA       THR  13 -12.031  -0.439   6.902
  113    HB   THR  13           HB       THR  13 -12.012   2.499   6.071
  114    HG1  THR  13           HG1      THR  13 -10.041   2.040   7.079
  115   HG21  THR  13          3HG2      THR  13 -13.217   1.117   8.496
  116   HG22  THR  13          1HG2      THR  13 -14.128   1.757   7.115
  117   HG23  THR  13          2HG2      THR  13 -13.241   2.850   8.177
  118    H    CYS  14           H        CYS  14 -13.849  -1.344   6.044
  119    HA   CYS  14           HA       CYS  14 -15.326  -0.015   3.895
  120    HB2  CYS  14           2HB      CYS  14 -13.641  -1.748   2.922
  121    HB3  CYS  14           3HB      CYS  14 -14.704  -2.971   3.589
  122    H    ASN  15           H        ASN  15 -17.405  -0.062   4.312
  123    HA   ASN  15           HA       ASN  15 -19.498  -0.707   4.760
  124    HB2  ASN  15           2HB      ASN  15 -18.945  -3.016   4.071
  125    HB3  ASN  15           3HB      ASN  15 -18.341  -3.370   5.684
  126   HD21  ASN  15          1HD2      ASN  15 -21.300  -1.514   5.089
  127   HD22  ASN  15          2HD2      ASN  15 -22.373  -2.721   5.682
  128    H    GLY  16           H        GLY  16 -17.617  -2.175   7.434
  129    HA2  GLY  16           2HA      GLY  16 -18.026   0.076   9.167
  130    HA3  GLY  16           3HA      GLY  16 -19.082  -1.271   9.594
  131    H    LYS  17           H        LYS  17 -16.274  -2.440   8.215
  132    HA   LYS  17           HA       LYS  17 -14.945  -2.895  10.827
  133    HB2  LYS  17           2HB      LYS  17 -15.144  -4.758   8.417
  134    HB3  LYS  17           3HB      LYS  17 -14.165  -5.073   9.848
  135    HG2  LYS  17           2HG      LYS  17 -16.168  -5.234  11.234
  136    HG3  LYS  17           3HG      LYS  17 -17.185  -4.776   9.868
  137    HD2  LYS  17           2HD      LYS  17 -17.258  -7.210  10.273
  138    HD3  LYS  17           3HD      LYS  17 -16.583  -6.836   8.685
  139    HE2  LYS  17           2HE      LYS  17 -15.333  -8.641   9.816
  140    HE3  LYS  17           3HE      LYS  17 -14.312  -7.230   9.537
  141    HZ1  LYS  17           3HZ      LYS  17 -13.957  -8.102  11.741
  142    HZ2  LYS  17           1HZ      LYS  17 -15.600  -7.992  12.106
  143    HZ3  LYS  17           2HZ      LYS  17 -14.695  -6.588  11.866
  144    H    THR  18           H        THR  18 -12.653  -3.033  10.758
  145    HA   THR  18           HA       THR  18 -11.348  -1.853   8.371
  146    HB   THR  18           HB       THR  18 -10.258  -1.672  11.218
  147    HG1  THR  18           HG1      THR  18 -12.405  -0.419  10.273
  148   HG21  THR  18          3HG2      THR  18  -8.907   0.172  10.273
  149   HG22  THR  18          1HG2      THR  18  -9.665  -0.063   8.701
  150   HG23  THR  18          2HG2      THR  18  -8.625  -1.324   9.375
  151    H    TYR  19           H        TYR  19  -9.954  -3.180   7.402
  152    HA   TYR  19           HA       TYR  19  -9.259  -5.771   8.619
  153    HB2  TYR  19           2HB      TYR  19  -9.388  -5.050   5.646
  154    HB3  TYR  19           3HB      TYR  19  -9.182  -6.656   6.332
  155    HD1  TYR  19           HD2      TYR  19 -11.632  -3.865   5.901
  156    HD2  TYR  19           HD1      TYR  19 -11.112  -7.978   6.954
  157    HE1  TYR  19           HE2      TYR  19 -14.067  -4.177   5.853
  158    HE2  TYR  19           HE1      TYR  19 -13.553  -8.288   6.903
  159    HH   TYR  19           HH       TYR  19 -15.707  -5.954   5.616
  160    H    GLU  20           H        GLU  20  -7.285  -5.275   9.554
  161    HA   GLU  20           HA       GLU  20  -5.145  -4.353   7.721
  162    HB2  GLU  20           2HB      GLU  20  -3.838  -3.665   9.733
  163    HB3  GLU  20           3HB      GLU  20  -5.297  -2.734   9.478
  164    HG2  GLU  20           2HG      GLU  20  -5.123  -4.997  11.484
  165    HG3  GLU  20           3HG      GLU  20  -4.740  -3.323  11.877
  166    H    ARG  21           H        ARG  21  -3.225  -5.400   7.693
  167    HA   ARG  21           HA       ARG  21  -2.769  -7.889   9.126
  168    HB2  ARG  21           2HB      ARG  21  -4.314  -8.551   7.260
  169    HB3  ARG  21           3HB      ARG  21  -3.211  -7.842   6.096
  170    HG2  ARG  21           2HG      ARG  21  -2.639 -10.069   5.880
  171    HG3  ARG  21           3HG      ARG  21  -1.484  -9.589   7.121
  172    HD2  ARG  21           2HD      ARG  21  -4.134 -10.992   7.592
  173    HD3  ARG  21           3HD      ARG  21  -2.543 -11.748   7.633
  174    HE   ARG  21           HE       ARG  21  -3.473  -9.698   9.563
  175   HH11  ARG  21          1HH1      ARG  21  -1.654 -12.658   8.910
  176   HH12  ARG  21          2HH1      ARG  21  -1.156 -12.833  10.563
  177   HH21  ARG  21          1HH2      ARG  21  -2.772  -9.945  11.684
  178   HH22  ARG  21          2HH2      ARG  21  -1.787 -11.301  12.123
  179    H    THR  22           H        THR  22  -0.565  -8.107   9.362
  180    HA   THR  22           HA       THR  22   1.219  -6.222   8.032
  181    HB   THR  22           HB       THR  22   1.832  -8.332  10.152
  182    HG1  THR  22           HG1      THR  22   1.245  -6.884  11.583
  183   HG21  THR  22          3HG2      THR  22   3.479  -5.947   9.228
  184   HG22  THR  22          1HG2      THR  22   3.867  -7.645   8.929
  185   HG23  THR  22          2HG2      THR  22   3.884  -7.011  10.576
  186    H    TYR  23           H        TYR  23   1.932  -6.782   6.058
  187    HA   TYR  23           HA       TYR  23   2.354  -9.603   5.298
  188    HB2  TYR  23           2HB      TYR  23   2.380  -7.091   3.551
  189    HB3  TYR  23           3HB      TYR  23   2.451  -8.756   2.979
  190    HD1  TYR  23           HD2      TYR  23   0.424 -10.226   3.153
  191    HD2  TYR  23           HD1      TYR  23   0.263  -6.082   4.165
  192    HE1  TYR  23           HE2      TYR  23  -2.039 -10.289   3.064
  193    HE2  TYR  23           HE1      TYR  23  -2.179  -6.145   4.086
  194    HH   TYR  23           HH       TYR  23  -3.931  -8.999   4.089
  195    H    GLN  24           H        GLN  24   4.352 -10.361   4.755
  196    HA   GLN  24           HA       GLN  24   6.711  -8.650   5.206
  197    HB2  GLN  24           2HB      GLN  24   6.304 -11.677   5.070
  198    HB3  GLN  24           3HB      GLN  24   7.908 -10.953   5.019
  199    HG2  GLN  24           2HG      GLN  24   7.392 -11.717   7.268
  200    HG3  GLN  24           3HG      GLN  24   7.554  -9.968   7.230
  201   HE21  GLN  24          1HE2      GLN  24   6.353  -9.529   9.039
  202   HE22  GLN  24          2HE2      GLN  24   4.663  -9.854   9.178
  203    H    LEU  25           H        LEU  25   7.171  -7.570   3.352
  204    HA   LEU  25           HA       LEU  25   6.971  -8.953   0.744
  205    HB2  LEU  25           2HB      LEU  25   7.075  -5.966   1.349
  206    HB3  LEU  25           3HB      LEU  25   7.006  -6.669  -0.260
  207    HG   LEU  25           HG       LEU  25   4.819  -6.646   1.850
  208   HD11  LEU  25          1HD1      LEU  25   3.524  -5.458   0.129
  209   HD12  LEU  25          2HD1      LEU  25   4.910  -5.515  -0.965
  210   HD13  LEU  25          3HD1      LEU  25   5.007  -4.600   0.542
  211   HD21  LEU  25          3HD2      LEU  25   4.777  -8.873   0.851
  212   HD22  LEU  25          1HD2      LEU  25   4.806  -8.185  -0.776
  213   HD23  LEU  25          2HD2      LEU  25   3.405  -7.936   0.271
  214    H    TYR  26           H        TYR  26   8.857  -9.738   0.072
  215    HA   TYR  26           HA       TYR  26  11.391  -8.356   0.720
  216    HB2  TYR  26           2HB      TYR  26  11.211 -10.729   1.463
  217    HB3  TYR  26           3HB      TYR  26  10.908 -11.228  -0.195
  218    HD1  TYR  26           HD1      TYR  26  13.475  -9.873   2.114
  219    HD2  TYR  26           HD2      TYR  26  12.761 -11.475  -1.771
  220    HE1  TYR  26           HE1      TYR  26  15.890 -10.104   1.768
  221    HE2  TYR  26           HE2      TYR  26  15.183 -11.703  -2.120
  222    HH   TYR  26           HH       TYR  26  17.454 -11.346   0.432
  223    H    ALA  27           H        ALA  27  12.278  -7.199  -0.905
  224    HA   ALA  27           HA       ALA  27  12.185  -8.218  -3.654
  225    HB1  ALA  27           3HB      ALA  27  10.296  -6.653  -3.554
  226    HB2  ALA  27           1HB      ALA  27  11.581  -6.015  -4.582
  227    HB3  ALA  27           2HB      ALA  27  11.357  -5.380  -2.949
  228    H    VAL  28           H        VAL  28  14.193  -8.305  -4.291
  229    HA   VAL  28           HA       VAL  28  16.387  -6.777  -3.272
  230    HB   VAL  28           HB       VAL  28  16.185  -8.461  -5.817
  231   HG11  VAL  28          1HG1      VAL  28  18.666  -7.577  -4.303
  232   HG12  VAL  28          2HG1      VAL  28  18.145  -6.997  -5.888
  233   HG13  VAL  28          3HG1      VAL  28  18.637  -8.678  -5.685
  234   HG21  VAL  28          3HG2      VAL  28  17.099  -9.319  -3.044
  235   HG22  VAL  28          1HG2      VAL  28  17.154 -10.316  -4.503
  236   HG23  VAL  28          2HG2      VAL  28  15.600  -9.803  -3.843
  237    H    ARG  29           H        ARG  29  14.086  -6.458  -5.858
  238    HA   ARG  29           HA       ARG  29  15.485  -4.157  -7.078
  239    HB2  ARG  29           2HB      ARG  29  13.345  -5.821  -8.446
  240    HB3  ARG  29           3HB      ARG  29  14.540  -4.763  -9.186
  241    HG2  ARG  29           2HG      ARG  29  16.328  -6.396  -8.585
  242    HG3  ARG  29           3HG      ARG  29  15.107  -7.449  -7.867
  243    HD2  ARG  29           2HD      ARG  29  13.987  -7.511 -10.169
  244    HD3  ARG  29           3HD      ARG  29  15.430  -6.712 -10.799
  245    HE   ARG  29           HE       ARG  29  15.150  -9.476  -9.962
  246   HH11  ARG  29          1HH1      ARG  29  17.474  -6.949 -10.721
  247   HH12  ARG  29          2HH1      ARG  29  18.760  -8.066 -11.027
  248   HH21  ARG  29          1HH2      ARG  29  16.837 -10.917 -10.375
  249   HH22  ARG  29          2HH2      ARG  29  18.398 -10.321 -10.837
  250    H    ASP  30           H        ASP  30  14.199  -2.317  -7.663
  251    HA   ASP  30           HA       ASP  30  12.184  -1.549  -5.798
  252    HB2  ASP  30           2HB      ASP  30  12.902  -0.167  -8.429
  253    HB3  ASP  30           3HB      ASP  30  12.066   0.565  -7.063
  254    H    GLU  31           H        GLU  31  12.096  -2.372  -9.253
  255    HA   GLU  31           HA       GLU  31   9.361  -1.960  -9.765
  256    HB2  GLU  31           2HB      GLU  31  11.318  -3.862 -11.112
  257    HB3  GLU  31           3HB      GLU  31   9.732  -3.453 -11.757
  258    HG2  GLU  31           2HG      GLU  31  12.054  -1.547 -11.349
  259    HG3  GLU  31           3HG      GLU  31  11.501  -2.203 -12.887
  260    H    GLU  32           H        GLU  32  11.055  -4.703  -8.366
  261    HA   GLU  32           HA       GLU  32   9.043  -6.653  -8.551
  262    HB2  GLU  32           2HB      GLU  32  11.360  -6.243  -6.642
  263    HB3  GLU  32           3HB      GLU  32  10.253  -7.597  -6.439
  264    HG2  GLU  32           2HG      GLU  32  11.962  -7.053  -8.886
  265    HG3  GLU  32           3HG      GLU  32  12.291  -8.243  -7.632
  266    H    LEU  33           H        LEU  33   9.709  -4.219  -5.992
  267    HA   LEU  33           HA       LEU  33   7.658  -5.140  -4.242
  268    HB2  LEU  33           2HB      LEU  33   9.789  -3.514  -3.870
  269    HB3  LEU  33           3HB      LEU  33   8.571  -2.277  -4.077
  270    HG   LEU  33           HG       LEU  33   8.954  -2.724  -1.691
  271   HD11  LEU  33          1HD1      LEU  33   6.682  -2.072  -2.295
  272   HD12  LEU  33          2HD1      LEU  33   6.703  -3.130  -0.888
  273   HD13  LEU  33          3HD1      LEU  33   6.224  -3.771  -2.465
  274   HD21  LEU  33          3HD2      LEU  33   8.414  -4.885  -0.640
  275   HD22  LEU  33          1HD2      LEU  33   9.738  -5.028  -1.794
  276   HD23  LEU  33          2HD2      LEU  33   8.124  -5.592  -2.233
  277    H    LYS  34           H        LYS  34   7.736  -2.758  -6.883
  278    HA   LYS  34           HA       LYS  34   5.282  -1.469  -6.570
  279    HB2  LYS  34           2HB      LYS  34   6.729  -2.294  -9.120
  280    HB3  LYS  34           3HB      LYS  34   5.274  -1.302  -9.132
  281    HG2  LYS  34           2HG      LYS  34   6.420   0.460  -7.886
  282    HG3  LYS  34           3HG      LYS  34   7.870  -0.541  -7.759
  283    HD2  LYS  34           2HD      LYS  34   8.058   1.186  -9.546
  284    HD3  LYS  34           3HD      LYS  34   8.206  -0.455 -10.172
  285    HE2  LYS  34           2HE      LYS  34   5.815  -0.345 -10.902
  286    HE3  LYS  34           3HE      LYS  34   5.752   1.326 -10.345
  287    HZ1  LYS  34           3HZ      LYS  34   7.372   1.943 -11.968
  288    HZ2  LYS  34           1HZ      LYS  34   6.158   1.076 -12.757
  289    HZ3  LYS  34           2HZ      LYS  34   7.637   0.334 -12.416
  290    H    GLU  35           H        GLU  35   5.890  -4.377  -8.591
  291    HA   GLU  35           HA       GLU  35   3.173  -4.877  -9.136
  292    HB2  GLU  35           2HB      GLU  35   3.915  -6.882 -10.245
  293    HB3  GLU  35           3HB      GLU  35   5.068  -5.602 -10.564
  294    HG2  GLU  35           2HG      GLU  35   6.503  -7.369 -10.203
  295    HG3  GLU  35           3HG      GLU  35   6.422  -6.705  -8.574
  296    H    LYS  36           H        LYS  36   5.184  -5.879  -6.449
  297    HA   LYS  36           HA       LYS  36   3.463  -7.934  -5.436
  298    HB2  LYS  36           2HB      LYS  36   5.693  -6.307  -4.165
  299    HB3  LYS  36           3HB      LYS  36   4.795  -7.528  -3.261
  300    HG2  LYS  36           2HG      LYS  36   5.593  -9.298  -4.628
  301    HG3  LYS  36           3HG      LYS  36   6.181  -8.186  -5.868
  302    HD2  LYS  36           2HD      LYS  36   7.907  -7.362  -4.255
  303    HD3  LYS  36           3HD      LYS  36   7.349  -8.566  -3.085
  304    HE2  LYS  36           2HE      LYS  36   9.393  -9.238  -4.433
  305    HE3  LYS  36           3HE      LYS  36   8.051 -10.379  -4.492
  306    HZ1  LYS  36           3HZ      LYS  36   9.148  -9.907  -6.663
  307    HZ2  LYS  36           1HZ      LYS  36   8.524  -8.339  -6.583
  308    HZ3  LYS  36           2HZ      LYS  36   7.476  -9.659  -6.648
  309    H    LEU  37           H        LEU  37   3.723  -4.440  -4.851
  310    HA   LEU  37           HA       LEU  37   1.678  -4.207  -2.920
  311    HB2  LEU  37           2HB      LEU  37   2.623  -2.239  -5.031
  312    HB3  LEU  37           3HB      LEU  37   1.481  -1.821  -3.760
  313    HG   LEU  37           HG       LEU  37   4.300  -2.816  -3.200
  314   HD11  LEU  37          1HD1      LEU  37   3.313   0.039  -3.315
  315   HD12  LEU  37          2HD1      LEU  37   4.442  -0.731  -4.432
  316   HD13  LEU  37          3HD1      LEU  37   4.903  -0.486  -2.749
  317   HD21  LEU  37          3HD2      LEU  37   2.267  -1.459  -1.394
  318   HD22  LEU  37          1HD2      LEU  37   3.916  -1.908  -0.945
  319   HD23  LEU  37          2HD2      LEU  37   2.741  -3.160  -1.339
  320    H    LYS  38           H        LYS  38   1.545  -3.986  -6.523
  321    HA   LYS  38           HA       LYS  38  -1.213  -3.702  -6.820
  322    HB2  LYS  38           2HB      LYS  38   0.722  -5.177  -8.657
  323    HB3  LYS  38           3HB      LYS  38  -0.902  -4.657  -9.101
  324    HG2  LYS  38           2HG      LYS  38  -0.173  -2.274  -8.659
  325    HG3  LYS  38           3HG      LYS  38   1.471  -2.884  -8.441
  326    HD2  LYS  38           2HD      LYS  38   1.224  -2.040 -10.718
  327    HD3  LYS  38           3HD      LYS  38   1.415  -3.794 -10.769
  328    HE2  LYS  38           2HE      LYS  38  -1.033  -4.048 -11.058
  329    HE3  LYS  38           3HE      LYS  38  -1.222  -2.295 -10.986
  330    HZ1  LYS  38           3HZ      LYS  38   0.293  -3.785 -13.064
  331    HZ2  LYS  38           1HZ      LYS  38   0.122  -2.109 -12.986
  332    HZ3  LYS  38           2HZ      LYS  38  -1.231  -3.078 -13.262
  333    H    LYS  39           H        LYS  39   0.725  -6.662  -6.380
  334    HA   LYS  39           HA       LYS  39  -1.309  -8.575  -6.694
  335    HB2  LYS  39           2HB      LYS  39   1.238  -8.629  -5.043
  336    HB3  LYS  39           3HB      LYS  39   0.143 -10.003  -5.082
  337    HG2  LYS  39           2HG      LYS  39   1.571  -8.839  -7.496
  338    HG3  LYS  39           3HG      LYS  39   2.077 -10.270  -6.594
  339    HD2  LYS  39           2HD      LYS  39  -0.168 -11.313  -7.183
  340    HD3  LYS  39           3HD      LYS  39  -0.456  -9.932  -8.250
  341    HE2  LYS  39           2HE      LYS  39   1.810 -11.952  -8.487
  342    HE3  LYS  39           3HE      LYS  39   0.393 -11.843  -9.530
  343    HZ1  LYS  39           3HZ      LYS  39   1.151  -9.681 -10.282
  344    HZ2  LYS  39           1HZ      LYS  39   2.342 -10.846 -10.546
  345    HZ3  LYS  39           2HZ      LYS  39   2.494  -9.761  -9.263
  346    H    VAL  40           H        VAL  40  -0.032  -7.213  -3.630
  347    HA   VAL  40           HA       VAL  40  -1.804  -8.572  -1.916
  348    HB   VAL  40           HB       VAL  40  -0.209  -6.012  -1.424
  349   HG11  VAL  40          1HG1      VAL  40  -0.458  -6.494   0.994
  350   HG12  VAL  40          2HG1      VAL  40  -1.564  -7.815   0.612
  351   HG13  VAL  40          3HG1      VAL  40  -2.012  -6.150   0.229
  352   HG21  VAL  40          3HG2      VAL  40   1.204  -7.954  -1.995
  353   HG22  VAL  40          1HG2      VAL  40   0.433  -8.905  -0.727
  354   HG23  VAL  40          2HG2      VAL  40   1.423  -7.505  -0.301
  355    H    LEU  41           H        LEU  41  -1.958  -5.246  -3.213
  356    HA   LEU  41           HA       LEU  41  -4.289  -4.426  -1.841
  357    HB2  LEU  41           2HB      LEU  41  -2.900  -3.384  -4.328
  358    HB3  LEU  41           3HB      LEU  41  -4.367  -2.634  -3.719
  359    HG   LEU  41           HG       LEU  41  -1.831  -2.910  -2.052
  360   HD11  LEU  41          1HD1      LEU  41  -1.358  -1.487  -3.996
  361   HD12  LEU  41          2HD1      LEU  41  -1.385  -0.547  -2.505
  362   HD13  LEU  41          3HD1      LEU  41  -2.759  -0.480  -3.614
  363   HD21  LEU  41          3HD2      LEU  41  -4.325  -1.223  -1.645
  364   HD22  LEU  41          1HD2      LEU  41  -2.897  -1.236  -0.607
  365   HD23  LEU  41          2HD2      LEU  41  -3.894  -2.680  -0.741
  366    H    ASN  42           H        ASN  42  -3.935  -5.412  -5.316
  367    HA   ASN  42           HA       ASN  42  -6.659  -5.283  -5.977
  368    HB2  ASN  42           2HB      ASN  42  -4.740  -5.353  -7.583
  369    HB3  ASN  42           3HB      ASN  42  -4.517  -7.057  -7.227
  370   HD21  ASN  42          1HD2      ASN  42  -4.937  -7.858  -9.249
  371   HD22  ASN  42          2HD2      ASN  42  -6.447  -7.682 -10.071
  372    H    GLU  43           H        GLU  43  -4.770  -8.044  -4.696
  373    HA   GLU  43           HA       GLU  43  -6.811 -10.015  -4.955
  374    HB2  GLU  43           2HB      GLU  43  -4.384  -9.900  -3.121
  375    HB3  GLU  43           3HB      GLU  43  -5.472 -11.281  -3.182
  376    HG2  GLU  43           2HG      GLU  43  -3.723 -10.259  -5.434
  377    HG3  GLU  43           3HG      GLU  43  -3.470 -11.713  -4.474
  378    H    ARG  44           H        ARG  44  -5.819  -7.907  -2.235
  379    HA   ARG  44           HA       ARG  44  -7.607  -9.135  -0.357
  380    HB2  ARG  44           2HB      ARG  44  -5.335  -7.720   0.007
  381    HB3  ARG  44           3HB      ARG  44  -6.474  -6.399   0.214
  382    HG2  ARG  44           2HG      ARG  44  -5.916  -7.344   2.383
  383    HG3  ARG  44           3HG      ARG  44  -7.611  -7.697   2.018
  384    HD2  ARG  44           2HD      ARG  44  -6.438  -9.662   2.986
  385    HD3  ARG  44           3HD      ARG  44  -7.007  -9.990   1.342
  386    HE   ARG  44           HE       ARG  44  -4.219  -9.155   1.879
  387   HH11  ARG  44          1HH1      ARG  44  -6.412 -11.506   0.424
  388   HH12  ARG  44          2HH1      ARG  44  -5.134 -12.388  -0.350
  389   HH21  ARG  44          1HH2      ARG  44  -2.576 -10.331   0.884
  390   HH22  ARG  44          2HH2      ARG  44  -2.961 -11.716  -0.082
  391    H    MET  45           H        MET  45  -7.772  -6.354  -2.476
  392    HA   MET  45           HA       MET  45 -10.151  -5.255  -1.232
  393    HB2  MET  45           2HB      MET  45  -8.552  -4.402  -3.664
  394    HB3  MET  45           3HB      MET  45 -10.023  -3.588  -3.149
  395    HG2  MET  45           2HG      MET  45  -8.814  -3.324  -0.857
  396    HG3  MET  45           3HG      MET  45  -7.349  -3.694  -1.767
  397    HE1  MET  45           3HE      MET  45 -10.077  -0.082  -2.716
  398    HE2  MET  45           1HE      MET  45 -10.449  -1.270  -1.468
  399    HE3  MET  45           2HE      MET  45 -10.503  -1.734  -3.170
  400    H    ASP  46           H        ASP  46  -9.548  -7.684  -3.512
  401    HA   ASP  46           HA       ASP  46 -11.719  -7.369  -5.268
  402    HB2  ASP  46           2HB      ASP  46  -9.887  -8.894  -5.789
  403    HB3  ASP  46           3HB      ASP  46 -10.294  -9.921  -4.421
  404    HA   PRO  47           HA       PRO  47 -14.540  -9.926  -2.229
  405    HB2  PRO  47           2HB      PRO  47 -13.732 -10.281   0.377
  406    HB3  PRO  47           3HB      PRO  47 -13.389 -11.462  -0.907
  407    HG2  PRO  47           2HG      PRO  47 -11.595  -9.307   0.186
  408    HG3  PRO  47           3HG      PRO  47 -11.225 -11.019  -0.136
  409    HD2  PRO  47           2HD      PRO  47 -10.513  -9.096  -1.878
  410    HD3  PRO  47           3HD      PRO  47 -11.050 -10.691  -2.439
  411    H    ILE  48           H        ILE  48 -12.556  -7.216  -1.140
  412    HA   ILE  48           HA       ILE  48 -14.314  -6.060   0.775
  413    HB   ILE  48           HB       ILE  48 -12.085  -4.860  -0.915
  414   HG12  ILE  48          2HG1      ILE  48 -11.357  -6.492   0.782
  415   HG13  ILE  48          3HG1      ILE  48 -10.790  -4.883   1.196
  416   HG21  ILE  48          1HG2      ILE  48 -13.594  -3.016  -0.427
  417   HG22  ILE  48          2HG2      ILE  48 -12.113  -2.855   0.513
  418   HG23  ILE  48          3HG2      ILE  48 -13.587  -3.430   1.288
  419   HD11  ILE  48          3HD1      ILE  48 -11.505  -6.071   3.159
  420   HD12  ILE  48          1HD1      ILE  48 -13.101  -6.352   2.467
  421   HD13  ILE  48          2HD1      ILE  48 -12.589  -4.711   2.876
  422    H    LYS  49           H        LYS  49 -13.953  -5.514  -2.740
  423    HA   LYS  49           HA       LYS  49 -15.884  -3.434  -2.940
  424    HB2  LYS  49           2HB      LYS  49 -14.924  -5.333  -5.114
  425    HB3  LYS  49           3HB      LYS  49 -15.785  -3.813  -5.370
  426    HG2  LYS  49           2HG      LYS  49 -13.911  -2.541  -4.520
  427    HG3  LYS  49           3HG      LYS  49 -13.052  -4.008  -4.066
  428    HD2  LYS  49           2HD      LYS  49 -13.747  -3.176  -6.913
  429    HD3  LYS  49           3HD      LYS  49 -12.166  -2.989  -6.151
  430    HE2  LYS  49           2HE      LYS  49 -12.048  -5.476  -5.885
  431    HE3  LYS  49           3HE      LYS  49 -13.580  -5.608  -6.754
  432    HZ1  LYS  49           3HZ      LYS  49 -11.831  -5.981  -8.290
  433    HZ2  LYS  49           1HZ      LYS  49 -11.003  -4.592  -7.812
  434    HZ3  LYS  49           2HZ      LYS  49 -12.464  -4.455  -8.640
  435    H    LYS  50           H        LYS  50 -16.000  -6.909  -3.066
  436    HA   LYS  50           HA       LYS  50 -18.697  -7.272  -3.903
  437    HB2  LYS  50           2HB      LYS  50 -16.862  -8.955  -4.100
  438    HB3  LYS  50           3HB      LYS  50 -16.838  -9.120  -2.350
  439    HG2  LYS  50           2HG      LYS  50 -19.217  -9.954  -2.473
  440    HG3  LYS  50           3HG      LYS  50 -19.082  -9.917  -4.233
  441    HD2  LYS  50           2HD      LYS  50 -17.443 -11.615  -2.313
  442    HD3  LYS  50           3HD      LYS  50 -18.673 -12.191  -3.437
  443    HE2  LYS  50           2HE      LYS  50 -17.257 -11.565  -5.342
  444    HE3  LYS  50           3HE      LYS  50 -16.052 -10.881  -4.249
  445    HZ1  LYS  50           3HZ      LYS  50 -15.711 -13.093  -3.316
  446    HZ2  LYS  50           1HZ      LYS  50 -15.402 -13.071  -4.978
  447    HZ3  LYS  50           2HZ      LYS  50 -16.838 -13.743  -4.393
  448    H    LEU  51           H        LEU  51 -17.149  -6.702  -0.778
  449    HA   LEU  51           HA       LEU  51 -19.391  -7.366   0.906
  450    HB2  LEU  51           2HB      LEU  51 -17.017  -5.530   1.479
  451    HB3  LEU  51           3HB      LEU  51 -18.177  -6.074   2.682
  452    HG   LEU  51           HG       LEU  51 -16.176  -7.812   1.195
  453   HD11  LEU  51          1HD1      LEU  51 -16.289  -7.052   4.119
  454   HD12  LEU  51          2HD1      LEU  51 -15.138  -6.453   2.922
  455   HD13  LEU  51          3HD1      LEU  51 -15.128  -8.156   3.372
  456   HD21  LEU  51          3HD2      LEU  51 -18.215  -9.088   1.526
  457   HD22  LEU  51          1HD2      LEU  51 -18.241  -8.664   3.240
  458   HD23  LEU  51          2HD2      LEU  51 -16.948  -9.680   2.594
  459    H    GLY  52           H        GLY  52 -18.200  -4.449  -0.695
  460    HA2  GLY  52           2HA      GLY  52 -19.619  -2.929  -1.772
  461    HA3  GLY  52           3HA      GLY  52 -20.960  -3.468  -0.781
  462    H    CYS  53           H        CYS  53 -19.091  -0.906  -1.402
  463    HA   CYS  53           HA       CYS  53 -19.785   0.508   1.034
  464    HB2  CYS  53           2HB      CYS  53 -16.883   0.201   0.125
  465    HB3  CYS  53           3HB      CYS  53 -17.427   1.332   1.361
  466    H    LYS  54           H        LYS  54 -19.727   2.842   0.679
  467    HA   LYS  54           HA       LYS  54 -19.866   3.706  -2.069
  468    HB2  LYS  54           2HB      LYS  54 -20.324   5.925  -1.272
  469    HB3  LYS  54           3HB      LYS  54 -21.217   4.817  -0.250
  470    HG2  LYS  54           2HG      LYS  54 -18.545   5.958   0.607
  471    HG3  LYS  54           3HG      LYS  54 -20.043   6.851   0.848
  472    HD2  LYS  54           2HD      LYS  54 -19.553   4.052   1.936
  473    HD3  LYS  54           3HD      LYS  54 -19.242   5.529   2.850
  474    HE2  LYS  54           2HE      LYS  54 -21.602   6.140   2.766
  475    HE3  LYS  54           3HE      LYS  54 -21.960   4.764   1.716
  476    HZ1  LYS  54           3HZ      LYS  54 -20.962   4.591   4.510
  477    HZ2  LYS  54           1HZ      LYS  54 -21.312   3.279   3.508
  478    HZ3  LYS  54           2HZ      LYS  54 -22.553   4.307   4.016
  479    H    ARG  55           H        ARG  55 -17.477   3.752   0.487
  480    HA   ARG  55           HA       ARG  55 -15.300   4.384  -1.295
  481    HB2  ARG  55           2HB      ARG  55 -16.266   6.637  -0.720
  482    HB3  ARG  55           3HB      ARG  55 -15.973   6.309   0.984
  483    HG2  ARG  55           2HG      ARG  55 -13.549   6.273   0.588
  484    HG3  ARG  55           3HG      ARG  55 -13.810   6.484  -1.147
  485    HD2  ARG  55           2HD      ARG  55 -14.494   8.476   1.038
  486    HD3  ARG  55           3HD      ARG  55 -13.179   8.610  -0.139
  487    HE   ARG  55           HE       ARG  55 -15.736   8.336  -1.406
  488   HH11  ARG  55          1HH1      ARG  55 -13.621  10.716   0.097
  489   HH12  ARG  55          2HH1      ARG  55 -14.338  12.045  -0.762
  490   HH21  ARG  55          1HH2      ARG  55 -16.662  10.062  -2.492
  491   HH22  ARG  55          2HH2      ARG  55 -16.066  11.673  -2.231
  492    H    VAL  56           H        VAL  56 -13.300   3.826  -0.370
  493    HA   VAL  56           HA       VAL  56 -13.373   2.469   2.273
  494    HB   VAL  56           HB       VAL  56 -11.410   1.111   1.441
  495   HG11  VAL  56          1HG1      VAL  56 -12.732  -0.453   0.070
  496   HG12  VAL  56          2HG1      VAL  56 -13.975   0.784  -0.146
  497   HG13  VAL  56          3HG1      VAL  56 -13.645   0.137   1.462
  498   HG21  VAL  56          3HG2      VAL  56 -10.964   0.972  -0.992
  499   HG22  VAL  56          1HG2      VAL  56 -10.621   2.586  -0.366
  500   HG23  VAL  56          2HG2      VAL  56 -12.101   2.292  -1.282
  501    H    ARG  57           H        ARG  57 -11.857   3.020   3.767
  502    HA   ARG  57           HA       ARG  57  -9.871   5.117   3.096
  503    HB2  ARG  57           2HB      ARG  57 -11.440   5.665   4.938
  504    HB3  ARG  57           3HB      ARG  57 -10.955   4.209   5.800
  505    HG2  ARG  57           2HG      ARG  57  -8.640   5.134   6.002
  506    HG3  ARG  57           3HG      ARG  57  -9.185   6.611   5.199
  507    HD2  ARG  57           2HD      ARG  57 -10.218   5.531   7.848
  508    HD3  ARG  57           3HD      ARG  57  -9.113   6.892   7.647
  509    HE   ARG  57           HE       ARG  57 -10.929   8.099   6.534
  510   HH11  ARG  57          1HH1      ARG  57 -11.891   5.332   8.487
  511   HH12  ARG  57          2HH1      ARG  57 -13.507   5.909   8.725
  512   HH21  ARG  57          1HH2      ARG  57 -13.052   8.829   6.843
  513   HH22  ARG  57          2HH2      ARG  57 -14.160   7.892   7.790
  514    H    ILE  58           H        ILE  58  -8.115   4.056   2.396
  515    HA   ILE  58           HA       ILE  58  -7.103   1.639   3.729
  516    HB   ILE  58           HB       ILE  58  -5.997   3.048   1.244
  517   HG12  ILE  58          2HG1      ILE  58  -7.890   0.651   1.303
  518   HG13  ILE  58          3HG1      ILE  58  -8.365   2.290   0.880
  519   HG21  ILE  58          1HG2      ILE  58  -4.848   0.910   0.784
  520   HG22  ILE  58          2HG2      ILE  58  -5.514   0.228   2.269
  521   HG23  ILE  58          3HG2      ILE  58  -4.369   1.569   2.352
  522   HD11  ILE  58          3HD1      ILE  58  -6.417   0.563  -0.654
  523   HD12  ILE  58          1HD1      ILE  58  -6.889   2.215  -1.070
  524   HD13  ILE  58          2HD1      ILE  58  -8.087   0.923  -1.093
  525    H    SER  59           H        SER  59  -5.091   1.643   4.716
  526    HA   SER  59           HA       SER  59  -3.484   4.079   4.927
  527    HB2  SER  59           2HB      SER  59  -4.493   2.538   7.379
  528    HB3  SER  59           3HB      SER  59  -3.415   3.935   7.399
  529    HG   SER  59           HG       SER  59  -5.435   4.830   6.115
  530    H    ILE  60           H        ILE  60  -1.726   3.176   3.964
  531    HA   ILE  60           HA       ILE  60  -0.799   0.490   4.766
  532    HB   ILE  60           HB       ILE  60   0.027   2.251   2.415
  533   HG12  ILE  60          2HG1      ILE  60  -1.653  -0.300   2.452
  534   HG13  ILE  60          3HG1      ILE  60  -2.280   1.327   2.207
  535   HG21  ILE  60          1HG2      ILE  60   0.876  -0.594   3.057
  536   HG22  ILE  60          2HG2      ILE  60   1.902   0.839   3.149
  537   HG23  ILE  60          3HG2      ILE  60   1.287   0.296   1.588
  538   HD11  ILE  60          3HD1      ILE  60  -2.122   0.169   0.111
  539   HD12  ILE  60          1HD1      ILE  60  -0.408  -0.159   0.367
  540   HD13  ILE  60          2HD1      ILE  60  -0.969   1.499   0.136
  541    H    ARG  61           H        ARG  61   0.484   0.638   6.539
  542    HA   ARG  61           HA       ARG  61   2.413   2.849   6.790
  543    HB2  ARG  61           2HB      ARG  61   0.900   2.171   8.757
  544    HB3  ARG  61           3HB      ARG  61   1.835   0.682   8.862
  545    HG2  ARG  61           2HG      ARG  61   3.892   2.006   9.260
  546    HG3  ARG  61           3HG      ARG  61   2.953   3.494   9.134
  547    HD2  ARG  61           2HD      ARG  61   3.203   3.149  11.452
  548    HD3  ARG  61           3HD      ARG  61   1.567   2.592  11.104
  549    HE   ARG  61           HE       ARG  61   2.318   0.333  11.309
  550   HH11  ARG  61          1HH1      ARG  61   4.725   2.714  12.284
  551   HH12  ARG  61          2HH1      ARG  61   5.648   1.579  13.217
  552   HH21  ARG  61          1HH2      ARG  61   3.551  -1.156  12.509
  553   HH22  ARG  61          2HH2      ARG  61   4.980  -0.630  13.341
  554    H    VAL  62           H        VAL  62   4.426   2.480   6.102
  555    HA   VAL  62           HA       VAL  62   5.340  -0.275   5.618
  556    HB   VAL  62           HB       VAL  62   5.515   1.641   3.845
  557   HG11  VAL  62          1HG1      VAL  62   7.972   2.397   5.458
  558   HG12  VAL  62          2HG1      VAL  62   6.508   3.378   5.311
  559   HG13  VAL  62          3HG1      VAL  62   7.501   3.057   3.886
  560   HG21  VAL  62          3HG2      VAL  62   6.573  -0.543   3.558
  561   HG22  VAL  62          1HG2      VAL  62   7.982   0.001   4.472
  562   HG23  VAL  62          2HG2      VAL  62   7.599   0.740   2.913
  563    H    LYS  63           H        LYS  63   7.091  -1.123   6.762
  564    HA   LYS  63           HA       LYS  63   7.779   0.199   9.251
  565    HB2  LYS  63           2HB      LYS  63   7.426  -2.300   9.085
  566    HB3  LYS  63           3HB      LYS  63   8.924  -2.400   8.164
  567    HG2  LYS  63           2HG      LYS  63  10.055  -1.257  10.199
  568    HG3  LYS  63           3HG      LYS  63   8.559  -1.605  11.073
  569    HD2  LYS  63           2HD      LYS  63  10.125  -3.370  11.547
  570    HD3  LYS  63           3HD      LYS  63   8.867  -4.036  10.499
  571    HE2  LYS  63           2HE      LYS  63  11.004  -4.841   9.715
  572    HE3  LYS  63           3HE      LYS  63  10.417  -3.672   8.534
  573    HZ1  LYS  63           3HZ      LYS  63  12.743  -3.340   8.983
  574    HZ2  LYS  63           1HZ      LYS  63  12.451  -3.187  10.639
  575    HZ3  LYS  63           2HZ      LYS  63  11.876  -2.013   9.572
  576    H    HIS  64           H        HIS  64   9.662   1.175   9.731
  577    HA   HIS  64           HA       HIS  64  11.501   1.839   7.563
  578    HB2  HIS  64           2HB      HIS  64  11.214   2.828  10.430
  579    HB3  HIS  64           3HB      HIS  64  12.451   3.412   9.316
  580    HD1  HIS  64           HD1      HIS  64   9.318   4.459  10.524
  581    HD2  HIS  64           HD2      HIS  64  10.946   4.238   6.702
  582    HE1  HIS  64           HE1      HIS  64   7.999   6.060   9.114
  583    HE2  HIS  64           HE2      HIS  64   9.118   6.049   6.876
  584    H    SER  65           H        SER  65  13.242   0.658   7.201
  585    HA   SER  65           HA       SER  65  13.887  -1.646   8.699
  586    HB2  SER  65           2HB      SER  65  15.806  -1.806   7.036
  587    HB3  SER  65           3HB      SER  65  14.205  -1.655   6.318
  588    HG   SER  65           HG       SER  65  16.317   0.175   6.367
  589    H    ASP  66           H        ASP  66  15.896   1.224   8.025
  590    HA   ASP  66           HA       ASP  66  17.146   1.156  10.669
  591    HB2  ASP  66           2HB      ASP  66  18.588  -0.365   9.351
  592    HB3  ASP  66           3HB      ASP  66  18.739   0.835   8.074
  593    H    ALA  67           H        ALA  67  17.905   3.219  11.246
  594    HA   ALA  67           HA       ALA  67  16.445   5.359  10.278
  595    HB1  ALA  67           3HB      ALA  67  17.371   5.249  12.536
  596    HB2  ALA  67           1HB      ALA  67  17.808   6.768  11.750
  597    HB3  ALA  67           2HB      ALA  67  19.000   5.471  11.898
  598    H    ALA  68           H        ALA  68  19.720   4.382   9.363
  599    HA   ALA  68           HA       ALA  68  20.398   6.734   7.886
  600    HB1  ALA  68           3HB      ALA  68  22.250   5.385   6.984
  601    HB2  ALA  68           1HB      ALA  68  21.512   3.920   7.646
  602    HB3  ALA  68           2HB      ALA  68  22.103   5.179   8.731
  603    H    GLU  69           H        GLU  69  18.931   3.624   7.014
  604    HA   GLU  69           HA       GLU  69  18.967   4.045   4.163
  605    HB2  GLU  69           2HB      GLU  69  17.361   2.029   5.801
  606    HB3  GLU  69           3HB      GLU  69  17.603   1.981   4.056
  607    HG2  GLU  69           2HG      GLU  69  20.047   1.651   4.439
  608    HG3  GLU  69           3HG      GLU  69  19.745   1.613   6.178
  609    H    GLU  70           H        GLU  70  16.536   4.396   6.730
  610    HA   GLU  70           HA       GLU  70  14.331   4.063   4.974
  611    HB2  GLU  70           2HB      GLU  70  12.937   4.454   6.986
  612    HB3  GLU  70           3HB      GLU  70  14.188   3.252   7.220
  613    HG2  GLU  70           2HG      GLU  70  14.137   4.439   9.224
  614    HG3  GLU  70           3HG      GLU  70  15.544   5.062   8.377
  615    H    LYS  71           H        LYS  71  16.008   6.927   5.956
  616    HA   LYS  71           HA       LYS  71  14.016   8.861   5.365
  617    HB2  LYS  71           2HB      LYS  71  17.040   9.116   5.014
  618    HB3  LYS  71           3HB      LYS  71  15.893  10.449   5.164
  619    HG2  LYS  71           2HG      LYS  71  15.368   9.731   7.470
  620    HG3  LYS  71           3HG      LYS  71  16.518   8.399   7.311
  621    HD2  LYS  71           2HD      LYS  71  18.357  10.053   7.008
  622    HD3  LYS  71           3HD      LYS  71  17.192  11.368   7.216
  623    HE2  LYS  71           2HE      LYS  71  17.916   9.261   9.282
  624    HE3  LYS  71           3HE      LYS  71  18.385  10.961   9.315
  625    HZ1  LYS  71           3HZ      LYS  71  15.611   9.910   9.510
  626    HZ2  LYS  71           1HZ      LYS  71  16.030  11.547   9.504
  627    HZ3  LYS  71           2HZ      LYS  71  16.520  10.552  10.778
  628    H    LYS  72           H        LYS  72  16.457   7.222   3.408
  629    HA   LYS  72           HA       LYS  72  15.796   8.537   0.926
  630    HB2  LYS  72           2HB      LYS  72  18.113   7.792   1.445
  631    HB3  LYS  72           3HB      LYS  72  17.570   6.122   1.510
  632    HG2  LYS  72           2HG      LYS  72  18.702   6.543  -0.596
  633    HG3  LYS  72           3HG      LYS  72  16.991   6.221  -0.897
  634    HD2  LYS  72           2HD      LYS  72  16.585   8.667  -1.109
  635    HD3  LYS  72           3HD      LYS  72  18.305   8.970  -0.833
  636    HE2  LYS  72           2HE      LYS  72  17.132   7.403  -3.157
  637    HE3  LYS  72           3HE      LYS  72  17.733   9.059  -3.231
  638    HZ1  LYS  72           3HZ      LYS  72  19.332   7.388  -4.039
  639    HZ2  LYS  72           1HZ      LYS  72  19.401   6.710  -2.496
  640    HZ3  LYS  72           2HZ      LYS  72  19.938   8.292  -2.749
  641    H    GLU  73           H        GLU  73  15.116   5.420   2.486
  642    HA   GLU  73           HA       GLU  73  14.115   4.154   0.119
  643    HB2  GLU  73           2HB      GLU  73  13.987   3.285   3.031
  644    HB3  GLU  73           3HB      GLU  73  13.461   2.289   1.676
  645    HG2  GLU  73           2HG      GLU  73  16.278   3.239   2.267
  646    HG3  GLU  73           3HG      GLU  73  15.668   1.589   2.352
  647    H    ALA  74           H        ALA  74  12.564   5.844   2.849
  648    HA   ALA  74           HA       ALA  74   9.884   5.082   2.134
  649    HB1  ALA  74           3HB      ALA  74  10.827   7.395   3.863
  650    HB2  ALA  74           1HB      ALA  74  10.446   5.766   4.429
  651    HB3  ALA  74           2HB      ALA  74   9.173   6.785   3.755
  652    H    LYS  75           H        LYS  75  11.987   7.846   1.423
  653    HA   LYS  75           HA       LYS  75  10.148   9.411  -0.061
  654    HB2  LYS  75           2HB      LYS  75  12.323  10.282   0.793
  655    HB3  LYS  75           3HB      LYS  75  13.184   9.274  -0.368
  656    HG2  LYS  75           2HG      LYS  75  12.191  10.536  -2.233
  657    HG3  LYS  75           3HG      LYS  75  11.242  11.500  -1.096
  658    HD2  LYS  75           2HD      LYS  75  13.309  12.451  -0.150
  659    HD3  LYS  75           3HD      LYS  75  14.282  11.454  -1.239
  660    HE2  LYS  75           2HE      LYS  75  14.093  13.765  -2.079
  661    HE3  LYS  75           3HE      LYS  75  13.318  12.629  -3.184
  662    HZ1  LYS  75           3HZ      LYS  75  11.168  13.247  -2.268
  663    HZ2  LYS  75           1HZ      LYS  75  11.973  14.625  -2.826
  664    HZ3  LYS  75           2HZ      LYS  75  11.897  14.301  -1.172
  665    H    LYS  76           H        LYS  76  12.388   6.842  -0.999
  666    HA   LYS  76           HA       LYS  76  11.847   6.787  -3.787
  667    HB2  LYS  76           2HB      LYS  76  13.879   5.811  -2.843
  668    HB3  LYS  76           3HB      LYS  76  12.953   4.678  -1.880
  669    HG2  LYS  76           2HG      LYS  76  12.727   4.555  -4.887
  670    HG3  LYS  76           3HG      LYS  76  14.188   3.933  -4.127
  671    HD2  LYS  76           2HD      LYS  76  11.360   2.988  -3.506
  672    HD3  LYS  76           3HD      LYS  76  12.485   2.174  -4.593
  673    HE2  LYS  76           2HE      LYS  76  12.990   2.633  -1.628
  674    HE3  LYS  76           3HE      LYS  76  12.382   1.134  -2.331
  675    HZ1  LYS  76           3HZ      LYS  76  14.762   1.024  -1.951
  676    HZ2  LYS  76           1HZ      LYS  76  15.014   2.373  -2.942
  677    HZ3  LYS  76           2HZ      LYS  76  14.426   0.936  -3.606
  678    H    PHE  77           H        PHE  77  10.375   5.234  -0.962
  679    HA   PHE  77           HA       PHE  77   8.761   3.352  -2.409
  680    HB2  PHE  77           2HB      PHE  77   9.611   3.012  -0.054
  681    HB3  PHE  77           3HB      PHE  77   8.503   4.258   0.496
  682    HD1  PHE  77           HD1      PHE  77   8.558   0.946  -1.280
  683    HD2  PHE  77           HD2      PHE  77   6.329   3.607   1.228
  684    HE1  PHE  77           HE1      PHE  77   6.830  -0.770  -0.967
  685    HE2  PHE  77           HE2      PHE  77   4.608   1.871   1.522
  686    HZ   PHE  77           HZ       PHE  77   4.859  -0.319   0.428
  687    H    ALA  78           H        ALA  78   8.401   6.645  -1.351
  688    HA   ALA  78           HA       ALA  78   5.603   6.955  -1.537
  689    HB1  ALA  78           3HB      ALA  78   6.084   9.359  -1.817
  690    HB2  ALA  78           1HB      ALA  78   7.789   8.991  -2.108
  691    HB3  ALA  78           2HB      ALA  78   7.067   8.656  -0.532
  692    H    ALA  79           H        ALA  79   8.208   7.323  -3.948
  693    HA   ALA  79           HA       ALA  79   6.594   7.946  -6.187
  694    HB1  ALA  79           3HB      ALA  79   9.000   8.428  -6.098
  695    HB2  ALA  79           1HB      ALA  79   8.609   7.445  -7.510
  696    HB3  ALA  79           2HB      ALA  79   9.362   6.701  -6.094
  697    H    ILE  80           H        ILE  80   7.855   4.871  -4.904
  698    HA   ILE  80           HA       ILE  80   7.065   3.055  -6.875
  699    HB   ILE  80           HB       ILE  80   7.280   2.719  -3.850
  700   HG12  ILE  80          2HG1      ILE  80   9.399   3.315  -4.983
  701   HG13  ILE  80          3HG1      ILE  80   9.472   1.705  -4.290
  702   HG21  ILE  80          1HG2      ILE  80   7.404   0.280  -4.160
  703   HG22  ILE  80          2HG2      ILE  80   7.036   0.475  -5.873
  704   HG23  ILE  80          3HG2      ILE  80   5.839   0.920  -4.660
  705   HD11  ILE  80          3HD1      ILE  80  10.570   1.801  -6.437
  706   HD12  ILE  80          1HD1      ILE  80   9.090   2.363  -7.210
  707   HD13  ILE  80          2HD1      ILE  80   9.168   0.738  -6.522
  708    H    LEU  81           H        LEU  81   5.260   4.234  -4.031
  709    HA   LEU  81           HA       LEU  81   2.893   2.720  -4.428
  710    HB2  LEU  81           2HB      LEU  81   3.578   5.170  -2.789
  711    HB3  LEU  81           3HB      LEU  81   1.928   4.574  -2.844
  712    HG   LEU  81           HG       LEU  81   4.317   2.963  -1.856
  713   HD11  LEU  81          1HD1      LEU  81   2.115   4.320  -0.279
  714   HD12  LEU  81          2HD1      LEU  81   3.808   4.815  -0.349
  715   HD13  LEU  81          3HD1      LEU  81   3.375   3.273   0.382
  716   HD21  LEU  81          3HD2      LEU  81   2.660   1.349  -1.049
  717   HD22  LEU  81          1HD2      LEU  81   2.549   1.535  -2.798
  718   HD23  LEU  81          2HD2      LEU  81   1.353   2.306  -1.753
  719    H    ASN  82           H        ASN  82   3.872   5.979  -5.434
  720    HA   ASN  82           HA       ASN  82   1.371   6.965  -6.309
  721    HB2  ASN  82           2HB      ASN  82   4.222   7.687  -7.082
  722    HB3  ASN  82           3HB      ASN  82   2.839   8.524  -7.786
  723   HD21  ASN  82          1HD2      ASN  82   5.006   9.476  -5.992
  724   HD22  ASN  82          2HD2      ASN  82   4.194  10.202  -4.651
  725    H    LYS  83           H        LYS  83   3.798   5.002  -7.953
  726    HA   LYS  83           HA       LYS  83   2.608   4.935 -10.525
  727    HB2  LYS  83           2HB      LYS  83   4.280   2.742  -9.219
  728    HB3  LYS  83           3HB      LYS  83   4.008   2.964 -10.945
  729    HG2  LYS  83           2HG      LYS  83   5.608   4.759  -9.102
  730    HG3  LYS  83           3HG      LYS  83   6.240   3.705 -10.367
  731    HD2  LYS  83           2HD      LYS  83   5.160   5.099 -12.091
  732    HD3  LYS  83           3HD      LYS  83   4.450   6.128 -10.842
  733    HE2  LYS  83           2HE      LYS  83   6.437   7.193 -11.823
  734    HE3  LYS  83           3HE      LYS  83   6.716   6.815 -10.122
  735    HZ1  LYS  83           3HZ      LYS  83   8.607   6.259 -11.560
  736    HZ2  LYS  83           1HZ      LYS  83   7.651   5.147 -12.399
  737    HZ3  LYS  83           2HZ      LYS  83   7.998   4.899 -10.765
  738    H    VAL  84           H        VAL  84   2.255   2.832  -7.669
  739    HA   VAL  84           HA       VAL  84   0.805   0.744  -8.939
  740    HB   VAL  84           HB       VAL  84   1.171   1.460  -5.994
  741   HG11  VAL  84          1HG1      VAL  84   0.445  -0.853  -5.454
  742   HG12  VAL  84          2HG1      VAL  84   0.000  -1.099  -7.143
  743   HG13  VAL  84          3HG1      VAL  84  -0.857   0.098  -6.172
  744   HG21  VAL  84          3HG2      VAL  84   3.254   0.886  -7.178
  745   HG22  VAL  84          1HG2      VAL  84   2.541  -0.633  -7.726
  746   HG23  VAL  84          2HG2      VAL  84   2.841  -0.366  -6.006
  747    H    PHE  85           H        PHE  85  -0.223   3.369  -6.759
  748    HA   PHE  85           HA       PHE  85  -2.990   2.802  -6.764
  749    HB2  PHE  85           2HB      PHE  85  -1.600   5.466  -6.250
  750    HB3  PHE  85           3HB      PHE  85  -3.290   5.124  -5.882
  751    HD1  PHE  85           HD1      PHE  85  -3.240   2.464  -4.663
  752    HD2  PHE  85           HD2      PHE  85  -0.486   5.707  -4.181
  753    HE1  PHE  85           HE1      PHE  85  -2.601   1.604  -2.449
  754    HE2  PHE  85           HE2      PHE  85   0.144   4.830  -1.974
  755    HZ   PHE  85           HZ       PHE  85  -0.907   2.784  -1.110
  756    H    ALA  86           H        ALA  86  -0.994   4.739  -8.944
  757    HA   ALA  86           HA       ALA  86  -3.079   5.906 -10.490
  758    HB1  ALA  86           3HB      ALA  86  -0.787   6.782 -10.514
  759    HB2  ALA  86           1HB      ALA  86  -1.318   6.373 -12.147
  760    HB3  ALA  86           2HB      ALA  86  -0.212   5.300 -11.280
  761    H    GLU  87           H        GLU  87  -1.505   2.777 -10.537
  762    HA   GLU  87           HA       GLU  87  -2.584   1.947 -13.118
  763    HB2  GLU  87           2HB      GLU  87  -0.915   0.498 -11.016
  764    HB3  GLU  87           3HB      GLU  87  -1.441  -0.251 -12.524
  765    HG2  GLU  87           2HG      GLU  87  -0.148   1.343 -13.831
  766    HG3  GLU  87           3HG      GLU  87   0.279   2.246 -12.380
  767    H    LEU  88           H        LEU  88  -3.793   2.066  -9.947
  768    HA   LEU  88           HA       LEU  88  -5.532  -0.314 -10.306
  769    HB2  LEU  88           2HB      LEU  88  -4.655   1.070  -7.747
  770    HB3  LEU  88           3HB      LEU  88  -5.868  -0.199  -7.808
  771    HG   LEU  88           HG       LEU  88  -2.929  -0.526  -8.547
  772   HD11  LEU  88          1HD1      LEU  88  -2.760  -1.888  -6.521
  773   HD12  LEU  88          2HD1      LEU  88  -4.449  -1.549  -6.132
  774   HD13  LEU  88          3HD1      LEU  88  -3.263  -0.241  -6.143
  775   HD21  LEU  88          3HD2      LEU  88  -3.400  -2.936  -8.709
  776   HD22  LEU  88          1HD2      LEU  88  -4.324  -2.022  -9.899
  777   HD23  LEU  88          2HD2      LEU  88  -5.119  -2.632  -8.446
  778    H    GLY  89           H        GLY  89  -5.509   3.130 -10.142
  779    HA2  GLY  89           2HA      GLY  89  -7.319   4.414 -10.946
  780    HA3  GLY  89           3HA      GLY  89  -8.445   3.166 -10.444
  781    H    TYR  90           H        TYR  90  -5.889   4.936  -8.709
  782    HA   TYR  90           HA       TYR  90  -7.904   6.197  -6.937
  783    HB2  TYR  90           2HB      TYR  90  -5.111   5.302  -6.059
  784    HB3  TYR  90           3HB      TYR  90  -6.361   6.002  -5.037
  785    HD1  TYR  90           HD2      TYR  90  -8.718   4.586  -5.188
  786    HD2  TYR  90           HD1      TYR  90  -4.800   2.990  -5.826
  787    HE1  TYR  90           HE2      TYR  90  -9.545   2.324  -4.684
  788    HE2  TYR  90           HE1      TYR  90  -5.631   0.737  -5.319
  789    HH   TYR  90           HH       TYR  90  -7.503  -0.308  -4.106
  790    H    ASN  91           H        ASN  91  -7.616   8.376  -6.667
  791    HA   ASN  91           HA       ASN  91  -5.959   9.729  -8.607
  792    HB2  ASN  91           2HB      ASN  91  -7.833  10.868  -6.486
  793    HB3  ASN  91           3HB      ASN  91  -7.150  11.759  -7.844
  794   HD21  ASN  91          1HD2      ASN  91  -7.975  11.382  -9.931
  795   HD22  ASN  91          2HD2      ASN  91  -9.450  10.526 -10.192
  796    H    ASP  92           H        ASP  92  -4.588  11.610  -8.065
  797    HA   ASP  92           HA       ASP  92  -2.489  10.899  -6.348
  798    HB2  ASP  92           2HB      ASP  92  -3.089  13.630  -7.569
  799    HB3  ASP  92           3HB      ASP  92  -1.535  13.116  -6.928
  800    H    SER  93           H        SER  93  -4.950  13.461  -5.992
  801    HA   SER  93           HA       SER  93  -4.236  14.550  -3.530
  802    HB2  SER  93           2HB      SER  93  -6.637  15.288  -3.406
  803    HB3  SER  93           3HB      SER  93  -5.894  15.599  -4.976
  804    HG   SER  93           HG       SER  93  -7.670  13.481  -4.294
  805    H    ASN  94           H        ASN  94  -6.070  11.647  -4.252
  806    HA   ASN  94           HA       ASN  94  -7.201  11.149  -1.696
  807    HB2  ASN  94           2HB      ASN  94  -6.552   9.233  -3.979
  808    HB3  ASN  94           3HB      ASN  94  -7.532   8.817  -2.575
  809   HD21  ASN  94          1HD2      ASN  94  -9.318   8.336  -3.892
  810   HD22  ASN  94          2HD2      ASN  94 -10.241   9.560  -4.689
  811    H    VAL  95           H        VAL  95  -4.046  10.616  -3.039
  812    HA   VAL  95           HA       VAL  95  -3.126   8.818  -0.905
  813    HB   VAL  95           HB       VAL  95  -1.589  10.027  -3.264
  814   HG11  VAL  95          1HG1      VAL  95  -0.102   9.253  -1.460
  815   HG12  VAL  95          2HG1      VAL  95   0.059   8.238  -2.893
  816   HG13  VAL  95          3HG1      VAL  95  -0.861   7.657  -1.503
  817   HG21  VAL  95          3HG2      VAL  95  -3.447   8.669  -4.110
  818   HG22  VAL  95          1HG2      VAL  95  -2.939   7.306  -3.106
  819   HG23  VAL  95          2HG2      VAL  95  -1.907   7.865  -4.426
  820    H    THR  96           H        THR  96  -2.565   9.845   0.999
  821    HA   THR  96           HA       THR  96  -0.796  12.211   0.908
  822    HB   THR  96           HB       THR  96  -3.273  12.064   2.696
  823    HG1  THR  96           HG1      THR  96  -2.838  13.191   0.176
  824   HG21  THR  96          3HG2      THR  96  -2.734  14.406   3.278
  825   HG22  THR  96          1HG2      THR  96  -1.277  14.326   2.294
  826   HG23  THR  96          2HG2      THR  96  -1.417  13.324   3.743
  827    H    TRP  97           H        TRP  97   0.883  11.979   2.305
  828    HA   TRP  97           HA       TRP  97   0.990   9.720   4.155
  829    HB2  TRP  97           2HB      TRP  97   3.071  11.787   3.330
  830    HB3  TRP  97           3HB      TRP  97   3.384  10.503   4.495
  831    HD1  TRP  97           HD1      TRP  97   2.460  10.895   0.733
  832    HE1  TRP  97           HE1      TRP  97   3.416   8.870  -0.534
  833    HE3  TRP  97           HE3      TRP  97   4.254   8.196   4.710
  834    HZ2  TRP  97           HZ2      TRP  97   4.751   6.456   0.060
  835    HZ3  TRP  97           HZ3      TRP  97   5.358   6.035   4.269
  836    HH2  TRP  97           HH2      TRP  97   5.601   5.181   1.987
  837    H    ASP  98           H        ASP  98   1.009   9.864   6.338
  838    HA   ASP  98           HA       ASP  98   1.467  12.174   7.916
  839    HB2  ASP  98           2HB      ASP  98  -0.794  12.821   7.147
  840    HB3  ASP  98           3HB      ASP  98  -1.437  11.260   7.642
  841    H    GLY  99           H        GLY  99   2.343  11.377   9.711
  842    HA2  GLY  99           2HA      GLY  99   2.746  10.137  11.582
  843    HA3  GLY  99           3HA      GLY  99   1.169   9.388  11.371
  844    H    ASP 100           H        ASP 100   4.206   9.423   9.532
  845    HA   ASP 100           HA       ASP 100   5.307   7.917   8.291
  846    HB2  ASP 100           2HB      ASP 100   6.467   6.201   9.508
  847    HB3  ASP 100           3HB      ASP 100   6.308   7.609  10.533
  848    H    THR 101           H        THR 101   2.491   7.738   7.991
  849    HA   THR 101           HA       THR 101   2.142   5.027   6.867
  850    HB   THR 101           HB       THR 101   0.034   6.594   8.445
  851    HG1  THR 101           HG1      THR 101   1.885   5.423   9.584
  852   HG21  THR 101          3HG2      THR 101  -0.113   3.778   7.300
  853   HG22  THR 101          1HG2      THR 101  -0.987   5.186   6.678
  854   HG23  THR 101          2HG2      THR 101  -1.349   4.556   8.286
  855    H    VAL 102           H        VAL 102   0.931   5.098   4.873
  856    HA   VAL 102           HA       VAL 102   0.237   7.803   3.889
  857    HB   VAL 102           HB       VAL 102   1.811   6.562   2.422
  858   HG11  VAL 102          1HG1      VAL 102   1.140   4.251   2.792
  859   HG12  VAL 102          2HG1      VAL 102   1.058   4.635   1.073
  860   HG13  VAL 102          3HG1      VAL 102  -0.422   4.551   2.026
  861   HG21  VAL 102          3HG2      VAL 102   0.617   6.963   0.295
  862   HG22  VAL 102          1HG2      VAL 102   0.334   8.260   1.461
  863   HG23  VAL 102          2HG2      VAL 102  -0.913   7.044   1.174
  864    H    THR 103           H        THR 103  -1.836   8.322   3.887
  865    HA   THR 103           HA       THR 103  -3.938   6.312   4.275
  866    HB   THR 103           HB       THR 103  -4.102   9.356   4.529
  867    HG1  THR 103           HG1      THR 103  -2.717   7.891   6.070
  868   HG21  THR 103          3HG2      THR 103  -6.168   8.930   5.801
  869   HG22  THR 103          1HG2      THR 103  -5.976   7.193   5.584
  870   HG23  THR 103          2HG2      THR 103  -6.305   8.226   4.187
  871    H    VAL 104           H        VAL 104  -4.764   5.644   2.378
  872    HA   VAL 104           HA       VAL 104  -5.120   7.540   0.125
  873    HB   VAL 104           HB       VAL 104  -4.648   4.525  -0.064
  874   HG11  VAL 104          1HG1      VAL 104  -6.040   5.373  -1.914
  875   HG12  VAL 104          2HG1      VAL 104  -4.443   4.908  -2.503
  876   HG13  VAL 104          3HG1      VAL 104  -4.835   6.614  -2.273
  877   HG21  VAL 104          3HG2      VAL 104  -2.437   5.091  -0.997
  878   HG22  VAL 104          1HG2      VAL 104  -2.601   5.662   0.663
  879   HG23  VAL 104          2HG2      VAL 104  -2.732   6.799  -0.682
  880    H    GLU 105           H        GLU 105  -7.220   7.880  -0.319
  881    HA   GLU 105           HA       GLU 105  -9.220   5.822   0.435
  882    HB2  GLU 105           2HB      GLU 105 -10.899   7.654   0.325
  883    HB3  GLU 105           3HB      GLU 105  -9.654   7.947   1.532
  884    HG2  GLU 105           2HG      GLU 105  -8.522   9.507  -0.041
  885    HG3  GLU 105           3HG      GLU 105  -9.816   9.243  -1.209
  886    H    GLY 106           H        GLY 106 -10.818   5.245  -1.083
  887    HA2  GLY 106           2HA      GLY 106 -10.663   6.343  -3.815
  888    HA3  GLY 106           3HA      GLY 106 -10.440   4.605  -3.603
  889    H    GLN 107           H        GLN 107 -12.650   6.479  -4.760
  890    HA   GLN 107           HA       GLN 107 -15.012   5.983  -3.241
  891    HB2  GLN 107           2HB      GLN 107 -14.746   7.821  -4.947
  892    HB3  GLN 107           3HB      GLN 107 -14.719   6.610  -6.222
  893    HG2  GLN 107           2HG      GLN 107 -16.912   7.612  -6.152
  894    HG3  GLN 107           3HG      GLN 107 -17.044   5.947  -5.584
  895   HE21  GLN 107          1HE2      GLN 107 -18.953   6.331  -4.444
  896   HE22  GLN 107          2HE2      GLN 107 -19.009   7.277  -2.999
  897    H    LEU 108           H        LEU 108 -15.543   3.890  -2.827
  898    HA   LEU 108           HA       LEU 108 -14.629   1.655  -4.335
  899    HB2  LEU 108           2HB      LEU 108 -15.074   1.844  -1.813
  900    HB3  LEU 108           3HB      LEU 108 -16.772   1.668  -2.170
  901    HG   LEU 108           HG       LEU 108 -15.630  -0.386  -1.281
  902   HD11  LEU 108          1HD1      LEU 108 -17.743  -0.557  -2.536
  903   HD12  LEU 108          2HD1      LEU 108 -16.731  -1.983  -2.671
  904   HD13  LEU 108          3HD1      LEU 108 -16.824  -0.848  -4.016
  905   HD21  LEU 108          3HD2      LEU 108 -13.473  -0.118  -2.392
  906   HD22  LEU 108          1HD2      LEU 108 -14.219  -0.446  -3.959
  907   HD23  LEU 108          2HD2      LEU 108 -14.170  -1.703  -2.719
  908    H    GLU 109           H        GLU 109 -15.844   0.119  -5.531
  909    HA   GLU 109           HA       GLU 109 -17.327  -0.673  -7.036
  910    HB2  GLU 109           2HB      GLU 109 -19.133  -0.371  -5.419
  911    HB3  GLU 109           3HB      GLU 109 -19.243   1.339  -5.800
  912    HG2  GLU 109           2HG      GLU 109 -19.974   0.679  -8.134
  913    HG3  GLU 109           3HG      GLU 109 -20.050  -0.988  -7.563
  914    H    GLY 110           H        GLY 110 -18.301   2.773  -7.033
  915    HA2  GLY 110           2HA      GLY 110 -17.638   3.095  -9.847
  916    HA3  GLY 110           3HA      GLY 110 -18.291   4.317  -8.763
  917    H    VAL 111           H        VAL 111 -15.330   2.420  -9.303
  918    HA   VAL 111           HA       VAL 111 -13.674   4.222  -7.796
  919    HB   VAL 111           HB       VAL 111 -11.761   2.711  -8.549
  920   HG11  VAL 111          1HG1      VAL 111 -12.430   0.803  -7.115
  921   HG12  VAL 111          2HG1      VAL 111 -14.109   1.351  -7.172
  922   HG13  VAL 111          3HG1      VAL 111 -12.881   2.353  -6.397
  923   HG21  VAL 111          3HG2      VAL 111 -12.310   0.524  -9.580
  924   HG22  VAL 111          1HG2      VAL 111 -12.695   1.861 -10.667
  925   HG23  VAL 111          2HG2      VAL 111 -13.987   1.039  -9.789
  926    H    ASP 112           H        ASP 112 -14.261   6.112  -9.049
  927    HA   ASP 112           HA       ASP 112 -12.114   7.035 -10.643
  928    HB2  ASP 112           2HB      ASP 112 -13.341   5.839 -12.483
  929    HB3  ASP 112           3HB      ASP 112 -14.783   6.784 -12.134
  930    H    LEU 113           H        LEU 113 -12.081   9.274 -10.621
  931    HA   LEU 113           HA       LEU 113 -14.481  10.737  -9.665
  932    HB2  LEU 113           2HB      LEU 113 -11.571  11.289  -8.930
  933    HB3  LEU 113           3HB      LEU 113 -12.927  12.319  -8.494
  934    HG   LEU 113           HG       LEU 113 -12.486   9.468  -7.516
  935   HD11  LEU 113          1HD1      LEU 113 -12.224  12.079  -5.997
  936   HD12  LEU 113          2HD1      LEU 113 -10.896  11.042  -6.526
  937   HD13  LEU 113          3HD1      LEU 113 -12.045  10.452  -5.329
  938   HD21  LEU 113          3HD2      LEU 113 -14.881   9.961  -7.701
  939   HD22  LEU 113          1HD2      LEU 113 -14.674  11.429  -6.739
  940   HD23  LEU 113          2HD2      LEU 113 -14.391   9.842  -6.015
  941    H    GLU 114           H        GLU 114 -11.694  10.577 -11.775
  942    HA   GLU 114           HA       GLU 114 -11.986  13.286 -12.817
  943    HB2  GLU 114           2HB      GLU 114 -10.017  11.047 -13.421
  944    HB3  GLU 114           3HB      GLU 114 -10.002  12.592 -14.265
  945    HG2  GLU 114           2HG      GLU 114  -9.613  13.754 -12.114
  946    HG3  GLU 114           3HG      GLU 114  -9.595  12.198 -11.286
  947    H    HIS 115           H        HIS 115 -14.078  13.083 -13.736
  948    HA   HIS 115           HA       HIS 115 -14.271  11.575 -16.268
  949    HB2  HIS 115           2HB      HIS 115 -16.716  12.274 -16.177
  950    HB3  HIS 115           3HB      HIS 115 -16.192  11.204 -14.884
  951    HD1  HIS 115           HD1      HIS 115 -16.997  14.875 -15.477
  952    HD2  HIS 115           HD2      HIS 115 -16.736  12.159 -12.348
  953    HE1  HIS 115           HE1      HIS 115 -17.864  16.083 -13.459
  954    HE2  HIS 115           HE2      HIS 115 -17.876  14.353 -11.640
  955    H    HIS 116           H        HIS 116 -12.577  13.037 -17.097
  956    HA   HIS 116           HA       HIS 116 -13.060  15.867 -17.356
  957    HB2  HIS 116           2HB      HIS 116 -10.925  14.115 -18.645
  958    HB3  HIS 116           3HB      HIS 116 -10.969  15.871 -18.753
  959    HD1  HIS 116           HD1      HIS 116 -10.679  17.168 -16.405
  960    HD2  HIS 116           HD2      HIS 116  -9.625  13.150 -16.444
  961    HE1  HIS 116           HE1      HIS 116  -9.218  16.826 -14.389
  962    HE2  HIS 116           HE2      HIS 116  -8.472  14.436 -14.537
  963    H    HIS 117           H        HIS 117 -14.127  16.901 -18.897
  964    HA   HIS 117           HA       HIS 117 -14.308  15.771 -21.634
  965    HB2  HIS 117           2HB      HIS 117 -16.323  17.436 -20.085
  966    HB3  HIS 117           3HB      HIS 117 -16.356  17.363 -21.841
  967    HD1  HIS 117           HD1      HIS 117 -17.571  15.423 -22.876
  968    HD2  HIS 117           HD2      HIS 117 -16.841  14.818 -18.821
  969    HE1  HIS 117           HE1      HIS 117 -18.841  13.353 -22.258
  970    HE2  HIS 117           HE2      HIS 117 -18.507  13.094 -19.785
  971    H    HIS 118           H        HIS 118 -12.450  16.677 -22.395
  972    HA   HIS 118           HA       HIS 118 -12.057  19.602 -22.171
  973    HB2  HIS 118           2HB      HIS 118  -9.672  19.194 -22.526
  974    HB3  HIS 118           3HB      HIS 118 -10.238  18.175 -21.212
  975    HD1  HIS 118           HD1      HIS 118  -8.646  18.041 -24.557
  976    HD2  HIS 118           HD2      HIS 118 -10.317  15.359 -21.853
  977    HE1  HIS 118           HE1      HIS 118  -7.906  15.764 -25.308
  978    HE2  HIS 118           HE2      HIS 118  -9.027  14.164 -23.738
  979    H    HIS 119           H        HIS 119 -12.475  20.753 -23.962
  980    HA   HIS 119           HA       HIS 119 -12.893  19.494 -26.531
  981    HB2  HIS 119           2HB      HIS 119 -13.396  21.830 -27.327
  982    HB3  HIS 119           3HB      HIS 119 -14.384  21.308 -25.974
  983    HD1  HIS 119           HD1      HIS 119 -14.044  22.518 -23.707
  984    HD2  HIS 119           HD2      HIS 119 -11.748  24.071 -26.806
  985    HE1  HIS 119           HE1      HIS 119 -13.213  24.742 -22.894
  986    HE2  HIS 119           HE2      HIS 119 -11.746  25.609 -24.737
  987    H    HIS 120           H        HIS 120 -11.364  19.111 -27.994
  988    HA   HIS 120           HA       HIS 120  -9.367  18.881 -29.021
  989    HB2  HIS 120           2HB      HIS 120  -9.813  21.115 -29.919
  990    HB3  HIS 120           3HB      HIS 120  -9.193  21.877 -28.460
  991    HD1  HIS 120           HD1      HIS 120  -6.663  22.157 -28.251
  992    HD2  HIS 120           HD2      HIS 120  -7.786  20.135 -31.701
  993    HE1  HIS 120           HE1      HIS 120  -4.609  22.093 -29.699
  994    HE2  HIS 120           HE2      HIS 120  -5.274  20.721 -31.693
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1  18.790  -2.588  -0.962
    2    H2   MET   1           2H       MET   1  17.740  -2.266  -2.243
    3    H3   MET   1           3H       MET   1  18.582  -1.001  -1.506
    4    HA   MET   1           HA       MET   1  19.540  -1.589  -3.646
    5    HB2  MET   1           2HB      MET   1  21.305  -2.320  -1.269
    6    HB3  MET   1           3HB      MET   1  21.902  -1.897  -2.867
    7    HG2  MET   1           2HG      MET   1  21.031   0.371  -2.613
    8    HG3  MET   1           3HG      MET   1  20.353  -0.048  -1.037
    9    HE1  MET   1           3HE      MET   1  23.683  -0.774   1.013
   10    HE2  MET   1           1HE      MET   1  22.727  -1.952   0.115
   11    HE3  MET   1           2HE      MET   1  21.923  -0.734   1.108
   12    H    SER   2           H        SER   2  20.543  -4.132  -1.362
   13    HA   SER   2           HA       SER   2  20.221  -6.234  -3.389
   14    HB2  SER   2           2HB      SER   2  22.305  -6.128  -1.998
   15    HB3  SER   2           3HB      SER   2  21.336  -6.342  -0.543
   16    HG   SER   2           HG       SER   2  21.820  -8.364  -0.930
   17    H    GLY   3           H        GLY   3  19.409  -8.404  -1.828
   18    HA2  GLY   3           2HA      GLY   3  16.621  -8.237  -1.782
   19    HA3  GLY   3           3HA      GLY   3  17.571  -9.481  -0.988
   20    H    LYS   4           H        LYS   4  15.332  -7.126  -0.459
   21    HA   LYS   4           HA       LYS   4  16.016  -6.751   2.385
   22    HB2  LYS   4           2HB      LYS   4  16.796  -4.798   0.892
   23    HB3  LYS   4           3HB      LYS   4  15.101  -4.478   0.568
   24    HG2  LYS   4           2HG      LYS   4  15.431  -2.982   2.273
   25    HG3  LYS   4           3HG      LYS   4  14.952  -4.375   3.233
   26    HD2  LYS   4           2HD      LYS   4  17.844  -3.563   2.705
   27    HD3  LYS   4           3HD      LYS   4  16.928  -3.082   4.126
   28    HE2  LYS   4           2HE      LYS   4  18.139  -4.887   4.950
   29    HE3  LYS   4           3HE      LYS   4  16.643  -5.686   4.481
   30    HZ1  LYS   4           3HZ      LYS   4  18.460  -6.988   3.727
   31    HZ2  LYS   4           1HZ      LYS   4  19.213  -5.658   3.006
   32    HZ3  LYS   4           2HZ      LYS   4  17.787  -6.275   2.356
   33    H    LYS   5           H        LYS   5  14.288  -6.866   3.733
   34    HA   LYS   5           HA       LYS   5  11.627  -7.401   2.579
   35    HB2  LYS   5           2HB      LYS   5  12.643  -9.133   4.057
   36    HB3  LYS   5           3HB      LYS   5  12.710  -7.965   5.371
   37    HG2  LYS   5           2HG      LYS   5  10.132  -7.786   5.114
   38    HG3  LYS   5           3HG      LYS   5  10.253  -9.232   4.110
   39    HD2  LYS   5           2HD      LYS   5   9.686  -9.883   6.394
   40    HD3  LYS   5           3HD      LYS   5  11.322 -10.437   6.025
   41    HE2  LYS   5           2HE      LYS   5  12.255  -8.501   7.255
   42    HE3  LYS   5           3HE      LYS   5  10.620  -7.933   7.602
   43    HZ1  LYS   5           3HZ      LYS   5  11.771 -10.511   8.533
   44    HZ2  LYS   5           1HZ      LYS   5  10.224  -9.933   8.879
   45    HZ3  LYS   5           2HZ      LYS   5  11.580  -9.118   9.476
   46    H    VAL   6           H        VAL   6  10.358  -5.638   2.522
   47    HA   VAL   6           HA       VAL   6  10.105  -3.893   4.907
   48    HB   VAL   6           HB       VAL   6  10.186  -2.632   2.808
   49   HG11  VAL   6          1HG1      VAL   6   9.505  -4.381   1.230
   50   HG12  VAL   6          2HG1      VAL   6   8.544  -2.922   0.991
   51   HG13  VAL   6          3HG1      VAL   6   7.846  -4.307   1.832
   52   HG21  VAL   6          3HG2      VAL   6   8.060  -1.375   2.934
   53   HG22  VAL   6          1HG2      VAL   6   8.664  -1.765   4.548
   54   HG23  VAL   6          2HG2      VAL   6   7.326  -2.690   3.859
   55    H    GLU   7           H        GLU   7   8.274  -4.057   6.180
   56    HA   GLU   7           HA       GLU   7   6.307  -6.142   5.448
   57    HB2  GLU   7           2HB      GLU   7   7.112  -5.068   8.184
   58    HB3  GLU   7           3HB      GLU   7   5.707  -6.108   7.925
   59    HG2  GLU   7           2HG      GLU   7   7.211  -7.843   6.928
   60    HG3  GLU   7           3HG      GLU   7   8.594  -6.812   7.278
   61    H    VAL   8           H        VAL   8   4.637  -5.415   4.568
   62    HA   VAL   8           HA       VAL   8   3.754  -2.622   4.766
   63    HB   VAL   8           HB       VAL   8   3.273  -4.823   2.692
   64   HG11  VAL   8          1HG1      VAL   8   2.079  -3.148   1.314
   65   HG12  VAL   8          2HG1      VAL   8   2.156  -1.999   2.650
   66   HG13  VAL   8          3HG1      VAL   8   1.226  -3.490   2.821
   67   HG21  VAL   8          3HG2      VAL   8   5.519  -3.811   2.601
   68   HG22  VAL   8          1HG2      VAL   8   4.806  -2.197   2.488
   69   HG23  VAL   8          2HG2      VAL   8   4.577  -3.359   1.178
   70    H    GLN   9           H        GLN   9   2.214  -2.359   6.280
   71    HA   GLN   9           HA       GLN   9   0.362  -4.548   6.961
   72    HB2  GLN   9           2HB      GLN   9   0.889  -1.941   8.461
   73    HB3  GLN   9           3HB      GLN   9  -0.048  -3.313   9.040
   74    HG2  GLN   9           2HG      GLN   9   2.000  -4.694   9.082
   75    HG3  GLN   9           3HG      GLN   9   2.938  -3.324   8.492
   76   HE21  GLN   9          1HE2      GLN   9   1.208  -4.659  11.226
   77   HE22  GLN   9          2HE2      GLN   9   1.864  -3.591  12.417
   78    H    VAL  10           H        VAL  10  -1.319  -4.446   5.568
   79    HA   VAL  10           HA       VAL  10  -2.397  -1.868   4.654
   80    HB   VAL  10           HB       VAL  10  -3.077  -4.714   3.741
   81   HG11  VAL  10          1HG1      VAL  10  -4.227  -3.645   1.830
   82   HG12  VAL  10          2HG1      VAL  10  -3.885  -2.048   2.504
   83   HG13  VAL  10          3HG1      VAL  10  -4.961  -3.155   3.360
   84   HG21  VAL  10          3HG2      VAL  10  -1.316  -2.611   2.418
   85   HG22  VAL  10          1HG2      VAL  10  -1.756  -4.171   1.714
   86   HG23  VAL  10          2HG2      VAL  10  -0.761  -4.109   3.171
   87    H    LYS  11           H        LYS  11  -3.894  -1.001   5.902
   88    HA   LYS  11           HA       LYS  11  -5.910  -2.655   7.312
   89    HB2  LYS  11           2HB      LYS  11  -4.333  -1.557   8.880
   90    HB3  LYS  11           3HB      LYS  11  -4.633   0.003   8.126
   91    HG2  LYS  11           2HG      LYS  11  -7.006  -0.117   8.872
   92    HG3  LYS  11           3HG      LYS  11  -6.658  -1.650   9.674
   93    HD2  LYS  11           2HD      LYS  11  -6.654   0.196  11.291
   94    HD3  LYS  11           3HD      LYS  11  -5.041  -0.511  11.163
   95    HE2  LYS  11           2HE      LYS  11  -4.369   1.359   9.663
   96    HE3  LYS  11           3HE      LYS  11  -5.982   2.057   9.839
   97    HZ1  LYS  11           3HZ      LYS  11  -4.277   3.044  11.310
   98    HZ2  LYS  11           1HZ      LYS  11  -4.144   1.569  12.117
   99    HZ3  LYS  11           2HZ      LYS  11  -5.605   2.419  12.145
  100    H    ILE  12           H        ILE  12  -7.692  -2.470   6.003
  101    HA   ILE  12           HA       ILE  12  -8.338   0.188   4.867
  102    HB   ILE  12           HB       ILE  12  -7.643  -1.216   3.058
  103   HG12  ILE  12          2HG1      ILE  12 -10.690  -1.027   3.048
  104   HG13  ILE  12          3HG1      ILE  12  -9.586   0.288   2.662
  105   HG21  ILE  12          1HG2      ILE  12  -8.670  -3.374   2.468
  106   HG22  ILE  12          2HG2      ILE  12  -9.665  -3.310   3.924
  107   HG23  ILE  12          3HG2      ILE  12  -7.910  -3.442   4.060
  108   HD11  ILE  12          3HD1      ILE  12 -10.524  -0.666   0.673
  109   HD12  ILE  12          1HD1      ILE  12  -9.920  -2.265   1.104
  110   HD13  ILE  12          2HD1      ILE  12  -8.788  -0.963   0.725
  111    H    THR  13           H        THR  13 -10.164   1.069   5.521
  112    HA   THR  13           HA       THR  13 -12.194  -0.542   6.918
  113    HB   THR  13           HB       THR  13 -11.886   2.505   6.799
  114    HG1  THR  13           HG1      THR  13 -11.069   0.607   8.767
  115   HG21  THR  13          3HG2      THR  13 -14.191   1.749   7.356
  116   HG22  THR  13          1HG2      THR  13 -13.402   2.515   8.741
  117   HG23  THR  13          2HG2      THR  13 -13.540   0.757   8.663
  118    H    CYS  14           H        CYS  14 -13.715  -1.237   5.600
  119    HA   CYS  14           HA       CYS  14 -14.839   0.449   3.422
  120    HB2  CYS  14           2HB      CYS  14 -13.491  -1.612   2.732
  121    HB3  CYS  14           3HB      CYS  14 -14.732  -2.592   3.490
  122    H    ASN  15           H        ASN  15 -16.800   1.124   4.037
  123    HA   ASN  15           HA       ASN  15 -18.948   1.235   4.685
  124    HB2  ASN  15           2HB      ASN  15 -19.281  -0.929   3.515
  125    HB3  ASN  15           3HB      ASN  15 -18.820  -1.804   4.964
  126   HD21  ASN  15          1HD2      ASN  15 -21.326  -1.738   3.309
  127   HD22  ASN  15          2HD2      ASN  15 -22.592  -1.462   4.451
  128    H    GLY  16           H        GLY  16 -17.880  -1.420   6.806
  129    HA2  GLY  16           2HA      GLY  16 -17.353   0.325   9.070
  130    HA3  GLY  16           3HA      GLY  16 -18.797  -0.672   9.257
  131    H    LYS  17           H        LYS  17 -16.548  -2.224   7.295
  132    HA   LYS  17           HA       LYS  17 -15.464  -3.854   9.514
  133    HB2  LYS  17           2HB      LYS  17 -15.929  -4.549   6.575
  134    HB3  LYS  17           3HB      LYS  17 -15.176  -5.628   7.737
  135    HG2  LYS  17           2HG      LYS  17 -17.994  -4.609   8.168
  136    HG3  LYS  17           3HG      LYS  17 -17.677  -5.970   7.101
  137    HD2  LYS  17           2HD      LYS  17 -18.297  -6.903   9.203
  138    HD3  LYS  17           3HD      LYS  17 -16.559  -7.138   9.063
  139    HE2  LYS  17           2HE      LYS  17 -17.222  -6.464  11.343
  140    HE3  LYS  17           3HE      LYS  17 -16.174  -5.255  10.601
  141    HZ1  LYS  17           3HZ      LYS  17 -18.063  -4.270  11.769
  142    HZ2  LYS  17           1HZ      LYS  17 -19.135  -5.087  10.749
  143    HZ3  LYS  17           2HZ      LYS  17 -18.104  -3.908  10.119
  144    H    THR  18           H        THR  18 -13.333  -3.661   9.875
  145    HA   THR  18           HA       THR  18 -11.585  -2.377   7.863
  146    HB   THR  18           HB       THR  18 -11.232  -2.572  10.896
  147    HG1  THR  18           HG1      THR  18 -12.724  -1.019  10.630
  148   HG21  THR  18          3HG2      THR  18  -9.392  -0.957  10.585
  149   HG22  THR  18          1HG2      THR  18  -9.597  -1.046   8.835
  150   HG23  THR  18          2HG2      THR  18  -9.051  -2.466   9.734
  151    H    TYR  19           H        TYR  19 -10.075  -3.601   6.943
  152    HA   TYR  19           HA       TYR  19  -9.479  -6.320   7.951
  153    HB2  TYR  19           2HB      TYR  19  -9.356  -5.198   5.101
  154    HB3  TYR  19           3HB      TYR  19  -8.940  -6.844   5.561
  155    HD1  TYR  19           HD2      TYR  19 -11.859  -4.471   5.868
  156    HD2  TYR  19           HD1      TYR  19 -10.595  -8.494   5.170
  157    HE1  TYR  19           HE2      TYR  19 -14.183  -5.139   5.518
  158    HE2  TYR  19           HE1      TYR  19 -12.942  -9.158   4.822
  159    HH   TYR  19           HH       TYR  19 -15.487  -6.854   4.534
  160    H    GLU  20           H        GLU  20  -7.608  -6.073   9.123
  161    HA   GLU  20           HA       GLU  20  -5.363  -4.537   7.931
  162    HB2  GLU  20           2HB      GLU  20  -4.562  -3.964  10.119
  163    HB3  GLU  20           3HB      GLU  20  -6.266  -3.554  10.067
  164    HG2  GLU  20           2HG      GLU  20  -5.052  -5.964  11.452
  165    HG3  GLU  20           3HG      GLU  20  -5.602  -4.486  12.235
  166    H    ARG  21           H        ARG  21  -3.351  -5.509   7.793
  167    HA   ARG  21           HA       ARG  21  -2.610  -7.849   9.254
  168    HB2  ARG  21           2HB      ARG  21  -4.038  -9.034   7.681
  169    HB3  ARG  21           3HB      ARG  21  -3.294  -8.228   6.305
  170    HG2  ARG  21           2HG      ARG  21  -1.224  -9.437   6.621
  171    HG3  ARG  21           3HG      ARG  21  -1.776 -10.091   8.163
  172    HD2  ARG  21           2HD      ARG  21  -3.089 -10.695   5.500
  173    HD3  ARG  21           3HD      ARG  21  -1.859 -11.714   6.251
  174    HE   ARG  21           HE       ARG  21  -4.629 -11.345   7.127
  175   HH11  ARG  21          1HH1      ARG  21  -1.490 -12.798   7.814
  176   HH12  ARG  21          2HH1      ARG  21  -2.134 -13.934   8.953
  177   HH21  ARG  21          1HH2      ARG  21  -5.451 -12.847   8.634
  178   HH22  ARG  21          2HH2      ARG  21  -4.377 -13.961   9.418
  179    H    THR  22           H        THR  22  -0.457  -8.149   9.270
  180    HA   THR  22           HA       THR  22   1.321  -6.322   7.871
  181    HB   THR  22           HB       THR  22   1.960  -8.547   9.872
  182    HG1  THR  22           HG1      THR  22   1.112  -7.272  11.299
  183   HG21  THR  22          3HG2      THR  22   3.588  -6.098   9.081
  184   HG22  THR  22          1HG2      THR  22   3.954  -7.768   8.630
  185   HG23  THR  22          2HG2      THR  22   4.026  -7.274  10.322
  186    H    TYR  23           H        TYR  23   1.772  -6.912   5.799
  187    HA   TYR  23           HA       TYR  23   2.195  -9.728   5.026
  188    HB2  TYR  23           2HB      TYR  23   2.023  -7.179   3.339
  189    HB3  TYR  23           3HB      TYR  23   2.278  -8.791   2.683
  190    HD1  TYR  23           HD1      TYR  23  -0.198  -6.587   4.380
  191    HD2  TYR  23           HD2      TYR  23   0.415 -10.299   2.346
  192    HE1  TYR  23           HE1      TYR  23  -2.629  -6.879   4.179
  193    HE2  TYR  23           HE2      TYR  23  -2.015 -10.596   2.153
  194    HH   TYR  23           HH       TYR  23  -4.048  -9.855   3.242
  195    H    GLN  24           H        GLN  24   4.190 -10.494   4.488
  196    HA   GLN  24           HA       GLN  24   6.557  -8.768   4.909
  197    HB2  GLN  24           2HB      GLN  24   6.271 -11.812   4.765
  198    HB3  GLN  24           3HB      GLN  24   7.824 -10.991   4.825
  199    HG2  GLN  24           2HG      GLN  24   7.276 -11.834   7.026
  200    HG3  GLN  24           3HG      GLN  24   7.262 -10.077   7.056
  201   HE21  GLN  24          1HE2      GLN  24   5.338  -9.017   7.553
  202   HE22  GLN  24          2HE2      GLN  24   3.907  -9.840   8.058
  203    H    LEU  25           H        LEU  25   7.181  -7.768   3.071
  204    HA   LEU  25           HA       LEU  25   7.078  -9.212   0.482
  205    HB2  LEU  25           2HB      LEU  25   6.892  -6.214   1.016
  206    HB3  LEU  25           3HB      LEU  25   7.036  -6.925  -0.587
  207    HG   LEU  25           HG       LEU  25   4.690  -7.192   1.334
  208   HD11  LEU  25          1HD1      LEU  25   4.743  -5.083   0.112
  209   HD12  LEU  25          2HD1      LEU  25   3.403  -6.086  -0.433
  210   HD13  LEU  25          3HD1      LEU  25   4.859  -5.944  -1.426
  211   HD21  LEU  25          3HD2      LEU  25   3.575  -8.573  -0.395
  212   HD22  LEU  25          1HD2      LEU  25   5.002  -9.364   0.272
  213   HD23  LEU  25          2HD2      LEU  25   5.075  -8.616  -1.325
  214    H    TYR  26           H        TYR  26   8.974  -9.821  -0.210
  215    HA   TYR  26           HA       TYR  26  11.463  -8.461   0.654
  216    HB2  TYR  26           2HB      TYR  26  11.195 -10.735   1.602
  217    HB3  TYR  26           3HB      TYR  26  10.912 -11.400   0.001
  218    HD1  TYR  26           HD1      TYR  26  13.501  -9.918   2.227
  219    HD2  TYR  26           HD2      TYR  26  12.783 -11.987  -1.445
  220    HE1  TYR  26           HE1      TYR  26  15.899 -10.398   2.024
  221    HE2  TYR  26           HE2      TYR  26  15.183 -12.466  -1.648
  222    HH   TYR  26           HH       TYR  26  17.308 -11.630  -0.850
  223    H    ALA  27           H        ALA  27  12.430  -7.414  -1.006
  224    HA   ALA  27           HA       ALA  27  12.710  -8.694  -3.616
  225    HB1  ALA  27           3HB      ALA  27  10.641  -7.376  -3.892
  226    HB2  ALA  27           1HB      ALA  27  11.949  -6.715  -4.875
  227    HB3  ALA  27           2HB      ALA  27  11.488  -5.918  -3.370
  228    H    VAL  28           H        VAL  28  14.437  -7.950  -4.781
  229    HA   VAL  28           HA       VAL  28  16.576  -6.619  -3.385
  230    HB   VAL  28           HB       VAL  28  16.408  -7.547  -6.302
  231   HG11  VAL  28          1HG1      VAL  28  18.220  -5.907  -5.988
  232   HG12  VAL  28          2HG1      VAL  28  18.870  -7.513  -6.319
  233   HG13  VAL  28          3HG1      VAL  28  18.887  -6.876  -4.673
  234   HG21  VAL  28          3HG2      VAL  28  17.609  -9.579  -5.601
  235   HG22  VAL  28          1HG2      VAL  28  16.077  -9.431  -4.737
  236   HG23  VAL  28          2HG2      VAL  28  17.590  -9.032  -3.922
  237    H    ARG  29           H        ARG  29  14.304  -5.878  -6.011
  238    HA   ARG  29           HA       ARG  29  15.446  -3.158  -6.370
  239    HB2  ARG  29           2HB      ARG  29  13.993  -4.786  -8.504
  240    HB3  ARG  29           3HB      ARG  29  14.920  -3.303  -8.730
  241    HG2  ARG  29           2HG      ARG  29  16.986  -4.583  -8.061
  242    HG3  ARG  29           3HG      ARG  29  16.007  -6.047  -8.021
  243    HD2  ARG  29           2HD      ARG  29  15.519  -5.773 -10.433
  244    HD3  ARG  29           3HD      ARG  29  16.512  -4.309 -10.467
  245    HE   ARG  29           HE       ARG  29  17.464  -7.072 -10.073
  246   HH11  ARG  29          1HH1      ARG  29  18.278  -3.710 -10.755
  247   HH12  ARG  29          2HH1      ARG  29  19.917  -4.087 -11.183
  248   HH21  ARG  29          1HH2      ARG  29  19.595  -7.523 -10.623
  249   HH22  ARG  29          2HH2      ARG  29  20.661  -6.241 -11.108
  250    H    ASP  30           H        ASP  30  13.910  -1.537  -7.213
  251    HA   ASP  30           HA       ASP  30  11.599  -1.181  -5.636
  252    HB2  ASP  30           2HB      ASP  30  12.519   0.222  -8.187
  253    HB3  ASP  30           3HB      ASP  30  11.103   0.739  -7.286
  254    H    GLU  31           H        GLU  31  11.947  -2.037  -9.069
  255    HA   GLU  31           HA       GLU  31   9.199  -2.055  -9.719
  256    HB2  GLU  31           2HB      GLU  31  11.464  -3.528 -11.123
  257    HB3  GLU  31           3HB      GLU  31   9.877  -3.186 -11.807
  258    HG2  GLU  31           2HG      GLU  31  12.030  -1.180 -11.086
  259    HG3  GLU  31           3HG      GLU  31  11.490  -1.619 -12.705
  260    H    GLU  32           H        GLU  32  11.292  -4.497  -8.325
  261    HA   GLU  32           HA       GLU  32   9.544  -6.727  -8.713
  262    HB2  GLU  32           2HB      GLU  32  11.787  -6.377  -6.680
  263    HB3  GLU  32           3HB      GLU  32  11.058  -7.903  -7.177
  264    HG2  GLU  32           2HG      GLU  32  12.759  -6.058  -8.875
  265    HG3  GLU  32           3HG      GLU  32  13.229  -7.627  -8.225
  266    H    LEU  33           H        LEU  33   9.805  -4.176  -6.309
  267    HA   LEU  33           HA       LEU  33   8.157  -5.516  -4.325
  268    HB2  LEU  33           2HB      LEU  33  10.029  -3.539  -4.098
  269    HB3  LEU  33           3HB      LEU  33   8.602  -2.530  -4.181
  270    HG   LEU  33           HG       LEU  33   9.217  -2.891  -1.846
  271   HD11  LEU  33          1HD1      LEU  33   6.715  -4.503  -2.415
  272   HD12  LEU  33          2HD1      LEU  33   6.812  -2.746  -2.255
  273   HD13  LEU  33          3HD1      LEU  33   7.169  -3.771  -0.869
  274   HD21  LEU  33          3HD2      LEU  33   8.970  -5.878  -2.330
  275   HD22  LEU  33          1HD2      LEU  33   9.271  -5.098  -0.773
  276   HD23  LEU  33          2HD2      LEU  33  10.467  -4.984  -2.060
  277    H    LYS  34           H        LYS  34   7.738  -3.085  -6.880
  278    HA   LYS  34           HA       LYS  34   5.244  -1.998  -6.255
  279    HB2  LYS  34           2HB      LYS  34   6.542  -2.461  -8.966
  280    HB3  LYS  34           3HB      LYS  34   5.074  -1.510  -8.749
  281    HG2  LYS  34           2HG      LYS  34   6.247   0.128  -7.418
  282    HG3  LYS  34           3HG      LYS  34   7.703  -0.868  -7.392
  283    HD2  LYS  34           2HD      LYS  34   7.900   1.006  -8.993
  284    HD3  LYS  34           3HD      LYS  34   8.013  -0.560  -9.794
  285    HE2  LYS  34           2HE      LYS  34   5.636  -0.346 -10.493
  286    HE3  LYS  34           3HE      LYS  34   5.573   1.247  -9.733
  287    HZ1  LYS  34           3HZ      LYS  34   7.299   1.990 -11.252
  288    HZ2  LYS  34           1HZ      LYS  34   5.966   1.412 -12.106
  289    HZ3  LYS  34           2HZ      LYS  34   7.362   0.467 -11.975
  290    H    GLU  35           H        GLU  35   5.898  -4.709  -8.503
  291    HA   GLU  35           HA       GLU  35   3.309  -5.450  -9.158
  292    HB2  GLU  35           2HB      GLU  35   4.296  -7.769  -9.563
  293    HB3  GLU  35           3HB      GLU  35   5.129  -6.445 -10.371
  294    HG2  GLU  35           2HG      GLU  35   6.977  -6.536  -8.903
  295    HG3  GLU  35           3HG      GLU  35   6.092  -7.463  -7.696
  296    H    LYS  36           H        LYS  36   5.179  -6.300  -6.272
  297    HA   LYS  36           HA       LYS  36   3.401  -8.300  -5.270
  298    HB2  LYS  36           2HB      LYS  36   5.500  -6.680  -3.755
  299    HB3  LYS  36           3HB      LYS  36   4.727  -8.160  -3.184
  300    HG2  LYS  36           2HG      LYS  36   5.719  -9.378  -5.125
  301    HG3  LYS  36           3HG      LYS  36   6.560  -7.896  -5.584
  302    HD2  LYS  36           2HD      LYS  36   7.703  -7.952  -3.318
  303    HD3  LYS  36           3HD      LYS  36   6.965  -9.533  -3.051
  304    HE2  LYS  36           2HE      LYS  36   9.026  -8.757  -5.134
  305    HE3  LYS  36           3HE      LYS  36   9.178  -9.962  -3.858
  306    HZ1  LYS  36           3HZ      LYS  36   7.459 -10.150  -6.278
  307    HZ2  LYS  36           1HZ      LYS  36   7.477 -11.287  -5.026
  308    HZ3  LYS  36           2HZ      LYS  36   8.863 -11.037  -5.960
  309    H    LEU  37           H        LEU  37   3.797  -4.829  -4.681
  310    HA   LEU  37           HA       LEU  37   1.867  -4.466  -2.667
  311    HB2  LEU  37           2HB      LEU  37   2.837  -2.571  -4.839
  312    HB3  LEU  37           3HB      LEU  37   1.825  -2.064  -3.493
  313    HG   LEU  37           HG       LEU  37   4.562  -3.330  -3.094
  314   HD11  LEU  37          1HD1      LEU  37   4.870  -1.297  -4.396
  315   HD12  LEU  37          2HD1      LEU  37   5.469  -1.084  -2.754
  316   HD13  LEU  37          3HD1      LEU  37   3.924  -0.373  -3.228
  317   HD21  LEU  37          3HD2      LEU  37   2.818  -1.697  -1.215
  318   HD22  LEU  37          1HD2      LEU  37   4.421  -2.340  -0.849
  319   HD23  LEU  37          2HD2      LEU  37   3.080  -3.442  -1.140
  320    H    LYS  38           H        LYS  38   1.549  -4.382  -6.239
  321    HA   LYS  38           HA       LYS  38  -1.194  -3.812  -6.411
  322    HB2  LYS  38           2HB      LYS  38   0.565  -5.418  -8.316
  323    HB3  LYS  38           3HB      LYS  38  -1.016  -4.747  -8.718
  324    HG2  LYS  38           2HG      LYS  38  -0.156  -2.469  -8.412
  325    HG3  LYS  38           3HG      LYS  38   1.411  -3.107  -7.916
  326    HD2  LYS  38           2HD      LYS  38   1.558  -2.370 -10.224
  327    HD3  LYS  38           3HD      LYS  38   1.679  -4.131 -10.178
  328    HE2  LYS  38           2HE      LYS  38  -0.715  -4.289 -10.821
  329    HE3  LYS  38           3HE      LYS  38  -0.796  -2.525 -10.897
  330    HZ1  LYS  38           3HZ      LYS  38   0.840  -2.544 -12.646
  331    HZ2  LYS  38           1HZ      LYS  38  -0.465  -3.528 -13.077
  332    HZ3  LYS  38           2HZ      LYS  38   0.991  -4.221 -12.556
  333    H    LYS  39           H        LYS  39   0.539  -6.929  -6.158
  334    HA   LYS  39           HA       LYS  39  -1.668  -8.679  -6.376
  335    HB2  LYS  39           2HB      LYS  39   1.014  -8.999  -4.962
  336    HB3  LYS  39           3HB      LYS  39  -0.159 -10.309  -5.055
  337    HG2  LYS  39           2HG      LYS  39   1.122  -8.945  -7.442
  338    HG3  LYS  39           3HG      LYS  39   1.661 -10.469  -6.748
  339    HD2  LYS  39           2HD      LYS  39  -1.155 -10.097  -7.843
  340    HD3  LYS  39           3HD      LYS  39   0.196 -10.573  -8.866
  341    HE2  LYS  39           2HE      LYS  39  -1.030 -12.556  -8.226
  342    HE3  LYS  39           3HE      LYS  39   0.537 -12.587  -7.426
  343    HZ1  LYS  39           3HZ      LYS  39  -1.290 -13.272  -5.968
  344    HZ2  LYS  39           1HZ      LYS  39  -2.017 -11.757  -6.143
  345    HZ3  LYS  39           2HZ      LYS  39  -0.514 -11.894  -5.376
  346    H    VAL  40           H        VAL  40  -0.046  -7.396  -3.475
  347    HA   VAL  40           HA       VAL  40  -1.678  -8.485  -1.486
  348    HB   VAL  40           HB       VAL  40   0.136  -6.032  -1.526
  349   HG11  VAL  40          1HG1      VAL  40  -1.216  -7.207   0.927
  350   HG12  VAL  40          2HG1      VAL  40  -1.520  -5.614   0.234
  351   HG13  VAL  40          3HG1      VAL  40   0.053  -5.977   0.941
  352   HG21  VAL  40          3HG2      VAL  40   1.259  -8.212  -1.773
  353   HG22  VAL  40          1HG2      VAL  40   0.501  -8.790  -0.289
  354   HG23  VAL  40          2HG2      VAL  40   1.676  -7.472  -0.226
  355    H    LEU  41           H        LEU  41  -1.984  -5.417  -3.274
  356    HA   LEU  41           HA       LEU  41  -4.140  -4.414  -1.690
  357    HB2  LEU  41           2HB      LEU  41  -2.868  -3.520  -4.278
  358    HB3  LEU  41           3HB      LEU  41  -4.419  -2.834  -3.814
  359    HG   LEU  41           HG       LEU  41  -1.909  -2.727  -2.086
  360   HD11  LEU  41          1HD1      LEU  41  -1.651  -1.347  -4.091
  361   HD12  LEU  41          2HD1      LEU  41  -1.778  -0.357  -2.642
  362   HD13  LEU  41          3HD1      LEU  41  -3.162  -0.513  -3.730
  363   HD21  LEU  41          3HD2      LEU  41  -3.168  -1.146  -0.693
  364   HD22  LEU  41          1HD2      LEU  41  -3.975  -2.712  -0.756
  365   HD23  LEU  41          2HD2      LEU  41  -4.600  -1.358  -1.708
  366    H    ASN  42           H        ASN  42  -4.084  -5.952  -4.968
  367    HA   ASN  42           HA       ASN  42  -6.928  -6.011  -5.229
  368    HB2  ASN  42           2HB      ASN  42  -4.732  -7.547  -6.662
  369    HB3  ASN  42           3HB      ASN  42  -6.429  -7.870  -6.990
  370   HD21  ASN  42          1HD2      ASN  42  -3.789  -5.803  -7.671
  371   HD22  ASN  42          2HD2      ASN  42  -4.627  -4.718  -8.709
  372    H    GLU  43           H        GLU  43  -4.721  -8.033  -3.470
  373    HA   GLU  43           HA       GLU  43  -6.434 -10.318  -3.169
  374    HB2  GLU  43           2HB      GLU  43  -3.910 -10.313  -2.871
  375    HB3  GLU  43           3HB      GLU  43  -4.137  -9.440  -1.365
  376    HG2  GLU  43           2HG      GLU  43  -3.769 -11.786  -0.893
  377    HG3  GLU  43           3HG      GLU  43  -5.424 -11.355  -0.462
  378    H    ARG  44           H        ARG  44  -5.499  -7.649  -0.984
  379    HA   ARG  44           HA       ARG  44  -7.333  -8.379   1.081
  380    HB2  ARG  44           2HB      ARG  44  -5.115  -7.190   1.439
  381    HB3  ARG  44           3HB      ARG  44  -5.844  -5.741   0.765
  382    HG2  ARG  44           2HG      ARG  44  -5.847  -5.538   3.153
  383    HG3  ARG  44           3HG      ARG  44  -7.516  -5.762   2.635
  384    HD2  ARG  44           2HD      ARG  44  -5.855  -8.113   3.592
  385    HD3  ARG  44           3HD      ARG  44  -6.650  -7.041   4.734
  386    HE   ARG  44           HE       ARG  44  -8.781  -7.722   3.854
  387   HH11  ARG  44          1HH1      ARG  44  -6.125  -9.752   2.768
  388   HH12  ARG  44          2HH1      ARG  44  -7.148 -11.108   2.405
  389   HH21  ARG  44          1HH2      ARG  44 -10.090  -9.545   3.453
  390   HH22  ARG  44          2HH2      ARG  44  -9.383 -10.984   2.795
  391    H    MET  45           H        MET  45  -7.517  -6.320  -1.722
  392    HA   MET  45           HA       MET  45 -10.005  -5.056  -0.817
  393    HB2  MET  45           2HB      MET  45  -8.342  -4.438  -3.278
  394    HB3  MET  45           3HB      MET  45  -9.820  -3.603  -2.818
  395    HG2  MET  45           2HG      MET  45  -8.604  -3.025  -0.620
  396    HG3  MET  45           3HG      MET  45  -7.134  -3.536  -1.452
  397    HE1  MET  45           3HE      MET  45 -10.299  -1.664  -3.017
  398    HE2  MET  45           1HE      MET  45  -9.801  -0.004  -2.712
  399    HE3  MET  45           2HE      MET  45 -10.131  -1.082  -1.361
  400    H    ASP  46           H        ASP  46  -9.237  -7.865  -2.319
  401    HA   ASP  46           HA       ASP  46 -11.196  -8.122  -4.304
  402    HB2  ASP  46           2HB      ASP  46  -9.559  -9.855  -4.137
  403    HB3  ASP  46           3HB      ASP  46  -9.923 -10.163  -2.449
  404    HA   PRO  47           HA       PRO  47 -14.480  -9.433  -0.881
  405    HB2  PRO  47           2HB      PRO  47 -13.939  -8.806   1.750
  406    HB3  PRO  47           3HB      PRO  47 -13.493 -10.368   1.025
  407    HG2  PRO  47           2HG      PRO  47 -11.776  -7.927   1.416
  408    HG3  PRO  47           3HG      PRO  47 -11.408  -9.624   1.802
  409    HD2  PRO  47           2HD      PRO  47 -10.475  -8.488  -0.434
  410    HD3  PRO  47           3HD      PRO  47 -11.009 -10.182  -0.429
  411    H    ILE  48           H        ILE  48 -12.563  -6.549  -0.812
  412    HA   ILE  48           HA       ILE  48 -14.389  -4.780   0.533
  413    HB   ILE  48           HB       ILE  48 -11.912  -4.260  -1.150
  414   HG12  ILE  48          2HG1      ILE  48 -11.421  -5.546   0.876
  415   HG13  ILE  48          3HG1      ILE  48 -10.753  -3.929   1.020
  416   HG21  ILE  48          1HG2      ILE  48 -13.304  -2.248  -1.160
  417   HG22  ILE  48          2HG2      ILE  48 -11.826  -1.998  -0.239
  418   HG23  ILE  48          3HG2      ILE  48 -13.349  -2.257   0.605
  419   HD11  ILE  48          3HD1      ILE  48 -11.700  -4.730   3.094
  420   HD12  ILE  48          1HD1      ILE  48 -13.277  -4.915   2.331
  421   HD13  ILE  48          2HD1      ILE  48 -12.562  -3.309   2.513
  422    H    LYS  49           H        LYS  49 -13.552  -5.417  -2.899
  423    HA   LYS  49           HA       LYS  49 -15.265  -3.409  -4.014
  424    HB2  LYS  49           2HB      LYS  49 -14.224  -5.971  -5.307
  425    HB3  LYS  49           3HB      LYS  49 -14.966  -4.622  -6.166
  426    HG2  LYS  49           2HG      LYS  49 -13.087  -3.156  -5.458
  427    HG3  LYS  49           3HG      LYS  49 -12.345  -4.533  -4.634
  428    HD2  LYS  49           2HD      LYS  49 -12.322  -5.721  -6.899
  429    HD3  LYS  49           3HD      LYS  49 -12.790  -4.180  -7.625
  430    HE2  LYS  49           2HE      LYS  49 -10.239  -4.755  -6.070
  431    HE3  LYS  49           3HE      LYS  49 -10.376  -4.480  -7.807
  432    HZ1  LYS  49           3HZ      LYS  49  -9.619  -2.488  -6.795
  433    HZ2  LYS  49           1HZ      LYS  49 -10.856  -2.514  -5.645
  434    HZ3  LYS  49           2HZ      LYS  49 -11.219  -2.227  -7.267
  435    H    LYS  50           H        LYS  50 -15.641  -6.761  -3.047
  436    HA   LYS  50           HA       LYS  50 -18.280  -7.216  -3.993
  437    HB2  LYS  50           2HB      LYS  50 -16.654  -8.998  -3.471
  438    HB3  LYS  50           3HB      LYS  50 -16.672  -8.558  -1.776
  439    HG2  LYS  50           2HG      LYS  50 -19.251  -9.414  -3.081
  440    HG3  LYS  50           3HG      LYS  50 -18.049 -10.645  -2.701
  441    HD2  LYS  50           2HD      LYS  50 -19.353  -8.742  -0.708
  442    HD3  LYS  50           3HD      LYS  50 -19.726 -10.455  -0.911
  443    HE2  LYS  50           2HE      LYS  50 -17.385 -11.012  -0.242
  444    HE3  LYS  50           3HE      LYS  50 -17.081  -9.294   0.036
  445    HZ1  LYS  50           3HZ      LYS  50 -18.792  -9.295   1.734
  446    HZ2  LYS  50           1HZ      LYS  50 -17.624 -10.466   2.085
  447    HZ3  LYS  50           2HZ      LYS  50 -19.122 -10.929   1.453
  448    H    LEU  51           H        LEU  51 -16.995  -5.660  -1.118
  449    HA   LEU  51           HA       LEU  51 -19.507  -5.499   0.308
  450    HB2  LEU  51           2HB      LEU  51 -16.952  -3.866   0.618
  451    HB3  LEU  51           3HB      LEU  51 -18.358  -3.693   1.658
  452    HG   LEU  51           HG       LEU  51 -16.603  -6.167   1.422
  453   HD11  LEU  51          1HD1      LEU  51 -16.909  -4.210   3.717
  454   HD12  LEU  51          2HD1      LEU  51 -15.516  -4.358   2.643
  455   HD13  LEU  51          3HD1      LEU  51 -15.931  -5.683   3.725
  456   HD21  LEU  51          3HD2      LEU  51 -17.930  -7.119   3.254
  457   HD22  LEU  51          1HD2      LEU  51 -18.912  -6.845   1.817
  458   HD23  LEU  51          2HD2      LEU  51 -19.031  -5.740   3.189
  459    H    GLY  52           H        GLY  52 -17.684  -3.504  -1.969
  460    HA2  GLY  52           2HA      GLY  52 -18.245  -1.774  -3.339
  461    HA3  GLY  52           3HA      GLY  52 -19.921  -2.271  -3.146
  462    H    CYS  53           H        CYS  53 -17.346  -0.674  -1.253
  463    HA   CYS  53           HA       CYS  53 -19.288   0.764   0.355
  464    HB2  CYS  53           2HB      CYS  53 -16.250   0.814   0.413
  465    HB3  CYS  53           3HB      CYS  53 -17.324   1.512   1.632
  466    H    LYS  54           H        LYS  54 -19.365   3.006   0.624
  467    HA   LYS  54           HA       LYS  54 -19.265   4.591  -1.741
  468    HB2  LYS  54           2HB      LYS  54 -19.566   5.531   1.147
  469    HB3  LYS  54           3HB      LYS  54 -20.019   6.440  -0.292
  470    HG2  LYS  54           2HG      LYS  54 -21.324   3.898   0.735
  471    HG3  LYS  54           3HG      LYS  54 -21.994   5.528   0.817
  472    HD2  LYS  54           2HD      LYS  54 -21.435   3.973  -1.741
  473    HD3  LYS  54           3HD      LYS  54 -23.016   4.159  -0.984
  474    HE2  LYS  54           2HE      LYS  54 -22.903   6.608  -1.358
  475    HE3  LYS  54           3HE      LYS  54 -21.322   6.414  -2.123
  476    HZ1  LYS  54           3HZ      LYS  54 -23.089   6.568  -3.763
  477    HZ2  LYS  54           1HZ      LYS  54 -23.864   5.218  -3.096
  478    HZ3  LYS  54           2HZ      LYS  54 -22.351   5.049  -3.830
  479    H    ARG  55           H        ARG  55 -17.255   4.343   1.151
  480    HA   ARG  55           HA       ARG  55 -14.974   5.514  -0.266
  481    HB2  ARG  55           2HB      ARG  55 -15.549   7.479   0.897
  482    HB3  ARG  55           3HB      ARG  55 -16.184   6.613   2.287
  483    HG2  ARG  55           2HG      ARG  55 -13.995   6.197   3.159
  484    HG3  ARG  55           3HG      ARG  55 -13.213   6.677   1.655
  485    HD2  ARG  55           2HD      ARG  55 -14.849   8.668   3.245
  486    HD3  ARG  55           3HD      ARG  55 -13.174   8.313   3.683
  487    HE   ARG  55           HE       ARG  55 -13.719   9.069   0.908
  488   HH11  ARG  55          1HH1      ARG  55 -12.506  10.091   4.056
  489   HH12  ARG  55          2HH1      ARG  55 -11.648  11.457   3.410
  490   HH21  ARG  55          1HH2      ARG  55 -12.509  10.806   0.072
  491   HH22  ARG  55          2HH2      ARG  55 -11.652  11.859   1.159
  492    H    VAL  56           H        VAL  56 -13.100   4.514   0.200
  493    HA   VAL  56           HA       VAL  56 -12.889   2.695   2.515
  494    HB   VAL  56           HB       VAL  56 -11.336   1.273   1.182
  495   HG11  VAL  56          1HG1      VAL  56 -13.692   0.632   1.319
  496   HG12  VAL  56          2HG1      VAL  56 -13.036   0.189  -0.257
  497   HG13  VAL  56          3HG1      VAL  56 -14.072   1.609  -0.102
  498   HG21  VAL  56          3HG2      VAL  56 -11.175   1.511  -1.288
  499   HG22  VAL  56          1HG2      VAL  56 -10.511   2.921  -0.457
  500   HG23  VAL  56          2HG2      VAL  56 -12.107   3.010  -1.205
  501    H    ARG  57           H        ARG  57 -11.156   3.057   3.822
  502    HA   ARG  57           HA       ARG  57  -9.019   4.920   2.940
  503    HB2  ARG  57           2HB      ARG  57 -10.395   4.571   5.587
  504    HB3  ARG  57           3HB      ARG  57  -8.659   4.843   5.663
  505    HG2  ARG  57           2HG      ARG  57  -8.988   6.921   4.282
  506    HG3  ARG  57           3HG      ARG  57 -10.732   6.681   4.415
  507    HD2  ARG  57           2HD      ARG  57 -10.692   7.043   6.776
  508    HD3  ARG  57           3HD      ARG  57  -8.934   6.889   6.848
  509    HE   ARG  57           HE       ARG  57  -9.615   9.065   5.174
  510   HH11  ARG  57          1HH1      ARG  57  -9.608   8.190   8.582
  511   HH12  ARG  57          2HH1      ARG  57  -9.421   9.824   9.127
  512   HH21  ARG  57          1HH2      ARG  57  -9.333  11.208   5.911
  513   HH22  ARG  57          2HH2      ARG  57  -9.267  11.528   7.613
  514    H    ILE  58           H        ILE  58  -7.410   3.750   2.196
  515    HA   ILE  58           HA       ILE  58  -6.654   1.155   3.336
  516    HB   ILE  58           HB       ILE  58  -5.383   2.560   0.927
  517   HG12  ILE  58          2HG1      ILE  58  -7.697   0.574   0.757
  518   HG13  ILE  58          3HG1      ILE  58  -7.891   2.314   0.602
  519   HG21  ILE  58          1HG2      ILE  58  -5.512  -0.383   1.709
  520   HG22  ILE  58          2HG2      ILE  58  -4.109   0.676   1.876
  521   HG23  ILE  58          3HG2      ILE  58  -4.716   0.267   0.273
  522   HD11  ILE  58          3HD1      ILE  58  -6.283   0.548  -1.242
  523   HD12  ILE  58          1HD1      ILE  58  -6.463   2.300  -1.384
  524   HD13  ILE  58          2HD1      ILE  58  -7.868   1.252  -1.560
  525    H    SER  59           H        SER  59  -5.286   1.430   5.098
  526    HA   SER  59           HA       SER  59  -3.305   3.616   5.104
  527    HB2  SER  59           2HB      SER  59  -4.222   1.816   7.405
  528    HB3  SER  59           3HB      SER  59  -3.161   3.224   7.531
  529    HG   SER  59           HG       SER  59  -5.847   3.285   6.610
  530    H    ILE  60           H        ILE  60  -1.616   2.836   3.960
  531    HA   ILE  60           HA       ILE  60  -0.637   0.086   4.355
  532    HB   ILE  60           HB       ILE  60   0.064   2.230   2.297
  533   HG12  ILE  60          2HG1      ILE  60  -1.340  -0.467   2.005
  534   HG13  ILE  60          3HG1      ILE  60  -2.121   1.108   1.951
  535   HG21  ILE  60          1HG2      ILE  60   1.268  -0.548   2.540
  536   HG22  ILE  60          2HG2      ILE  60   2.112   0.978   2.799
  537   HG23  ILE  60          3HG2      ILE  60   1.523   0.561   1.192
  538   HD11  ILE  60          3HD1      ILE  60  -0.873   1.634  -0.101
  539   HD12  ILE  60          1HD1      ILE  60  -1.890   0.205  -0.260
  540   HD13  ILE  60          2HD1      ILE  60  -0.149   0.023  -0.057
  541    H    ARG  61           H        ARG  61   0.655  -0.094   6.051
  542    HA   ARG  61           HA       ARG  61   2.351   2.115   6.955
  543    HB2  ARG  61           2HB      ARG  61   0.747   0.485   8.410
  544    HB3  ARG  61           3HB      ARG  61   2.170  -0.539   8.411
  545    HG2  ARG  61           2HG      ARG  61   2.000   2.298   9.474
  546    HG3  ARG  61           3HG      ARG  61   2.018   0.828  10.443
  547    HD2  ARG  61           2HD      ARG  61   4.314   0.368   9.813
  548    HD3  ARG  61           3HD      ARG  61   4.305   1.683   8.631
  549    HE   ARG  61           HE       ARG  61   3.713   2.564  11.300
  550   HH11  ARG  61          1HH1      ARG  61   6.374   1.817   9.101
  551   HH12  ARG  61          2HH1      ARG  61   7.499   2.829   9.943
  552   HH21  ARG  61          1HH2      ARG  61   5.208   3.890  12.374
  553   HH22  ARG  61          2HH2      ARG  61   6.837   4.002  11.794
  554    H    VAL  62           H        VAL  62   4.198   2.153   5.809
  555    HA   VAL  62           HA       VAL  62   5.580  -0.305   4.990
  556    HB   VAL  62           HB       VAL  62   5.963   2.648   4.313
  557   HG11  VAL  62          1HG1      VAL  62   7.902   2.077   2.906
  558   HG12  VAL  62          2HG1      VAL  62   7.854   0.417   3.496
  559   HG13  VAL  62          3HG1      VAL  62   8.234   1.732   4.605
  560   HG21  VAL  62          3HG2      VAL  62   5.538   1.895   2.010
  561   HG22  VAL  62          1HG2      VAL  62   4.217   1.403   3.076
  562   HG23  VAL  62          2HG2      VAL  62   5.428   0.221   2.562
  563    H    LYS  63           H        LYS  63   6.864  -1.187   6.461
  564    HA   LYS  63           HA       LYS  63   8.053   0.359   8.629
  565    HB2  LYS  63           2HB      LYS  63   7.074  -2.033   8.846
  566    HB3  LYS  63           3HB      LYS  63   8.520  -2.593   8.020
  567    HG2  LYS  63           2HG      LYS  63   9.942  -1.761   9.824
  568    HG3  LYS  63           3HG      LYS  63   8.551  -1.016  10.618
  569    HD2  LYS  63           2HD      LYS  63   9.020  -3.056  11.799
  570    HD3  LYS  63           3HD      LYS  63   7.545  -3.324  10.868
  571    HE2  LYS  63           2HE      LYS  63   8.949  -5.284  10.691
  572    HE3  LYS  63           3HE      LYS  63   8.929  -4.483   9.120
  573    HZ1  LYS  63           3HZ      LYS  63  11.086  -3.568   9.563
  574    HZ2  LYS  63           1HZ      LYS  63  11.152  -5.236   9.837
  575    HZ3  LYS  63           2HZ      LYS  63  11.079  -4.164  11.142
  576    H    HIS  64           H        HIS  64   9.760   1.601   7.961
  577    HA   HIS  64           HA       HIS  64  11.544   0.999   5.839
  578    HB2  HIS  64           2HB      HIS  64  12.832   2.926   6.589
  579    HB3  HIS  64           3HB      HIS  64  11.127   3.317   6.791
  580    HD1  HIS  64           HD1      HIS  64  14.259   2.676   8.699
  581    HD2  HIS  64           HD2      HIS  64  10.295   3.618   9.507
  582    HE1  HIS  64           HE1      HIS  64  14.201   3.285  11.129
  583    HE2  HIS  64           HE2      HIS  64  11.817   3.954  11.569
  584    H    SER  65           H        SER  65  13.588   0.086   5.867
  585    HA   SER  65           HA       SER  65  13.997  -1.928   7.901
  586    HB2  SER  65           2HB      SER  65  14.225  -2.458   5.489
  587    HB3  SER  65           3HB      SER  65  15.597  -1.357   5.368
  588    HG   SER  65           HG       SER  65  16.782  -2.705   6.655
  589    H    ASP  66           H        ASP  66  15.581   1.052   6.857
  590    HA   ASP  66           HA       ASP  66  17.612   0.783   9.011
  591    HB2  ASP  66           2HB      ASP  66  17.958   1.881   6.187
  592    HB3  ASP  66           3HB      ASP  66  19.153   2.081   7.461
  593    H    ALA  67           H        ALA  67  18.002   2.598  10.232
  594    HA   ALA  67           HA       ALA  67  15.879   4.569  10.307
  595    HB1  ALA  67           3HB      ALA  67  18.265   4.217  12.157
  596    HB2  ALA  67           1HB      ALA  67  16.675   3.476  12.360
  597    HB3  ALA  67           2HB      ALA  67  16.845   5.228  12.459
  598    H    ALA  68           H        ALA  68  19.091   4.501   9.030
  599    HA   ALA  68           HA       ALA  68  19.351   7.403   8.812
  600    HB1  ALA  68           3HB      ALA  68  20.992   5.162   7.563
  601    HB2  ALA  68           1HB      ALA  68  21.379   6.020   9.055
  602    HB3  ALA  68           2HB      ALA  68  21.399   6.881   7.516
  603    H    GLU  69           H        GLU  69  18.611   4.612   6.786
  604    HA   GLU  69           HA       GLU  69  18.338   6.071   4.332
  605    HB2  GLU  69           2HB      GLU  69  17.631   3.188   5.005
  606    HB3  GLU  69           3HB      GLU  69  17.621   3.867   3.382
  607    HG2  GLU  69           2HG      GLU  69  20.089   3.733   5.142
  608    HG3  GLU  69           3HG      GLU  69  19.656   2.503   3.959
  609    H    GLU  70           H        GLU  70  16.178   5.550   6.935
  610    HA   GLU  70           HA       GLU  70  13.715   5.034   5.835
  611    HB2  GLU  70           2HB      GLU  70  12.717   6.237   7.781
  612    HB3  GLU  70           3HB      GLU  70  13.993   5.108   8.225
  613    HG2  GLU  70           2HG      GLU  70  15.563   6.903   8.574
  614    HG3  GLU  70           3HG      GLU  70  14.436   8.087   7.913
  615    H    LYS  71           H        LYS  71  15.368   8.171   5.757
  616    HA   LYS  71           HA       LYS  71  13.158   9.752   4.875
  617    HB2  LYS  71           2HB      LYS  71  16.164  10.164   4.565
  618    HB3  LYS  71           3HB      LYS  71  14.985  11.330   3.983
  619    HG2  LYS  71           2HG      LYS  71  15.705  12.186   6.058
  620    HG3  LYS  71           3HG      LYS  71  14.126  11.472   6.393
  621    HD2  LYS  71           2HD      LYS  71  15.343   9.411   7.231
  622    HD3  LYS  71           3HD      LYS  71  16.855  10.303   7.051
  623    HE2  LYS  71           2HE      LYS  71  16.118  10.385   9.371
  624    HE3  LYS  71           3HE      LYS  71  16.007  12.001   8.672
  625    HZ1  LYS  71           3HZ      LYS  71  13.741  10.102   9.002
  626    HZ2  LYS  71           1HZ      LYS  71  13.635  11.668   8.372
  627    HZ3  LYS  71           2HZ      LYS  71  14.057  11.438   9.994
  628    H    LYS  72           H        LYS  72  15.705   7.950   3.255
  629    HA   LYS  72           HA       LYS  72  14.975   8.534   0.561
  630    HB2  LYS  72           2HB      LYS  72  17.252   7.865   1.203
  631    HB3  LYS  72           3HB      LYS  72  16.669   6.317   1.795
  632    HG2  LYS  72           2HG      LYS  72  16.028   5.712  -0.558
  633    HG3  LYS  72           3HG      LYS  72  16.737   7.235  -1.108
  634    HD2  LYS  72           2HD      LYS  72  18.222   4.982   0.313
  635    HD3  LYS  72           3HD      LYS  72  18.307   5.340  -1.412
  636    HE2  LYS  72           2HE      LYS  72  19.385   7.480  -0.956
  637    HE3  LYS  72           3HE      LYS  72  19.188   7.250   0.782
  638    HZ1  LYS  72           3HZ      LYS  72  20.807   5.476  -0.971
  639    HZ2  LYS  72           1HZ      LYS  72  20.697   5.410   0.715
  640    HZ3  LYS  72           2HZ      LYS  72  21.439   6.732  -0.031
  641    H    GLU  73           H        GLU  73  14.052   6.021   2.902
  642    HA   GLU  73           HA       GLU  73  12.992   4.159   0.962
  643    HB2  GLU  73           2HB      GLU  73  12.857   4.179   4.007
  644    HB3  GLU  73           3HB      GLU  73  12.219   2.877   3.004
  645    HG2  GLU  73           2HG      GLU  73  14.512   2.475   2.110
  646    HG3  GLU  73           3HG      GLU  73  15.125   3.733   3.184
  647    H    ALA  74           H        ALA  74  11.528   6.427   3.332
  648    HA   ALA  74           HA       ALA  74   8.820   5.658   2.760
  649    HB1  ALA  74           3HB      ALA  74   9.871   8.184   4.084
  650    HB2  ALA  74           1HB      ALA  74   9.446   6.682   4.910
  651    HB3  ALA  74           2HB      ALA  74   8.195   7.626   4.096
  652    H    LYS  75           H        LYS  75  10.893   8.380   1.766
  653    HA   LYS  75           HA       LYS  75   9.214   9.608  -0.127
  654    HB2  LYS  75           2HB      LYS  75  11.262  10.646   0.764
  655    HB3  LYS  75           3HB      LYS  75  12.253   9.431  -0.031
  656    HG2  LYS  75           2HG      LYS  75  11.599  10.319  -2.235
  657    HG3  LYS  75           3HG      LYS  75  10.541  11.496  -1.453
  658    HD2  LYS  75           2HD      LYS  75  12.681  12.525  -2.153
  659    HD3  LYS  75           3HD      LYS  75  12.471  12.594  -0.404
  660    HE2  LYS  75           2HE      LYS  75  14.014  10.688  -0.133
  661    HE3  LYS  75           3HE      LYS  75  14.189  10.562  -1.886
  662    HZ1  LYS  75           3HZ      LYS  75  15.144  12.796  -1.902
  663    HZ2  LYS  75           1HZ      LYS  75  16.044  11.758  -0.915
  664    HZ3  LYS  75           2HZ      LYS  75  15.001  12.891  -0.221
  665    H    LYS  76           H        LYS  76  11.389   6.824  -0.434
  666    HA   LYS  76           HA       LYS  76  11.257   6.353  -3.210
  667    HB2  LYS  76           2HB      LYS  76  12.871   5.119  -1.962
  668    HB3  LYS  76           3HB      LYS  76  11.680   4.547  -0.809
  669    HG2  LYS  76           2HG      LYS  76  10.744   3.023  -2.491
  670    HG3  LYS  76           3HG      LYS  76  11.890   3.622  -3.695
  671    HD2  LYS  76           2HD      LYS  76  12.644   2.206  -1.101
  672    HD3  LYS  76           3HD      LYS  76  12.597   1.448  -2.695
  673    HE2  LYS  76           2HE      LYS  76  14.439   3.714  -1.844
  674    HE3  LYS  76           3HE      LYS  76  14.902   2.029  -2.092
  675    HZ1  LYS  76           3HZ      LYS  76  15.488   3.337  -4.010
  676    HZ2  LYS  76           1HZ      LYS  76  13.901   3.892  -4.180
  677    HZ3  LYS  76           2HZ      LYS  76  14.254   2.262  -4.434
  678    H    PHE  77           H        PHE  77   9.266   5.075  -0.533
  679    HA   PHE  77           HA       PHE  77   7.487   3.629  -2.220
  680    HB2  PHE  77           2HB      PHE  77   7.672   4.166   0.733
  681    HB3  PHE  77           3HB      PHE  77   6.115   3.642   0.099
  682    HD1  PHE  77           HD1      PHE  77   9.624   2.613   0.694
  683    HD2  PHE  77           HD2      PHE  77   5.811   1.403  -0.835
  684    HE1  PHE  77           HE1      PHE  77  10.353   0.265   0.700
  685    HE2  PHE  77           HE2      PHE  77   6.553  -0.933  -0.820
  686    HZ   PHE  77           HZ       PHE  77   8.815  -1.503  -0.057
  687    H    ALA  78           H        ALA  78   7.562   6.945  -1.139
  688    HA   ALA  78           HA       ALA  78   4.910   7.702  -1.543
  689    HB1  ALA  78           3HB      ALA  78   7.396   9.281  -2.279
  690    HB2  ALA  78           1HB      ALA  78   6.623   9.248  -0.694
  691    HB3  ALA  78           2HB      ALA  78   5.771   9.943  -2.076
  692    H    ALA  79           H        ALA  79   7.567   7.598  -3.947
  693    HA   ALA  79           HA       ALA  79   5.928   8.068  -6.234
  694    HB1  ALA  79           3HB      ALA  79   7.953   7.528  -7.525
  695    HB2  ALA  79           1HB      ALA  79   8.730   6.904  -6.059
  696    HB3  ALA  79           2HB      ALA  79   8.326   8.614  -6.187
  697    H    ILE  80           H        ILE  80   7.321   5.129  -4.779
  698    HA   ILE  80           HA       ILE  80   6.717   3.269  -6.799
  699    HB   ILE  80           HB       ILE  80   7.305   2.957  -3.833
  700   HG12  ILE  80          2HG1      ILE  80   9.218   3.710  -5.096
  701   HG13  ILE  80          3HG1      ILE  80   9.493   2.017  -4.705
  702   HG21  ILE  80          1HG2      ILE  80   7.004   0.649  -5.762
  703   HG22  ILE  80          2HG2      ILE  80   5.950   1.008  -4.400
  704   HG23  ILE  80          3HG2      ILE  80   7.625   0.540  -4.116
  705   HD11  ILE  80          3HD1      ILE  80   8.851   1.398  -6.996
  706   HD12  ILE  80          1HD1      ILE  80  10.206   2.528  -6.957
  707   HD13  ILE  80          2HD1      ILE  80   8.594   3.103  -7.378
  708    H    LEU  81           H        LEU  81   4.961   3.891  -3.730
  709    HA   LEU  81           HA       LEU  81   2.770   2.183  -4.312
  710    HB2  LEU  81           2HB      LEU  81   3.214   4.383  -2.278
  711    HB3  LEU  81           3HB      LEU  81   1.624   3.660  -2.448
  712    HG   LEU  81           HG       LEU  81   4.123   2.030  -1.834
  713   HD11  LEU  81          1HD1      LEU  81   3.735   3.601   0.003
  714   HD12  LEU  81          2HD1      LEU  81   3.378   1.951   0.499
  715   HD13  LEU  81          3HD1      LEU  81   2.058   3.067   0.135
  716   HD21  LEU  81          3HD2      LEU  81   2.309   0.743  -2.856
  717   HD22  LEU  81          1HD2      LEU  81   1.171   1.334  -1.640
  718   HD23  LEU  81          2HD2      LEU  81   2.516   0.292  -1.167
  719    H    ASN  82           H        ASN  82   3.379   5.647  -4.943
  720    HA   ASN  82           HA       ASN  82   0.755   6.403  -5.730
  721    HB2  ASN  82           2HB      ASN  82   2.870   7.893  -5.346
  722    HB3  ASN  82           3HB      ASN  82   3.249   7.576  -7.026
  723   HD21  ASN  82          1HD2      ASN  82   0.362   7.742  -7.887
  724   HD22  ASN  82          2HD2      ASN  82  -0.020   9.409  -7.804
  725    H    LYS  83           H        LYS  83   3.417   4.872  -7.526
  726    HA   LYS  83           HA       LYS  83   2.272   4.822 -10.112
  727    HB2  LYS  83           2HB      LYS  83   4.212   2.842  -8.828
  728    HB3  LYS  83           3HB      LYS  83   3.788   2.836 -10.536
  729    HG2  LYS  83           2HG      LYS  83   5.212   5.076  -9.070
  730    HG3  LYS  83           3HG      LYS  83   5.968   3.894 -10.142
  731    HD2  LYS  83           2HD      LYS  83   4.656   4.770 -12.045
  732    HD3  LYS  83           3HD      LYS  83   3.852   5.922 -10.975
  733    HE2  LYS  83           2HE      LYS  83   6.029   7.008 -10.520
  734    HE3  LYS  83           3HE      LYS  83   6.824   5.863 -11.604
  735    HZ1  LYS  83           3HZ      LYS  83   6.385   7.940 -12.729
  736    HZ2  LYS  83           1HZ      LYS  83   4.734   7.833 -12.372
  737    HZ3  LYS  83           2HZ      LYS  83   5.448   6.716 -13.419
  738    H    VAL  84           H        VAL  84   2.061   2.564  -7.382
  739    HA   VAL  84           HA       VAL  84   0.712   0.437  -8.683
  740    HB   VAL  84           HB       VAL  84   0.929   1.192  -5.727
  741   HG11  VAL  84          1HG1      VAL  84   0.257  -1.142  -5.199
  742   HG12  VAL  84          2HG1      VAL  84  -0.122  -1.403  -6.901
  743   HG13  VAL  84          3HG1      VAL  84  -1.042  -0.227  -5.967
  744   HG21  VAL  84          3HG2      VAL  84   2.451  -0.877  -7.363
  745   HG22  VAL  84          1HG2      VAL  84   2.646  -0.592  -5.630
  746   HG23  VAL  84          2HG2      VAL  84   3.089   0.664  -6.786
  747    H    PHE  85           H        PHE  85  -0.433   3.116  -6.649
  748    HA   PHE  85           HA       PHE  85  -3.209   2.588  -6.710
  749    HB2  PHE  85           2HB      PHE  85  -1.876   5.321  -6.431
  750    HB3  PHE  85           3HB      PHE  85  -3.536   4.933  -5.982
  751    HD1  PHE  85           HD1      PHE  85  -3.093   2.274  -4.597
  752    HD2  PHE  85           HD2      PHE  85  -0.941   5.967  -4.343
  753    HE1  PHE  85           HE1      PHE  85  -2.320   1.683  -2.336
  754    HE2  PHE  85           HE2      PHE  85  -0.174   5.359  -2.090
  755    HZ   PHE  85           HZ       PHE  85  -0.856   3.220  -1.089
  756    H    ALA  86           H        ALA  86  -1.140   4.505  -8.852
  757    HA   ALA  86           HA       ALA  86  -3.194   5.508 -10.565
  758    HB1  ALA  86           3HB      ALA  86  -1.010   6.614 -10.363
  759    HB2  ALA  86           1HB      ALA  86  -1.339   6.186 -12.041
  760    HB3  ALA  86           2HB      ALA  86  -0.212   5.216 -11.086
  761    H    GLU  87           H        GLU  87  -1.425   2.496 -10.433
  762    HA   GLU  87           HA       GLU  87  -2.215   1.579 -13.081
  763    HB2  GLU  87           2HB      GLU  87  -0.784   0.192 -10.778
  764    HB3  GLU  87           3HB      GLU  87  -1.150  -0.596 -12.314
  765    HG2  GLU  87           2HG      GLU  87   0.250   1.049 -13.503
  766    HG3  GLU  87           3HG      GLU  87   0.600   1.857 -11.978
  767    H    LEU  88           H        LEU  88  -3.715   1.764 -10.052
  768    HA   LEU  88           HA       LEU  88  -5.514  -0.523 -10.581
  769    HB2  LEU  88           2HB      LEU  88  -5.169   1.192  -8.074
  770    HB3  LEU  88           3HB      LEU  88  -6.369  -0.082  -8.247
  771    HG   LEU  88           HG       LEU  88  -3.347  -0.454  -8.220
  772   HD11  LEU  88          1HD1      LEU  88  -3.683  -1.674  -6.130
  773   HD12  LEU  88          2HD1      LEU  88  -5.418  -1.334  -6.189
  774   HD13  LEU  88          3HD1      LEU  88  -4.263  -0.013  -5.997
  775   HD21  LEU  88          3HD2      LEU  88  -5.501  -2.561  -8.563
  776   HD22  LEU  88          1HD2      LEU  88  -3.779  -2.877  -8.316
  777   HD23  LEU  88          2HD2      LEU  88  -4.321  -2.051  -9.773
  778    H    GLY  89           H        GLY  89  -5.341   2.986 -10.341
  779    HA2  GLY  89           2HA      GLY  89  -6.973   4.100 -11.907
  780    HA3  GLY  89           3HA      GLY  89  -8.229   3.270 -10.997
  781    H    TYR  90           H        TYR  90  -6.384   3.779  -8.525
  782    HA   TYR  90           HA       TYR  90  -7.748   6.095  -7.565
  783    HB2  TYR  90           2HB      TYR  90  -5.324   4.679  -6.361
  784    HB3  TYR  90           3HB      TYR  90  -6.376   5.814  -5.516
  785    HD1  TYR  90           HD2      TYR  90  -9.064   4.967  -6.219
  786    HD2  TYR  90           HD1      TYR  90  -5.639   2.549  -5.357
  787    HE1  TYR  90           HE2      TYR  90 -10.532   3.130  -5.543
  788    HE2  TYR  90           HE1      TYR  90  -7.120   0.702  -4.671
  789    HH   TYR  90           HH       TYR  90 -10.335   0.590  -5.478
  790    H    ASN  91           H        ASN  91  -6.933   8.135  -7.049
  791    HA   ASN  91           HA       ASN  91  -4.785   9.098  -8.809
  792    HB2  ASN  91           2HB      ASN  91  -6.793  10.683  -7.138
  793    HB3  ASN  91           3HB      ASN  91  -5.692  11.347  -8.344
  794   HD21  ASN  91          1HD2      ASN  91  -6.150  10.998 -10.561
  795   HD22  ASN  91          2HD2      ASN  91  -7.705  10.475 -11.097
  796    H    ASP  92           H        ASP  92  -3.195  10.570  -8.007
  797    HA   ASP  92           HA       ASP  92  -1.951   9.994  -5.532
  798    HB2  ASP  92           2HB      ASP  92  -0.452  11.896  -6.067
  799    HB3  ASP  92           3HB      ASP  92  -0.672  10.838  -7.452
  800    H    SER  93           H        SER  93  -4.411  12.282  -6.446
  801    HA   SER  93           HA       SER  93  -4.315  14.057  -4.237
  802    HB2  SER  93           2HB      SER  93  -6.617  14.706  -4.964
  803    HB3  SER  93           3HB      SER  93  -5.494  14.618  -6.318
  804    HG   SER  93           HG       SER  93  -7.780  13.404  -6.120
  805    H    ASN  94           H        ASN  94  -5.224  10.773  -4.325
  806    HA   ASN  94           HA       ASN  94  -7.014  10.873  -1.994
  807    HB2  ASN  94           2HB      ASN  94  -5.943   8.499  -3.598
  808    HB3  ASN  94           3HB      ASN  94  -7.125   8.387  -2.297
  809   HD21  ASN  94          1HD2      ASN  94  -8.703  10.683  -3.018
  810   HD22  ASN  94          2HD2      ASN  94  -9.514  10.300  -4.496
  811    H    VAL  95           H        VAL  95  -3.700  10.702  -2.654
  812    HA   VAL  95           HA       VAL  95  -2.942   8.774  -0.582
  813    HB   VAL  95           HB       VAL  95  -1.277  10.222  -2.709
  814   HG11  VAL  95          1HG1      VAL  95   0.477   8.567  -2.293
  815   HG12  VAL  95          2HG1      VAL  95  -0.496   7.819  -1.028
  816   HG13  VAL  95          3HG1      VAL  95   0.116   9.460  -0.812
  817   HG21  VAL  95          3HG2      VAL  95  -2.988   8.760  -3.719
  818   HG22  VAL  95          1HG2      VAL  95  -2.405   7.397  -2.760
  819   HG23  VAL  95          2HG2      VAL  95  -1.366   8.119  -3.992
  820    H    THR  96           H        THR  96  -2.619   9.584   1.448
  821    HA   THR  96           HA       THR  96  -1.271  12.214   1.806
  822    HB   THR  96           HB       THR  96  -3.311  10.870   3.646
  823    HG1  THR  96           HG1      THR  96  -3.510  12.723   1.578
  824   HG21  THR  96          3HG2      THR  96  -3.297  13.006   4.902
  825   HG22  THR  96          1HG2      THR  96  -1.994  13.608   3.880
  826   HG23  THR  96          2HG2      THR  96  -1.711  12.232   4.953
  827    H    TRP  97           H        TRP  97   0.810  11.786   2.299
  828    HA   TRP  97           HA       TRP  97   1.615   9.425   3.823
  829    HB2  TRP  97           2HB      TRP  97   3.130  11.536   2.250
  830    HB3  TRP  97           3HB      TRP  97   3.989  10.524   3.409
  831    HD1  TRP  97           HD1      TRP  97   2.396  10.357  -0.057
  832    HE1  TRP  97           HE1      TRP  97   2.893   8.045  -1.071
  833    HE3  TRP  97           HE3      TRP  97   4.389   8.058   4.064
  834    HZ2  TRP  97           HZ2      TRP  97   3.991   5.587  -0.238
  835    HZ3  TRP  97           HZ3      TRP  97   5.139   5.721   3.871
  836    HH2  TRP  97           HH2      TRP  97   4.942   4.512   1.757
  837    H    ASP  98           H        ASP  98   1.718   9.457   5.932
  838    HA   ASP  98           HA       ASP  98   2.722  11.822   7.403
  839    HB2  ASP  98           2HB      ASP  98   0.909   9.577   8.420
  840    HB3  ASP  98           3HB      ASP  98   1.546  10.892   9.401
  841    H    GLY  99           H        GLY  99   4.829  11.137   6.836
  842    HA2  GLY  99           2HA      GLY  99   6.876  10.307   7.425
  843    HA3  GLY  99           3HA      GLY  99   6.108   9.377   8.702
  844    H    ASP 100           H        ASP 100   6.149   7.242   8.448
  845    HA   ASP 100           HA       ASP 100   6.896   6.035   5.865
  846    HB2  ASP 100           2HB      ASP 100   6.863   4.844   8.678
  847    HB3  ASP 100           3HB      ASP 100   7.422   4.012   7.233
  848    H    THR 101           H        THR 101   4.058   6.782   7.308
  849    HA   THR 101           HA       THR 101   2.639   4.366   6.320
  850    HB   THR 101           HB       THR 101   1.739   6.266   8.549
  851    HG1  THR 101           HG1      THR 101   3.545   4.778   9.011
  852   HG21  THR 101          3HG2      THR 101   0.511   3.631   7.610
  853   HG22  THR 101          1HG2      THR 101  -0.187   5.236   7.357
  854   HG23  THR 101          2HG2      THR 101  -0.033   4.586   8.989
  855    H    VAL 102           H        VAL 102   0.999   4.752   4.864
  856    HA   VAL 102           HA       VAL 102   0.242   7.559   4.283
  857    HB   VAL 102           HB       VAL 102   1.567   6.717   2.426
  858   HG11  VAL 102          1HG1      VAL 102   1.316   4.299   2.713
  859   HG12  VAL 102          2HG1      VAL 102   0.951   4.774   1.053
  860   HG13  VAL 102          3HG1      VAL 102  -0.363   4.391   2.169
  861   HG21  VAL 102          3HG2      VAL 102  -0.295   8.193   1.862
  862   HG22  VAL 102          1HG2      VAL 102  -1.373   6.807   1.680
  863   HG23  VAL 102          2HG2      VAL 102  -0.023   7.029   0.565
  864    H    THR 103           H        THR 103  -1.848   8.001   4.569
  865    HA   THR 103           HA       THR 103  -3.876   5.861   4.682
  866    HB   THR 103           HB       THR 103  -4.018   8.779   5.594
  867    HG1  THR 103           HG1      THR 103  -2.925   6.685   6.775
  868   HG21  THR 103          3HG2      THR 103  -6.045   6.527   5.951
  869   HG22  THR 103          1HG2      THR 103  -6.257   7.972   4.943
  870   HG23  THR 103          2HG2      THR 103  -6.149   8.120   6.695
  871    H    VAL 104           H        VAL 104  -4.506   5.507   2.645
  872    HA   VAL 104           HA       VAL 104  -4.897   7.659   0.688
  873    HB   VAL 104           HB       VAL 104  -5.146   4.616   0.365
  874   HG11  VAL 104          1HG1      VAL 104  -5.045   5.041  -2.073
  875   HG12  VAL 104          2HG1      VAL 104  -5.046   6.781  -1.775
  876   HG13  VAL 104          3HG1      VAL 104  -6.455   5.812  -1.339
  877   HG21  VAL 104          3HG2      VAL 104  -2.827   6.427  -0.393
  878   HG22  VAL 104          1HG2      VAL 104  -2.949   4.700  -0.733
  879   HG23  VAL 104          2HG2      VAL 104  -2.844   5.264   0.936
  880    H    GLU 105           H        GLU 105  -6.874   8.612   0.757
  881    HA   GLU 105           HA       GLU 105  -9.218   7.026   1.619
  882    HB2  GLU 105           2HB      GLU 105 -10.200   9.210   2.358
  883    HB3  GLU 105           3HB      GLU 105  -8.784   8.719   3.279
  884    HG2  GLU 105           2HG      GLU 105  -7.395  10.343   2.100
  885    HG3  GLU 105           3HG      GLU 105  -8.747  10.779   1.052
  886    H    GLY 106           H        GLY 106 -10.549   6.639   0.025
  887    HA2  GLY 106           2HA      GLY 106 -11.345   8.569  -1.941
  888    HA3  GLY 106           3HA      GLY 106 -10.265   7.340  -2.607
  889    H    GLN 107           H        GLN 107 -12.410   7.171  -3.821
  890    HA   GLN 107           HA       GLN 107 -14.205   5.197  -2.547
  891    HB2  GLN 107           2HB      GLN 107 -14.537   6.693  -5.195
  892    HB3  GLN 107           3HB      GLN 107 -15.753   5.706  -4.378
  893    HG2  GLN 107           2HG      GLN 107 -15.709   7.312  -2.472
  894    HG3  GLN 107           3HG      GLN 107 -14.592   8.320  -3.383
  895   HE21  GLN 107          1HE2      GLN 107 -17.880   7.216  -3.106
  896   HE22  GLN 107          2HE2      GLN 107 -18.566   8.381  -4.182
  897    H    LEU 108           H        LEU 108 -14.758   3.300  -3.870
  898    HA   LEU 108           HA       LEU 108 -12.569   1.900  -4.909
  899    HB2  LEU 108           2HB      LEU 108 -15.559   1.486  -5.246
  900    HB3  LEU 108           3HB      LEU 108 -14.370   0.330  -5.839
  901    HG   LEU 108           HG       LEU 108 -14.815   1.097  -2.920
  902   HD11  LEU 108          1HD1      LEU 108 -15.426  -1.498  -4.364
  903   HD12  LEU 108          2HD1      LEU 108 -16.612  -0.309  -3.816
  904   HD13  LEU 108          3HD1      LEU 108 -15.639  -1.185  -2.638
  905   HD21  LEU 108          3HD2      LEU 108 -13.195  -0.663  -2.371
  906   HD22  LEU 108          1HD2      LEU 108 -12.449   0.611  -3.333
  907   HD23  LEU 108          2HD2      LEU 108 -12.875  -0.928  -4.087
  908    H    GLU 109           H        GLU 109 -11.582   2.000  -6.796
  909    HA   GLU 109           HA       GLU 109 -12.083   3.882  -8.822
  910    HB2  GLU 109           2HB      GLU 109 -10.226   2.917  -9.998
  911    HB3  GLU 109           3HB      GLU 109  -9.847   2.786  -8.290
  912    HG2  GLU 109           2HG      GLU 109 -10.991   0.494  -9.902
  913    HG3  GLU 109           3HG      GLU 109  -9.272   0.790  -9.768
  914    H    GLY 110           H        GLY 110 -13.086   0.572  -8.422
  915    HA2  GLY 110           2HA      GLY 110 -15.426   0.731  -9.856
  916    HA3  GLY 110           3HA      GLY 110 -14.226   0.112 -10.996
  917    H    VAL 111           H        VAL 111 -16.615  -1.068  -9.429
  918    HA   VAL 111           HA       VAL 111 -15.693  -3.352  -8.025
  919    HB   VAL 111           HB       VAL 111 -18.143  -3.105  -9.850
  920   HG11  VAL 111          1HG1      VAL 111 -19.121  -4.968  -8.565
  921   HG12  VAL 111          2HG1      VAL 111 -17.632  -5.124  -7.631
  922   HG13  VAL 111          3HG1      VAL 111 -17.626  -5.463  -9.362
  923   HG21  VAL 111          3HG2      VAL 111 -18.155  -1.381  -8.096
  924   HG22  VAL 111          1HG2      VAL 111 -17.950  -2.615  -6.852
  925   HG23  VAL 111          2HG2      VAL 111 -19.431  -2.565  -7.814
  926    H    ASP 112           H        ASP 112 -16.381  -2.737 -11.439
  927    HA   ASP 112           HA       ASP 112 -14.281  -4.642 -12.258
  928    HB2  ASP 112           2HB      ASP 112 -16.568  -5.625 -12.703
  929    HB3  ASP 112           3HB      ASP 112 -16.926  -4.247 -13.737
  930    H    LEU 113           H        LEU 113 -13.135  -3.936 -14.159
  931    HA   LEU 113           HA       LEU 113 -13.175  -0.975 -14.426
  932    HB2  LEU 113           2HB      LEU 113 -10.831  -2.895 -14.760
  933    HB3  LEU 113           3HB      LEU 113 -10.749  -1.137 -14.802
  934    HG   LEU 113           HG       LEU 113 -11.404  -2.854 -12.373
  935   HD11  LEU 113          1HD1      LEU 113  -9.308  -1.992 -11.444
  936   HD12  LEU 113          2HD1      LEU 113  -8.984  -1.125 -12.947
  937   HD13  LEU 113          3HD1      LEU 113  -9.035  -2.889 -12.937
  938   HD21  LEU 113          3HD2      LEU 113 -11.305   0.170 -12.584
  939   HD22  LEU 113          1HD2      LEU 113 -11.437  -0.750 -11.082
  940   HD23  LEU 113          2HD2      LEU 113 -12.730  -0.824 -12.273
  941    H    GLU 114           H        GLU 114 -12.017  -0.225 -16.505
  942    HA   GLU 114           HA       GLU 114 -13.217  -1.145 -18.885
  943    HB2  GLU 114           2HB      GLU 114 -10.656   0.469 -18.500
  944    HB3  GLU 114           3HB      GLU 114 -11.439   0.225 -20.060
  945    HG2  GLU 114           2HG      GLU 114 -12.598   1.681 -17.667
  946    HG3  GLU 114           3HG      GLU 114 -11.989   2.418 -19.146
  947    H    HIS 115           H        HIS 115 -10.037  -1.798 -17.453
  948    HA   HIS 115           HA       HIS 115  -9.609  -4.122 -19.161
  949    HB2  HIS 115           2HB      HIS 115  -8.123  -3.136 -16.679
  950    HB3  HIS 115           3HB      HIS 115  -7.670  -4.562 -17.605
  951    HD1  HIS 115           HD1      HIS 115  -6.538  -1.324 -17.198
  952    HD2  HIS 115           HD2      HIS 115  -7.401  -3.584 -20.570
  953    HE1  HIS 115           HE1      HIS 115  -5.194  -0.303 -19.053
  954    HE2  HIS 115           HE2      HIS 115  -5.750  -1.671 -21.087
  955    H    HIS 116           H        HIS 116 -11.413  -5.383 -18.837
  956    HA   HIS 116           HA       HIS 116 -12.734  -5.755 -16.349
  957    HB2  HIS 116           2HB      HIS 116 -12.972  -7.340 -18.949
  958    HB3  HIS 116           3HB      HIS 116 -14.036  -7.553 -17.563
  959    HD1  HIS 116           HD1      HIS 116 -16.093  -6.173 -17.585
  960    HD2  HIS 116           HD2      HIS 116 -13.165  -4.559 -20.040
  961    HE1  HIS 116           HE1      HIS 116 -17.164  -4.206 -18.702
  962    HE2  HIS 116           HE2      HIS 116 -15.311  -3.129 -20.007
  963    H    HIS 117           H        HIS 117 -11.355  -6.484 -14.815
  964    HA   HIS 117           HA       HIS 117 -10.489  -9.305 -14.903
  965    HB2  HIS 117           2HB      HIS 117  -8.691  -6.966 -14.077
  966    HB3  HIS 117           3HB      HIS 117  -8.302  -8.659 -13.813
  967    HD1  HIS 117           HD1      HIS 117  -8.374 -10.072 -16.291
  968    HD2  HIS 117           HD2      HIS 117  -7.434  -6.022 -16.290
  969    HE1  HIS 117           HE1      HIS 117  -7.242  -9.634 -18.488
  970    HE2  HIS 117           HE2      HIS 117  -6.816  -7.160 -18.522
  971    H    HIS 118           H        HIS 118 -12.727  -7.820 -13.647
  972    HA   HIS 118           HA       HIS 118 -12.440  -7.487 -10.893
  973    HB2  HIS 118           2HB      HIS 118 -14.881  -7.879 -10.710
  974    HB3  HIS 118           3HB      HIS 118 -14.502  -6.833 -12.069
  975    HD1  HIS 118           HD1      HIS 118 -16.760  -9.375 -11.307
  976    HD2  HIS 118           HD2      HIS 118 -14.291  -8.731 -14.578
  977    HE1  HIS 118           HE1      HIS 118 -17.751 -10.714 -13.172
  978    HE2  HIS 118           HE2      HIS 118 -16.113 -10.481 -15.059
  979    H    HIS 119           H        HIS 119 -11.879  -8.854  -9.321
  980    HA   HIS 119           HA       HIS 119 -11.436 -11.651  -9.854
  981    HB2  HIS 119           2HB      HIS 119  -9.981 -10.088  -8.387
  982    HB3  HIS 119           3HB      HIS 119 -11.180 -10.331  -7.120
  983    HD1  HIS 119           HD1      HIS 119 -11.093 -12.557  -5.863
  984    HD2  HIS 119           HD2      HIS 119  -8.464 -12.408  -9.071
  985    HE1  HIS 119           HE1      HIS 119  -9.591 -14.552  -5.597
  986    HE2  HIS 119           HE2      HIS 119  -7.889 -14.303  -7.435
  987    H    HIS 120           H        HIS 120 -13.686  -9.749  -7.872
  988    HA   HIS 120           HA       HIS 120 -15.530 -12.039  -7.692
  989    HB2  HIS 120           2HB      HIS 120 -15.493  -9.252  -6.489
  990    HB3  HIS 120           3HB      HIS 120 -17.027 -10.095  -6.640
  991    HD1  HIS 120           HD1      HIS 120 -14.125  -9.791  -4.465
  992    HD2  HIS 120           HD2      HIS 120 -17.105 -12.603  -5.144
  993    HE1  HIS 120           HE1      HIS 120 -14.197 -11.216  -2.399
  994    HE2  HIS 120           HE2      HIS 120 -16.006 -12.903  -2.833
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1  23.304  -0.912   0.042
    2    H2   MET   1           2H       MET   1  23.166  -0.901   1.724
    3    H3   MET   1           3H       MET   1  22.421   0.309   0.807
    4    HA   MET   1           HA       MET   1  20.802  -1.282   1.582
    5    HB2  MET   1           2HB      MET   1  19.720  -1.759  -0.559
    6    HB3  MET   1           3HB      MET   1  20.464  -0.171  -0.621
    7    HG2  MET   1           2HG      MET   1  22.309  -1.043  -1.967
    8    HG3  MET   1           3HG      MET   1  21.664  -2.679  -1.837
    9    HE1  MET   1           3HE      MET   1  18.344  -2.378  -3.970
   10    HE2  MET   1           1HE      MET   1  18.483  -2.175  -2.225
   11    HE3  MET   1           2HE      MET   1  19.367  -3.471  -3.036
   12    H    SER   2           H        SER   2  19.828  -3.442   1.049
   13    HA   SER   2           HA       SER   2  21.577  -5.563   0.114
   14    HB2  SER   2           2HB      SER   2  22.030  -5.410   2.598
   15    HB3  SER   2           3HB      SER   2  20.317  -5.696   2.903
   16    HG   SER   2           HG       SER   2  22.159  -7.450   1.632
   17    H    GLY   3           H        GLY   3  20.256  -7.604  -0.112
   18    HA2  GLY   3           2HA      GLY   3  17.578  -7.192  -1.029
   19    HA3  GLY   3           3HA      GLY   3  18.360  -8.745  -0.744
   20    H    LYS   4           H        LYS   4  16.196  -6.405   0.534
   21    HA   LYS   4           HA       LYS   4  16.209  -7.637   3.236
   22    HB2  LYS   4           2HB      LYS   4  17.051  -5.286   3.165
   23    HB3  LYS   4           3HB      LYS   4  15.551  -4.766   2.417
   24    HG2  LYS   4           2HG      LYS   4  15.184  -4.128   4.598
   25    HG3  LYS   4           3HG      LYS   4  14.443  -5.722   4.623
   26    HD2  LYS   4           2HD      LYS   4  17.288  -5.167   5.555
   27    HD3  LYS   4           3HD      LYS   4  15.894  -5.125   6.625
   28    HE2  LYS   4           2HE      LYS   4  15.475  -7.507   6.198
   29    HE3  LYS   4           3HE      LYS   4  16.846  -7.561   5.086
   30    HZ1  LYS   4           3HZ      LYS   4  17.442  -8.395   7.282
   31    HZ2  LYS   4           1HZ      LYS   4  17.003  -6.924   7.990
   32    HZ3  LYS   4           2HZ      LYS   4  18.315  -6.993   6.927
   33    H    LYS   5           H        LYS   5  14.249  -8.081   4.214
   34    HA   LYS   5           HA       LYS   5  11.799  -8.055   2.652
   35    HB2  LYS   5           2HB      LYS   5  12.313  -9.960   4.134
   36    HB3  LYS   5           3HB      LYS   5  12.385  -8.885   5.526
   37    HG2  LYS   5           2HG      LYS   5   9.920  -8.325   5.020
   38    HG3  LYS   5           3HG      LYS   5   9.948  -9.701   3.916
   39    HD2  LYS   5           2HD      LYS   5  10.527  -9.798   6.903
   40    HD3  LYS   5           3HD      LYS   5   9.038 -10.324   6.123
   41    HE2  LYS   5           2HE      LYS   5  10.233 -12.115   4.965
   42    HE3  LYS   5           3HE      LYS   5  11.770 -11.561   5.636
   43    HZ1  LYS   5           3HZ      LYS   5  10.954 -12.069   7.846
   44    HZ2  LYS   5           1HZ      LYS   5  10.868 -13.440   6.863
   45    HZ3  LYS   5           2HZ      LYS   5   9.466 -12.569   7.223
   46    H    VAL   6           H        VAL   6  10.577  -6.270   2.589
   47    HA   VAL   6           HA       VAL   6  10.349  -4.470   4.929
   48    HB   VAL   6           HB       VAL   6  10.714  -3.011   3.091
   49   HG11  VAL   6          1HG1      VAL   6  10.650  -4.708   1.291
   50   HG12  VAL   6          2HG1      VAL   6   9.729  -3.273   0.834
   51   HG13  VAL   6          3HG1      VAL   6   8.887  -4.731   1.367
   52   HG21  VAL   6          3HG2      VAL   6   8.669  -2.339   4.278
   53   HG22  VAL   6          1HG2      VAL   6   7.692  -3.288   3.157
   54   HG23  VAL   6          2HG2      VAL   6   8.590  -1.883   2.575
   55    H    GLU   7           H        GLU   7   8.381  -4.361   5.972
   56    HA   GLU   7           HA       GLU   7   6.315  -6.329   5.155
   57    HB2  GLU   7           2HB      GLU   7   7.015  -5.275   7.918
   58    HB3  GLU   7           3HB      GLU   7   5.617  -6.282   7.572
   59    HG2  GLU   7           2HG      GLU   7   7.109  -8.104   6.839
   60    HG3  GLU   7           3HG      GLU   7   8.507  -7.090   7.180
   61    H    VAL   8           H        VAL   8   4.605  -5.423   4.317
   62    HA   VAL   8           HA       VAL   8   4.056  -2.546   4.625
   63    HB   VAL   8           HB       VAL   8   3.067  -4.586   2.564
   64   HG11  VAL   8          1HG1      VAL   8   2.160  -2.691   1.292
   65   HG12  VAL   8          2HG1      VAL   8   2.638  -1.578   2.574
   66   HG13  VAL   8          3HG1      VAL   8   1.394  -2.790   2.881
   67   HG21  VAL   8          3HG2      VAL   8   4.568  -3.409   0.994
   68   HG22  VAL   8          1HG2      VAL   8   5.470  -4.080   2.358
   69   HG23  VAL   8          2HG2      VAL   8   5.114  -2.351   2.299
   70    H    GLN   9           H        GLN   9   2.510  -1.977   6.059
   71    HA   GLN   9           HA       GLN   9   0.557  -3.961   7.054
   72    HB2  GLN   9           2HB      GLN   9   1.327  -1.197   8.139
   73    HB3  GLN   9           3HB      GLN   9   0.210  -2.320   8.908
   74    HG2  GLN   9           2HG      GLN   9   2.028  -3.903   9.320
   75    HG3  GLN   9           3HG      GLN   9   3.155  -2.860   8.452
   76   HE21  GLN   9          1HE2      GLN   9   1.260  -3.196  11.393
   77   HE22  GLN   9          2HE2      GLN   9   2.089  -1.977  12.295
   78    H    VAL  10           H        VAL  10  -1.117  -3.927   5.598
   79    HA   VAL  10           HA       VAL  10  -2.118  -1.394   4.485
   80    HB   VAL  10           HB       VAL  10  -2.842  -4.291   3.796
   81   HG11  VAL  10          1HG1      VAL  10  -4.729  -2.786   3.314
   82   HG12  VAL  10          2HG1      VAL  10  -4.002  -3.373   1.817
   83   HG13  VAL  10          3HG1      VAL  10  -3.665  -1.734   2.377
   84   HG21  VAL  10          3HG2      VAL  10  -1.094  -2.315   2.284
   85   HG22  VAL  10          1HG2      VAL  10  -1.545  -3.927   1.720
   86   HG23  VAL  10          2HG2      VAL  10  -0.531  -3.744   3.153
   87    H    LYS  11           H        LYS  11  -3.549  -0.387   5.805
   88    HA   LYS  11           HA       LYS  11  -5.522  -1.975   7.353
   89    HB2  LYS  11           2HB      LYS  11  -4.076  -0.550   8.758
   90    HB3  LYS  11           3HB      LYS  11  -4.450   0.857   7.764
   91    HG2  LYS  11           2HG      LYS  11  -6.879   0.565   8.457
   92    HG3  LYS  11           3HG      LYS  11  -6.328  -0.640   9.617
   93    HD2  LYS  11           2HD      LYS  11  -5.452   2.273   9.556
   94    HD3  LYS  11           3HD      LYS  11  -6.668   1.598  10.639
   95    HE2  LYS  11           2HE      LYS  11  -4.940   0.122  11.635
   96    HE3  LYS  11           3HE      LYS  11  -3.727   0.848  10.574
   97    HZ1  LYS  11           3HZ      LYS  11  -3.738   1.816  12.802
   98    HZ2  LYS  11           1HZ      LYS  11  -5.336   2.326  12.592
   99    HZ3  LYS  11           2HZ      LYS  11  -4.107   2.973  11.626
  100    H    ILE  12           H        ILE  12  -7.302  -2.130   5.994
  101    HA   ILE  12           HA       ILE  12  -8.234   0.307   4.599
  102    HB   ILE  12           HB       ILE  12  -7.833  -1.478   3.038
  103   HG12  ILE  12          2HG1      ILE  12 -10.840  -1.240   3.479
  104   HG13  ILE  12          3HG1      ILE  12  -9.844  -0.035   2.671
  105   HG21  ILE  12          1HG2      ILE  12  -7.916  -3.439   4.520
  106   HG22  ILE  12          2HG2      ILE  12  -8.941  -3.688   3.105
  107   HG23  ILE  12          3HG2      ILE  12  -9.668  -3.276   4.659
  108   HD11  ILE  12          3HD1      ILE  12  -9.327  -1.652   0.924
  109   HD12  ILE  12          1HD1      ILE  12 -11.059  -1.375   1.090
  110   HD13  ILE  12          2HD1      ILE  12 -10.339  -2.848   1.737
  111    H    THR  13           H        THR  13 -10.075   1.237   5.183
  112    HA   THR  13           HA       THR  13 -11.799   0.044   7.246
  113    HB   THR  13           HB       THR  13 -11.802   2.939   6.258
  114    HG1  THR  13           HG1      THR  13  -9.747   2.101   7.234
  115   HG21  THR  13          3HG2      THR  13 -12.870   3.413   8.437
  116   HG22  THR  13          1HG2      THR  13 -12.810   1.704   8.859
  117   HG23  THR  13          2HG2      THR  13 -13.831   2.247   7.523
  118    H    CYS  14           H        CYS  14 -13.409  -1.124   6.313
  119    HA   CYS  14           HA       CYS  14 -14.975   0.014   4.082
  120    HB2  CYS  14           2HB      CYS  14 -13.593  -1.733   3.105
  121    HB3  CYS  14           3HB      CYS  14 -14.038  -2.869   4.376
  122    H    ASN  15           H        ASN  15 -16.983   0.305   4.698
  123    HA   ASN  15           HA       ASN  15 -18.977   0.237   5.737
  124    HB2  ASN  15           2HB      ASN  15 -19.132  -1.898   4.464
  125    HB3  ASN  15           3HB      ASN  15 -18.442  -2.769   5.829
  126   HD21  ASN  15          1HD2      ASN  15 -20.206  -4.086   6.244
  127   HD22  ASN  15          2HD2      ASN  15 -21.745  -3.499   6.756
  128    H    GLY  16           H        GLY  16 -17.176   1.161   7.374
  129    HA2  GLY  16           2HA      GLY  16 -16.999   1.835   9.542
  130    HA3  GLY  16           3HA      GLY  16 -18.362   0.803   9.931
  131    H    LYS  17           H        LYS  17 -15.900  -1.006   8.498
  132    HA   LYS  17           HA       LYS  17 -14.840  -1.884  11.122
  133    HB2  LYS  17           2HB      LYS  17 -15.387  -3.492   8.593
  134    HB3  LYS  17           3HB      LYS  17 -14.537  -4.124   9.997
  135    HG2  LYS  17           2HG      LYS  17 -16.611  -3.730  11.369
  136    HG3  LYS  17           3HG      LYS  17 -17.433  -3.226   9.887
  137    HD2  LYS  17           2HD      LYS  17 -17.948  -5.582  10.427
  138    HD3  LYS  17           3HD      LYS  17 -17.078  -5.457   8.898
  139    HE2  LYS  17           2HE      LYS  17 -14.978  -6.102  10.055
  140    HE3  LYS  17           3HE      LYS  17 -15.862  -6.241  11.575
  141    HZ1  LYS  17           3HZ      LYS  17 -15.548  -8.390  10.540
  142    HZ2  LYS  17           1HZ      LYS  17 -16.334  -7.881   9.140
  143    HZ3  LYS  17           2HZ      LYS  17 -17.193  -8.011  10.590
  144    H    THR  18           H        THR  18 -12.674  -2.166  11.338
  145    HA   THR  18           HA       THR  18 -10.909  -1.110   9.214
  146    HB   THR  18           HB       THR  18 -10.482  -1.392  12.226
  147    HG1  THR  18           HG1      THR  18 -11.965   0.281  11.384
  148   HG21  THR  18          3HG2      THR  18  -8.443  -0.052  11.916
  149   HG22  THR  18          1HG2      THR  18  -8.680  -0.074  10.170
  150   HG23  THR  18          2HG2      THR  18  -8.322  -1.576  11.029
  151    H    TYR  19           H        TYR  19  -9.783  -2.585   8.099
  152    HA   TYR  19           HA       TYR  19  -9.147  -5.248   9.230
  153    HB2  TYR  19           2HB      TYR  19  -9.392  -4.519   6.272
  154    HB3  TYR  19           3HB      TYR  19  -9.218  -6.125   6.960
  155    HD1  TYR  19           HD1      TYR  19 -11.149  -7.193   8.155
  156    HD2  TYR  19           HD2      TYR  19 -11.552  -3.461   6.110
  157    HE1  TYR  19           HE1      TYR  19 -13.587  -7.453   8.158
  158    HE2  TYR  19           HE2      TYR  19 -13.991  -3.722   6.117
  159    HH   TYR  19           HH       TYR  19 -15.654  -5.445   6.317
  160    H    GLU  20           H        GLU  20  -7.058  -4.917   9.984
  161    HA   GLU  20           HA       GLU  20  -5.084  -3.874   8.020
  162    HB2  GLU  20           2HB      GLU  20  -3.689  -3.118   9.869
  163    HB3  GLU  20           3HB      GLU  20  -5.276  -2.368   9.934
  164    HG2  GLU  20           2HG      GLU  20  -5.937  -3.796  11.790
  165    HG3  GLU  20           3HG      GLU  20  -4.433  -4.711  11.668
  166    H    ARG  21           H        ARG  21  -3.352  -5.049   7.536
  167    HA   ARG  21           HA       ARG  21  -2.611  -7.424   9.068
  168    HB2  ARG  21           2HB      ARG  21  -4.332  -8.230   7.465
  169    HB3  ARG  21           3HB      ARG  21  -3.419  -7.548   6.125
  170    HG2  ARG  21           2HG      ARG  21  -1.597  -9.134   6.498
  171    HG3  ARG  21           3HG      ARG  21  -2.398  -9.762   7.941
  172    HD2  ARG  21           2HD      ARG  21  -4.247 -10.625   6.570
  173    HD3  ARG  21           3HD      ARG  21  -3.523  -9.922   5.122
  174    HE   ARG  21           HE       ARG  21  -1.827 -11.546   5.170
  175   HH11  ARG  21          1HH1      ARG  21  -4.152 -12.111   7.739
  176   HH12  ARG  21          2HH1      ARG  21  -3.642 -13.746   8.002
  177   HH21  ARG  21          1HH2      ARG  21  -1.169 -13.692   5.540
  178   HH22  ARG  21          2HH2      ARG  21  -1.964 -14.631   6.762
  179    H    THR  22           H        THR  22  -0.471  -7.911   8.878
  180    HA   THR  22           HA       THR  22   1.242  -5.995   7.444
  181    HB   THR  22           HB       THR  22   1.946  -7.970   9.666
  182    HG1  THR  22           HG1      THR  22   0.669  -5.554   9.720
  183   HG21  THR  22          3HG2      THR  22   3.914  -7.250   8.348
  184   HG22  THR  22          1HG2      THR  22   3.953  -6.563   9.974
  185   HG23  THR  22          2HG2      THR  22   3.467  -5.563   8.605
  186    H    TYR  23           H        TYR  23   1.820  -6.701   5.458
  187    HA   TYR  23           HA       TYR  23   2.034  -9.565   4.807
  188    HB2  TYR  23           2HB      TYR  23   2.025  -7.120   2.969
  189    HB3  TYR  23           3HB      TYR  23   1.968  -8.800   2.446
  190    HD1  TYR  23           HD1      TYR  23   0.030  -6.089   4.094
  191    HD2  TYR  23           HD2      TYR  23  -0.144 -10.038   2.468
  192    HE1  TYR  23           HE1      TYR  23  -2.423  -6.003   4.149
  193    HE2  TYR  23           HE2      TYR  23  -2.601  -9.947   2.519
  194    HH   TYR  23           HH       TYR  23  -4.337  -7.064   3.020
  195    H    GLN  24           H        GLN  24   3.972 -10.472   4.485
  196    HA   GLN  24           HA       GLN  24   6.409  -8.863   4.804
  197    HB2  GLN  24           2HB      GLN  24   5.955 -11.894   4.765
  198    HB3  GLN  24           3HB      GLN  24   7.543 -11.147   4.895
  199    HG2  GLN  24           2HG      GLN  24   6.839 -11.805   7.103
  200    HG3  GLN  24           3HG      GLN  24   6.822 -10.043   7.016
  201   HE21  GLN  24          1HE2      GLN  24   5.332  -9.742   8.673
  202   HE22  GLN  24          2HE2      GLN  24   3.675 -10.221   8.554
  203    H    LEU  25           H        LEU  25   7.155  -7.959   2.979
  204    HA   LEU  25           HA       LEU  25   7.133  -9.485   0.420
  205    HB2  LEU  25           2HB      LEU  25   7.222  -6.443   0.808
  206    HB3  LEU  25           3HB      LEU  25   7.217  -7.286  -0.734
  207    HG   LEU  25           HG       LEU  25   4.917  -7.148   1.255
  208   HD11  LEU  25          1HD1      LEU  25   3.734  -5.957  -0.550
  209   HD12  LEU  25          2HD1      LEU  25   5.184  -6.026  -1.556
  210   HD13  LEU  25          3HD1      LEU  25   5.194  -5.102  -0.054
  211   HD21  LEU  25          3HD2      LEU  25   3.594  -8.435  -0.397
  212   HD22  LEU  25          1HD2      LEU  25   4.922  -9.378   0.277
  213   HD23  LEU  25          2HD2      LEU  25   5.056  -8.705  -1.349
  214    H    TYR  26           H        TYR  26   9.080  -9.921  -0.475
  215    HA   TYR  26           HA       TYR  26  11.536  -8.702   0.687
  216    HB2  TYR  26           2HB      TYR  26  11.040 -11.142   1.355
  217    HB3  TYR  26           3HB      TYR  26  11.261 -11.583  -0.331
  218    HD1  TYR  26           HD2      TYR  26  13.659 -10.683  -1.350
  219    HD2  TYR  26           HD1      TYR  26  12.884 -11.437   2.790
  220    HE1  TYR  26           HE2      TYR  26  16.061 -10.994  -0.955
  221    HE2  TYR  26           HE1      TYR  26  15.289 -11.745   3.176
  222    HH   TYR  26           HH       TYR  26  17.665 -10.893   0.921
  223    H    ALA  27           H        ALA  27  12.565  -7.523  -0.837
  224    HA   ALA  27           HA       ALA  27  12.956  -8.559  -3.536
  225    HB1  ALA  27           3HB      ALA  27  11.708  -5.813  -3.112
  226    HB2  ALA  27           1HB      ALA  27  10.877  -7.227  -3.761
  227    HB3  ALA  27           2HB      ALA  27  12.208  -6.501  -4.661
  228    H    VAL  28           H        VAL  28  14.461  -7.240  -4.752
  229    HA   VAL  28           HA       VAL  28  16.579  -6.001  -3.102
  230    HB   VAL  28           HB       VAL  28  16.621  -7.413  -5.809
  231   HG11  VAL  28          1HG1      VAL  28  18.937  -5.927  -4.532
  232   HG12  VAL  28          2HG1      VAL  28  18.114  -5.521  -6.044
  233   HG13  VAL  28          3HG1      VAL  28  19.058  -7.005  -5.928
  234   HG21  VAL  28          3HG2      VAL  28  16.629  -8.930  -3.874
  235   HG22  VAL  28          1HG2      VAL  28  18.042  -8.106  -3.211
  236   HG23  VAL  28          2HG2      VAL  28  18.174  -9.003  -4.724
  237    H    ARG  29           H        ARG  29  15.104  -5.788  -6.316
  238    HA   ARG  29           HA       ARG  29  15.779  -2.982  -6.697
  239    HB2  ARG  29           2HB      ARG  29  14.377  -5.015  -8.482
  240    HB3  ARG  29           3HB      ARG  29  14.827  -3.398  -8.985
  241    HG2  ARG  29           2HG      ARG  29  17.182  -3.939  -8.843
  242    HG3  ARG  29           3HG      ARG  29  16.831  -5.498  -8.091
  243    HD2  ARG  29           2HD      ARG  29  17.437  -5.750 -10.472
  244    HD3  ARG  29           3HD      ARG  29  15.785  -6.293 -10.170
  245    HE   ARG  29           HE       ARG  29  15.623  -3.635 -10.983
  246   HH11  ARG  29          1HH1      ARG  29  16.741  -6.651 -12.443
  247   HH12  ARG  29          2HH1      ARG  29  16.359  -6.142 -14.055
  248   HH21  ARG  29          1HH2      ARG  29  15.104  -3.014 -13.110
  249   HH22  ARG  29          2HH2      ARG  29  15.431  -4.082 -14.435
  250    H    ASP  30           H        ASP  30  14.102  -1.496  -7.428
  251    HA   ASP  30           HA       ASP  30  11.967  -1.347  -5.481
  252    HB2  ASP  30           2HB      ASP  30  12.403   0.679  -7.717
  253    HB3  ASP  30           3HB      ASP  30  11.732   0.945  -6.108
  254    H    GLU  31           H        GLU  31  12.216  -1.662  -8.961
  255    HA   GLU  31           HA       GLU  31   9.490  -1.703  -9.637
  256    HB2  GLU  31           2HB      GLU  31  10.254  -2.959 -11.712
  257    HB3  GLU  31           3HB      GLU  31  11.003  -1.400 -11.450
  258    HG2  GLU  31           2HG      GLU  31  12.475  -3.807 -10.428
  259    HG3  GLU  31           3HG      GLU  31  12.397  -3.586 -12.171
  260    H    GLU  32           H        GLU  32  11.620  -4.238  -8.347
  261    HA   GLU  32           HA       GLU  32   9.831  -6.428  -8.773
  262    HB2  GLU  32           2HB      GLU  32  12.020  -6.135  -6.658
  263    HB3  GLU  32           3HB      GLU  32  11.200  -7.633  -7.078
  264    HG2  GLU  32           2HG      GLU  32  12.156  -7.414  -9.401
  265    HG3  GLU  32           3HG      GLU  32  13.081  -6.040  -8.834
  266    H    LEU  33           H        LEU  33   9.955  -3.856  -6.428
  267    HA   LEU  33           HA       LEU  33   8.170  -5.178  -4.539
  268    HB2  LEU  33           2HB      LEU  33  10.060  -3.198  -4.227
  269    HB3  LEU  33           3HB      LEU  33   8.615  -2.214  -4.316
  270    HG   LEU  33           HG       LEU  33   9.219  -2.689  -1.978
  271   HD11  LEU  33          1HD1      LEU  33   6.825  -2.424  -2.439
  272   HD12  LEU  33          2HD1      LEU  33   7.114  -3.516  -1.087
  273   HD13  LEU  33          3HD1      LEU  33   6.667  -4.169  -2.666
  274   HD21  LEU  33          3HD2      LEU  33   9.135  -4.962  -1.020
  275   HD22  LEU  33          1HD2      LEU  33  10.393  -4.812  -2.242
  276   HD23  LEU  33          2HD2      LEU  33   8.883  -5.641  -2.629
  277    H    LYS  34           H        LYS  34   7.948  -2.809  -7.184
  278    HA   LYS  34           HA       LYS  34   5.448  -1.680  -6.732
  279    HB2  LYS  34           2HB      LYS  34   6.758  -2.325  -9.398
  280    HB3  LYS  34           3HB      LYS  34   5.254  -1.424  -9.261
  281    HG2  LYS  34           2HG      LYS  34   6.599   0.198  -7.755
  282    HG3  LYS  34           3HG      LYS  34   8.033  -0.586  -8.424
  283    HD2  LYS  34           2HD      LYS  34   7.530   1.413  -9.735
  284    HD3  LYS  34           3HD      LYS  34   7.210  -0.011 -10.727
  285    HE2  LYS  34           2HE      LYS  34   4.746   0.232  -9.985
  286    HE3  LYS  34           3HE      LYS  34   5.198   1.829  -9.388
  287    HZ1  LYS  34           3HZ      LYS  34   5.424   0.878 -12.197
  288    HZ2  LYS  34           1HZ      LYS  34   5.896   2.410 -11.649
  289    HZ3  LYS  34           2HZ      LYS  34   4.271   1.953 -11.597
  290    H    GLU  35           H        GLU  35   6.110  -4.535  -8.779
  291    HA   GLU  35           HA       GLU  35   3.576  -5.361  -9.426
  292    HB2  GLU  35           2HB      GLU  35   4.549  -7.720  -9.519
  293    HB3  GLU  35           3HB      GLU  35   5.423  -6.501 -10.438
  294    HG2  GLU  35           2HG      GLU  35   7.234  -6.466  -8.956
  295    HG3  GLU  35           3HG      GLU  35   6.299  -7.152  -7.632
  296    H    LYS  36           H        LYS  36   5.359  -6.102  -6.428
  297    HA   LYS  36           HA       LYS  36   3.574  -8.056  -5.421
  298    HB2  LYS  36           2HB      LYS  36   5.491  -6.289  -3.828
  299    HB3  LYS  36           3HB      LYS  36   4.790  -7.819  -3.297
  300    HG2  LYS  36           2HG      LYS  36   5.978  -8.961  -5.182
  301    HG3  LYS  36           3HG      LYS  36   6.747  -7.420  -5.570
  302    HD2  LYS  36           2HD      LYS  36   7.737  -7.411  -3.240
  303    HD3  LYS  36           3HD      LYS  36   7.074  -9.034  -3.010
  304    HE2  LYS  36           2HE      LYS  36   9.202  -8.162  -4.981
  305    HE3  LYS  36           3HE      LYS  36   9.366  -9.301  -3.651
  306    HZ1  LYS  36           3HZ      LYS  36   9.246 -10.493  -5.697
  307    HZ2  LYS  36           1HZ      LYS  36   7.819  -9.701  -6.152
  308    HZ3  LYS  36           2HZ      LYS  36   7.808 -10.777  -4.846
  309    H    LEU  37           H        LEU  37   3.831  -4.571  -4.918
  310    HA   LEU  37           HA       LEU  37   1.804  -4.232  -2.993
  311    HB2  LEU  37           2HB      LEU  37   2.766  -2.339  -5.174
  312    HB3  LEU  37           3HB      LEU  37   1.750  -1.860  -3.818
  313    HG   LEU  37           HG       LEU  37   4.543  -3.030  -3.499
  314   HD11  LEU  37          1HD1      LEU  37   4.687  -0.886  -4.646
  315   HD12  LEU  37          2HD1      LEU  37   5.292  -0.754  -2.997
  316   HD13  LEU  37          3HD1      LEU  37   3.693  -0.130  -3.402
  317   HD21  LEU  37          3HD2      LEU  37   4.357  -2.224  -1.176
  318   HD22  LEU  37          1HD2      LEU  37   3.097  -3.400  -1.545
  319   HD23  LEU  37          2HD2      LEU  37   2.708  -1.679  -1.485
  320    H    LYS  38           H        LYS  38   1.652  -3.950  -6.573
  321    HA   LYS  38           HA       LYS  38  -1.097  -3.538  -6.868
  322    HB2  LYS  38           2HB      LYS  38   0.849  -4.947  -8.758
  323    HB3  LYS  38           3HB      LYS  38  -0.715  -4.278  -9.223
  324    HG2  LYS  38           2HG      LYS  38   0.030  -2.025  -8.768
  325    HG3  LYS  38           3HG      LYS  38   1.516  -2.618  -8.033
  326    HD2  LYS  38           2HD      LYS  38   2.177  -1.833 -10.155
  327    HD3  LYS  38           3HD      LYS  38   2.108  -3.585 -10.336
  328    HE2  LYS  38           2HE      LYS  38  -0.114  -1.699 -11.190
  329    HE3  LYS  38           3HE      LYS  38   1.155  -2.281 -12.262
  330    HZ1  LYS  38           3HZ      LYS  38  -0.847  -3.972 -10.870
  331    HZ2  LYS  38           1HZ      LYS  38   0.392  -4.548 -11.864
  332    HZ3  LYS  38           2HZ      LYS  38  -0.836  -3.584 -12.512
  333    H    LYS  39           H        LYS  39   0.741  -6.554  -6.532
  334    HA   LYS  39           HA       LYS  39  -1.360  -8.383  -7.039
  335    HB2  LYS  39           2HB      LYS  39   1.095  -8.781  -5.275
  336    HB3  LYS  39           3HB      LYS  39   0.017 -10.069  -5.797
  337    HG2  LYS  39           2HG      LYS  39   1.828  -8.390  -7.538
  338    HG3  LYS  39           3HG      LYS  39   2.040 -10.084  -7.133
  339    HD2  LYS  39           2HD      LYS  39  -0.243  -8.957  -8.805
  340    HD3  LYS  39           3HD      LYS  39   1.207  -9.730  -9.444
  341    HE2  LYS  39           2HE      LYS  39   0.603 -11.829  -8.323
  342    HE3  LYS  39           3HE      LYS  39  -0.850 -11.073  -7.663
  343    HZ1  LYS  39           3HZ      LYS  39  -1.615 -10.705  -9.935
  344    HZ2  LYS  39           1HZ      LYS  39  -1.360 -12.345  -9.630
  345    HZ3  LYS  39           2HZ      LYS  39  -0.238 -11.472 -10.541
  346    H    VAL  40           H        VAL  40   0.006  -7.322  -3.921
  347    HA   VAL  40           HA       VAL  40  -1.742  -8.700  -2.205
  348    HB   VAL  40           HB       VAL  40   0.007  -6.230  -1.779
  349   HG11  VAL  40          1HG1      VAL  40  -1.502  -7.755   0.377
  350   HG12  VAL  40          2HG1      VAL  40  -1.782  -6.081  -0.107
  351   HG13  VAL  40          3HG1      VAL  40  -0.263  -6.531   0.667
  352   HG21  VAL  40          3HG2      VAL  40   0.360  -9.131  -0.924
  353   HG22  VAL  40          1HG2      VAL  40   1.482  -7.813  -0.558
  354   HG23  VAL  40          2HG2      VAL  40   1.226  -8.318  -2.228
  355    H    LEU  41           H        LEU  41  -1.910  -5.411  -3.517
  356    HA   LEU  41           HA       LEU  41  -4.236  -4.554  -2.168
  357    HB2  LEU  41           2HB      LEU  41  -2.935  -3.654  -4.759
  358    HB3  LEU  41           3HB      LEU  41  -4.400  -2.895  -4.153
  359    HG   LEU  41           HG       LEU  41  -1.837  -3.041  -2.509
  360   HD11  LEU  41          1HD1      LEU  41  -2.759  -0.747  -4.258
  361   HD12  LEU  41          2HD1      LEU  41  -1.357  -1.784  -4.545
  362   HD13  LEU  41          3HD1      LEU  41  -1.391  -0.720  -3.141
  363   HD21  LEU  41          3HD2      LEU  41  -3.888  -2.691  -1.188
  364   HD22  LEU  41          1HD2      LEU  41  -4.320  -1.303  -2.197
  365   HD23  LEU  41          2HD2      LEU  41  -2.879  -1.248  -1.176
  366    H    ASN  42           H        ASN  42  -3.912  -5.844  -5.554
  367    HA   ASN  42           HA       ASN  42  -6.689  -5.964  -6.077
  368    HB2  ASN  42           2HB      ASN  42  -4.347  -7.445  -7.328
  369    HB3  ASN  42           3HB      ASN  42  -5.998  -7.685  -7.886
  370   HD21  ASN  42          1HD2      ASN  42  -4.622  -4.555  -6.834
  371   HD22  ASN  42          2HD2      ASN  42  -4.731  -3.826  -8.387
  372    H    GLU  43           H        GLU  43  -4.647  -8.206  -4.332
  373    HA   GLU  43           HA       GLU  43  -6.468 -10.400  -4.299
  374    HB2  GLU  43           2HB      GLU  43  -4.170  -9.693  -2.440
  375    HB3  GLU  43           3HB      GLU  43  -5.107 -11.173  -2.290
  376    HG2  GLU  43           2HG      GLU  43  -3.374 -10.375  -4.639
  377    HG3  GLU  43           3HG      GLU  43  -3.005 -11.603  -3.434
  378    H    ARG  44           H        ARG  44  -5.741  -7.799  -1.994
  379    HA   ARG  44           HA       ARG  44  -7.625  -8.716  -0.044
  380    HB2  ARG  44           2HB      ARG  44  -5.433  -7.521   0.464
  381    HB3  ARG  44           3HB      ARG  44  -6.180  -6.033  -0.113
  382    HG2  ARG  44           2HG      ARG  44  -6.261  -6.150   2.335
  383    HG3  ARG  44           3HG      ARG  44  -7.894  -6.194   1.661
  384    HD2  ARG  44           2HD      ARG  44  -7.806  -8.724   1.881
  385    HD3  ARG  44           3HD      ARG  44  -6.292  -8.533   2.766
  386    HE   ARG  44           HE       ARG  44  -8.939  -7.549   3.640
  387   HH11  ARG  44          1HH1      ARG  44  -5.684  -8.586   4.481
  388   HH12  ARG  44          2HH1      ARG  44  -6.003  -8.562   6.188
  389   HH21  ARG  44          1HH2      ARG  44  -9.361  -7.644   5.838
  390   HH22  ARG  44          2HH2      ARG  44  -8.084  -8.030   6.949
  391    H    MET  45           H        MET  45  -7.742  -6.366  -2.645
  392    HA   MET  45           HA       MET  45  -9.957  -4.856  -1.542
  393    HB2  MET  45           2HB      MET  45  -8.582  -4.666  -4.257
  394    HB3  MET  45           3HB      MET  45  -9.852  -3.577  -3.711
  395    HG2  MET  45           2HG      MET  45  -7.114  -3.884  -2.449
  396    HG3  MET  45           3HG      MET  45  -7.649  -2.551  -3.467
  397    HE1  MET  45           3HE      MET  45 -10.294  -0.801  -1.162
  398    HE2  MET  45           1HE      MET  45 -10.604  -2.011  -2.406
  399    HE3  MET  45           2HE      MET  45  -9.432  -0.725  -2.699
  400    H    ASP  46           H        ASP  46  -9.716  -7.755  -3.327
  401    HA   ASP  46           HA       ASP  46 -12.021  -7.437  -4.970
  402    HB2  ASP  46           2HB      ASP  46 -10.109  -9.047  -5.452
  403    HB3  ASP  46           3HB      ASP  46 -10.791 -10.119  -4.234
  404    HA   PRO  47           HA       PRO  47 -14.476  -9.921  -1.464
  405    HB2  PRO  47           2HB      PRO  47 -13.373  -9.724   1.097
  406    HB3  PRO  47           3HB      PRO  47 -13.156 -11.116   0.018
  407    HG2  PRO  47           2HG      PRO  47 -11.308  -8.787   0.455
  408    HG3  PRO  47           3HG      PRO  47 -10.932 -10.526   0.396
  409    HD2  PRO  47           2HD      PRO  47 -10.473  -8.989  -1.735
  410    HD3  PRO  47           3HD      PRO  47 -11.138 -10.627  -1.947
  411    H    ILE  48           H        ILE  48 -12.716  -6.934  -0.964
  412    HA   ILE  48           HA       ILE  48 -14.408  -5.652   0.910
  413    HB   ILE  48           HB       ILE  48 -12.574  -4.438  -1.196
  414   HG12  ILE  48          2HG1      ILE  48 -11.380  -5.998   0.297
  415   HG13  ILE  48          3HG1      ILE  48 -10.859  -4.346   0.572
  416   HG21  ILE  48          1HG2      ILE  48 -12.462  -2.446   0.239
  417   HG22  ILE  48          2HG2      ILE  48 -13.660  -3.152   1.324
  418   HG23  ILE  48          3HG2      ILE  48 -14.105  -2.741  -0.332
  419   HD11  ILE  48          3HD1      ILE  48 -11.023  -5.571   2.645
  420   HD12  ILE  48          1HD1      ILE  48 -12.717  -5.944   2.339
  421   HD13  ILE  48          2HD1      ILE  48 -12.216  -4.275   2.626
  422    H    LYS  49           H        LYS  49 -14.469  -5.720  -2.657
  423    HA   LYS  49           HA       LYS  49 -16.560  -3.864  -3.108
  424    HB2  LYS  49           2HB      LYS  49 -15.809  -6.323  -4.733
  425    HB3  LYS  49           3HB      LYS  49 -16.853  -5.024  -5.300
  426    HG2  LYS  49           2HG      LYS  49 -15.030  -3.456  -5.328
  427    HG3  LYS  49           3HG      LYS  49 -13.954  -4.589  -4.506
  428    HD2  LYS  49           2HD      LYS  49 -15.129  -4.993  -7.295
  429    HD3  LYS  49           3HD      LYS  49 -13.488  -4.441  -6.955
  430    HE2  LYS  49           2HE      LYS  49 -12.972  -6.564  -5.850
  431    HE3  LYS  49           3HE      LYS  49 -14.625  -7.122  -6.083
  432    HZ1  LYS  49           3HZ      LYS  49 -13.031  -8.053  -7.686
  433    HZ2  LYS  49           1HZ      LYS  49 -12.734  -6.502  -8.286
  434    HZ3  LYS  49           2HZ      LYS  49 -14.272  -7.183  -8.433
  435    H    LYS  50           H        LYS  50 -16.562  -7.300  -2.266
  436    HA   LYS  50           HA       LYS  50 -19.388  -7.735  -2.496
  437    HB2  LYS  50           2HB      LYS  50 -17.735  -9.587  -2.665
  438    HB3  LYS  50           3HB      LYS  50 -17.299  -9.349  -0.974
  439    HG2  LYS  50           2HG      LYS  50 -19.635  -9.931  -0.318
  440    HG3  LYS  50           3HG      LYS  50 -20.019 -10.231  -2.013
  441    HD2  LYS  50           2HD      LYS  50 -17.986 -11.748  -0.341
  442    HD3  LYS  50           3HD      LYS  50 -19.582 -12.328  -0.808
  443    HE2  LYS  50           2HE      LYS  50 -18.883 -12.199  -3.203
  444    HE3  LYS  50           3HE      LYS  50 -17.263 -11.732  -2.672
  445    HZ1  LYS  50           3HZ      LYS  50 -18.639 -14.269  -1.992
  446    HZ2  LYS  50           1HZ      LYS  50 -17.079 -13.835  -1.513
  447    HZ3  LYS  50           2HZ      LYS  50 -17.425 -14.090  -3.147
  448    H    LEU  51           H        LEU  51 -17.231  -6.678   0.131
  449    HA   LEU  51           HA       LEU  51 -19.143  -6.806   2.237
  450    HB2  LEU  51           2HB      LEU  51 -16.777  -4.905   1.947
  451    HB3  LEU  51           3HB      LEU  51 -17.660  -5.215   3.435
  452    HG   LEU  51           HG       LEU  51 -15.904  -7.206   1.944
  453   HD11  LEU  51          1HD1      LEU  51 -14.620  -5.498   3.136
  454   HD12  LEU  51          2HD1      LEU  51 -14.432  -7.076   3.892
  455   HD13  LEU  51          3HD1      LEU  51 -15.485  -5.865   4.632
  456   HD21  LEU  51          3HD2      LEU  51 -17.473  -7.618   4.507
  457   HD22  LEU  51          1HD2      LEU  51 -16.299  -8.748   3.824
  458   HD23  LEU  51          2HD2      LEU  51 -17.787  -8.390   2.952
  459    H    GLY  52           H        GLY  52 -18.503  -4.528  -0.342
  460    HA2  GLY  52           2HA      GLY  52 -20.151  -3.333  -1.452
  461    HA3  GLY  52           3HA      GLY  52 -21.257  -3.591  -0.111
  462    H    CYS  53           H        CYS  53 -18.012  -2.175  -0.212
  463    HA   CYS  53           HA       CYS  53 -19.092   0.443   0.685
  464    HB2  CYS  53           2HB      CYS  53 -16.822   0.768   1.724
  465    HB3  CYS  53           3HB      CYS  53 -17.719  -0.579   2.428
  466    H    LYS  54           H        LYS  54 -19.224   1.656  -1.133
  467    HA   LYS  54           HA       LYS  54 -17.323   1.433  -3.297
  468    HB2  LYS  54           2HB      LYS  54 -19.814   2.081  -3.567
  469    HB3  LYS  54           3HB      LYS  54 -19.358   3.680  -2.982
  470    HG2  LYS  54           2HG      LYS  54 -17.687   3.827  -4.867
  471    HG3  LYS  54           3HG      LYS  54 -18.309   2.295  -5.482
  472    HD2  LYS  54           2HD      LYS  54 -20.562   3.362  -5.755
  473    HD3  LYS  54           3HD      LYS  54 -19.871   4.892  -5.201
  474    HE2  LYS  54           2HE      LYS  54 -18.237   4.755  -7.129
  475    HE3  LYS  54           3HE      LYS  54 -19.141   3.359  -7.718
  476    HZ1  LYS  54           3HZ      LYS  54 -19.868   5.332  -8.844
  477    HZ2  LYS  54           1HZ      LYS  54 -20.175   6.122  -7.379
  478    HZ3  LYS  54           2HZ      LYS  54 -21.118   4.800  -7.839
  479    H    ARG  55           H        ARG  55 -17.413   3.159  -0.331
  480    HA   ARG  55           HA       ARG  55 -15.028   4.724  -1.185
  481    HB2  ARG  55           2HB      ARG  55 -16.877   6.174  -0.347
  482    HB3  ARG  55           3HB      ARG  55 -16.915   5.270   1.166
  483    HG2  ARG  55           2HG      ARG  55 -14.552   6.000   1.619
  484    HG3  ARG  55           3HG      ARG  55 -14.598   6.962   0.144
  485    HD2  ARG  55           2HD      ARG  55 -16.407   8.343   1.087
  486    HD3  ARG  55           3HD      ARG  55 -16.408   7.362   2.555
  487    HE   ARG  55           HE       ARG  55 -14.021   8.891   1.704
  488   HH11  ARG  55          1HH1      ARG  55 -16.381   8.127   4.187
  489   HH12  ARG  55          2HH1      ARG  55 -15.578   9.060   5.408
  490   HH21  ARG  55          1HH2      ARG  55 -13.000  10.146   3.294
  491   HH22  ARG  55          2HH2      ARG  55 -13.660  10.203   4.901
  492    H    VAL  56           H        VAL  56 -13.160   4.073  -0.335
  493    HA   VAL  56           HA       VAL  56 -13.077   2.496   2.172
  494    HB   VAL  56           HB       VAL  56 -11.228   1.116   1.187
  495   HG11  VAL  56          1HG1      VAL  56 -12.627  -0.353  -0.217
  496   HG12  VAL  56          2HG1      VAL  56 -13.836   0.927  -0.370
  497   HG13  VAL  56          3HG1      VAL  56 -13.508   0.203   1.207
  498   HG21  VAL  56          3HG2      VAL  56 -10.443   2.646  -0.582
  499   HG22  VAL  56          1HG2      VAL  56 -11.957   2.434  -1.466
  500   HG23  VAL  56          2HG2      VAL  56 -10.850   1.074  -1.267
  501    H    ARG  57           H        ARG  57 -11.422   3.067   3.558
  502    HA   ARG  57           HA       ARG  57  -9.396   5.039   2.636
  503    HB2  ARG  57           2HB      ARG  57 -10.861   6.065   4.291
  504    HB3  ARG  57           3HB      ARG  57 -10.644   4.713   5.398
  505    HG2  ARG  57           2HG      ARG  57  -8.312   5.311   5.765
  506    HG3  ARG  57           3HG      ARG  57  -8.395   6.569   4.532
  507    HD2  ARG  57           2HD      ARG  57 -10.066   6.590   7.065
  508    HD3  ARG  57           3HD      ARG  57  -8.496   7.383   6.925
  509    HE   ARG  57           HE       ARG  57  -9.792   8.465   4.863
  510   HH11  ARG  57          1HH1      ARG  57 -10.821   8.109   8.212
  511   HH12  ARG  57          2HH1      ARG  57 -11.821   9.527   8.175
  512   HH21  ARG  57          1HH2      ARG  57 -11.073  10.284   4.803
  513   HH22  ARG  57          2HH2      ARG  57 -11.966  10.781   6.215
  514    H    ILE  58           H        ILE  58  -7.581   4.009   2.297
  515    HA   ILE  58           HA       ILE  58  -6.745   1.685   3.906
  516    HB   ILE  58           HB       ILE  58  -5.668   2.567   1.180
  517   HG12  ILE  58          2HG1      ILE  58  -7.743   0.398   1.746
  518   HG13  ILE  58          3HG1      ILE  58  -8.092   1.956   1.009
  519   HG21  ILE  58          1HG2      ILE  58  -4.103   1.168   2.475
  520   HG22  ILE  58          2HG2      ILE  58  -4.711   0.283   1.078
  521   HG23  ILE  58          3HG2      ILE  58  -5.352  -0.062   2.684
  522   HD11  ILE  58          3HD1      ILE  58  -6.369  -0.224  -0.158
  523   HD12  ILE  58          1HD1      ILE  58  -6.667   1.353  -0.897
  524   HD13  ILE  58          2HD1      ILE  58  -8.000   0.225  -0.652
  525    H    SER  59           H        SER  59  -5.469   2.484   5.596
  526    HA   SER  59           HA       SER  59  -3.398   4.498   5.103
  527    HB2  SER  59           2HB      SER  59  -4.320   3.223   7.720
  528    HB3  SER  59           3HB      SER  59  -3.192   4.571   7.560
  529    HG   SER  59           HG       SER  59  -4.853   5.825   6.724
  530    H    ILE  60           H        ILE  60  -1.648   3.510   4.168
  531    HA   ILE  60           HA       ILE  60  -0.772   0.854   5.107
  532    HB   ILE  60           HB       ILE  60   0.061   2.493   2.679
  533   HG12  ILE  60          2HG1      ILE  60  -1.492  -0.117   2.974
  534   HG13  ILE  60          3HG1      ILE  60  -2.144   1.431   2.450
  535   HG21  ILE  60          1HG2      ILE  60   1.484   0.585   1.996
  536   HG22  ILE  60          2HG2      ILE  60   1.139  -0.215   3.530
  537   HG23  ILE  60          3HG2      ILE  60   2.043   1.300   3.510
  538   HD11  ILE  60          3HD1      ILE  60  -1.893  -0.033   0.581
  539   HD12  ILE  60          1HD1      ILE  60  -0.192  -0.306   0.950
  540   HD13  ILE  60          2HD1      ILE  60  -0.738   1.290   0.423
  541    H    ARG  61           H        ARG  61   0.856   0.648   6.491
  542    HA   ARG  61           HA       ARG  61   2.745   2.878   6.998
  543    HB2  ARG  61           2HB      ARG  61   1.897   0.628   8.897
  544    HB3  ARG  61           3HB      ARG  61   3.060   1.894   9.262
  545    HG2  ARG  61           2HG      ARG  61   1.110   2.565  10.372
  546    HG3  ARG  61           3HG      ARG  61   1.122   3.560   8.916
  547    HD2  ARG  61           2HD      ARG  61  -1.137   2.694   9.419
  548    HD3  ARG  61           3HD      ARG  61  -0.545   2.069   7.879
  549    HE   ARG  61           HE       ARG  61  -0.487  -0.061   8.765
  550   HH11  ARG  61          1HH1      ARG  61  -1.138   2.189  11.391
  551   HH12  ARG  61          2HH1      ARG  61  -1.554   0.937  12.523
  552   HH21  ARG  61          1HH2      ARG  61  -1.035  -1.700  10.266
  553   HH22  ARG  61          2HH2      ARG  61  -1.499  -1.267  11.884
  554    H    VAL  62           H        VAL  62   4.788   2.424   6.340
  555    HA   VAL  62           HA       VAL  62   5.386  -0.313   5.426
  556    HB   VAL  62           HB       VAL  62   5.653   1.641   3.851
  557   HG11  VAL  62          1HG1      VAL  62   6.518   3.351   5.395
  558   HG12  VAL  62          2HG1      VAL  62   7.596   3.128   4.013
  559   HG13  VAL  62          3HG1      VAL  62   8.013   2.422   5.579
  560   HG21  VAL  62          3HG2      VAL  62   8.209   0.116   4.406
  561   HG22  VAL  62          1HG2      VAL  62   7.792   0.927   2.891
  562   HG23  VAL  62          2HG2      VAL  62   6.843  -0.454   3.444
  563    H    LYS  63           H        LYS  63   6.953  -1.585   6.402
  564    HA   LYS  63           HA       LYS  63   8.146  -0.548   8.889
  565    HB2  LYS  63           2HB      LYS  63   7.685  -3.391   7.916
  566    HB3  LYS  63           3HB      LYS  63   8.581  -3.000   9.381
  567    HG2  LYS  63           2HG      LYS  63   6.548  -1.893  10.300
  568    HG3  LYS  63           3HG      LYS  63   5.666  -2.349   8.843
  569    HD2  LYS  63           2HD      LYS  63   5.166  -3.867  10.727
  570    HD3  LYS  63           3HD      LYS  63   5.923  -4.721   9.386
  571    HE2  LYS  63           2HE      LYS  63   8.098  -4.651  10.610
  572    HE3  LYS  63           3HE      LYS  63   7.290  -3.851  11.961
  573    HZ1  LYS  63           3HZ      LYS  63   7.498  -6.213  12.360
  574    HZ2  LYS  63           1HZ      LYS  63   6.667  -6.574  10.928
  575    HZ3  LYS  63           2HZ      LYS  63   5.868  -5.805  12.206
  576    H    HIS  64           H        HIS  64  10.348  -0.582   9.183
  577    HA   HIS  64           HA       HIS  64  11.727  -0.252   6.601
  578    HB2  HIS  64           2HB      HIS  64  12.060   1.148   9.274
  579    HB3  HIS  64           3HB      HIS  64  13.156   1.402   7.916
  580    HD1  HIS  64           HD1      HIS  64  11.864   2.149   5.627
  581    HD2  HIS  64           HD2      HIS  64   9.938   2.906   9.222
  582    HE1  HIS  64           HE1      HIS  64  10.255   4.018   5.141
  583    HE2  HIS  64           HE2      HIS  64   9.333   4.616   7.394
  584    H    SER  65           H        SER  65  13.880  -0.553   6.371
  585    HA   SER  65           HA       SER  65  15.024  -2.938   7.387
  586    HB2  SER  65           2HB      SER  65  15.401  -2.073   5.084
  587    HB3  SER  65           3HB      SER  65  16.262  -0.681   5.742
  588    HG   SER  65           HG       SER  65  17.934  -1.935   5.498
  589    H    ASP  66           H        ASP  66  15.817   0.546   7.844
  590    HA   ASP  66           HA       ASP  66  16.904   0.092  10.487
  591    HB2  ASP  66           2HB      ASP  66  18.811  -0.594   8.951
  592    HB3  ASP  66           3HB      ASP  66  18.839   1.043   8.315
  593    H    ALA  67           H        ALA  67  17.606   2.119  11.530
  594    HA   ALA  67           HA       ALA  67  15.863   4.298  11.152
  595    HB1  ALA  67           3HB      ALA  67  17.207   5.438  12.874
  596    HB2  ALA  67           1HB      ALA  67  18.490   4.234  12.689
  597    HB3  ALA  67           2HB      ALA  67  16.914   3.757  13.321
  598    H    ALA  68           H        ALA  68  19.187   3.788  10.094
  599    HA   ALA  68           HA       ALA  68  19.666   6.390   9.053
  600    HB1  ALA  68           3HB      ALA  68  21.593   5.344   7.930
  601    HB2  ALA  68           1HB      ALA  68  20.966   3.742   8.347
  602    HB3  ALA  68           2HB      ALA  68  21.482   4.850   9.619
  603    H    GLU  69           H        GLU  69  18.336   3.431   7.699
  604    HA   GLU  69           HA       GLU  69  18.406   4.338   4.951
  605    HB2  GLU  69           2HB      GLU  69  17.322   1.800   6.237
  606    HB3  GLU  69           3HB      GLU  69  17.347   2.088   4.500
  607    HG2  GLU  69           2HG      GLU  69  19.809   2.220   4.547
  608    HG3  GLU  69           3HG      GLU  69  19.798   1.962   6.288
  609    H    GLU  70           H        GLU  70  16.082   4.434   7.557
  610    HA   GLU  70           HA       GLU  70  13.721   3.896   6.099
  611    HB2  GLU  70           2HB      GLU  70  12.485   4.620   8.038
  612    HB3  GLU  70           3HB      GLU  70  13.880   3.686   8.554
  613    HG2  GLU  70           2HG      GLU  70  15.027   5.691   9.275
  614    HG3  GLU  70           3HG      GLU  70  13.757   6.713   8.604
  615    H    LYS  71           H        LYS  71  15.335   6.946   6.769
  616    HA   LYS  71           HA       LYS  71  13.314   8.697   5.822
  617    HB2  LYS  71           2HB      LYS  71  15.143  10.416   5.807
  618    HB3  LYS  71           3HB      LYS  71  14.967   9.549   7.326
  619    HG2  LYS  71           2HG      LYS  71  16.902   8.083   6.658
  620    HG3  LYS  71           3HG      LYS  71  17.131   9.117   5.241
  621    HD2  LYS  71           2HD      LYS  71  17.480  11.078   6.750
  622    HD3  LYS  71           3HD      LYS  71  17.280  10.021   8.150
  623    HE2  LYS  71           2HE      LYS  71  19.654  10.458   7.716
  624    HE3  LYS  71           3HE      LYS  71  19.288   8.748   7.483
  625    HZ1  LYS  71           3HZ      LYS  71  19.263   9.104   5.121
  626    HZ2  LYS  71           1HZ      LYS  71  20.725   9.648   5.756
  627    HZ3  LYS  71           2HZ      LYS  71  19.536  10.757   5.312
  628    H    LYS  72           H        LYS  72  15.662   6.784   4.121
  629    HA   LYS  72           HA       LYS  72  15.163   8.083   1.555
  630    HB2  LYS  72           2HB      LYS  72  17.362   7.040   2.049
  631    HB3  LYS  72           3HB      LYS  72  16.588   5.468   2.208
  632    HG2  LYS  72           2HG      LYS  72  15.979   5.475  -0.155
  633    HG3  LYS  72           3HG      LYS  72  16.601   7.117  -0.347
  634    HD2  LYS  72           2HD      LYS  72  18.251   4.660   0.361
  635    HD3  LYS  72           3HD      LYS  72  18.192   5.442  -1.217
  636    HE2  LYS  72           2HE      LYS  72  19.234   7.450  -0.322
  637    HE3  LYS  72           3HE      LYS  72  19.168   6.806   1.319
  638    HZ1  LYS  72           3HZ      LYS  72  20.715   5.081   0.684
  639    HZ2  LYS  72           1HZ      LYS  72  21.369   6.597   0.324
  640    HZ3  LYS  72           2HZ      LYS  72  20.743   5.632  -0.911
  641    H    GLU  73           H        GLU  73  14.379   5.010   3.171
  642    HA   GLU  73           HA       GLU  73  13.106   3.622   1.145
  643    HB2  GLU  73           2HB      GLU  73  12.556   3.523   4.139
  644    HB3  GLU  73           3HB      GLU  73  11.940   2.340   2.991
  645    HG2  GLU  73           2HG      GLU  73  14.222   1.616   2.468
  646    HG3  GLU  73           3HG      GLU  73  14.879   2.851   3.544
  647    H    ALA  74           H        ALA  74  11.621   5.765   3.562
  648    HA   ALA  74           HA       ALA  74   8.919   5.351   2.916
  649    HB1  ALA  74           3HB      ALA  74   8.530   7.380   4.240
  650    HB2  ALA  74           1HB      ALA  74  10.251   7.789   4.144
  651    HB3  ALA  74           2HB      ALA  74   9.728   6.348   5.017
  652    H    LYS  75           H        LYS  75  11.138   7.934   1.902
  653    HA   LYS  75           HA       LYS  75   9.214   9.402   0.390
  654    HB2  LYS  75           2HB      LYS  75  12.245   9.559   0.567
  655    HB3  LYS  75           3HB      LYS  75  11.333  10.595  -0.526
  656    HG2  LYS  75           2HG      LYS  75  11.811  11.835   1.485
  657    HG3  LYS  75           3HG      LYS  75  10.078  11.510   1.438
  658    HD2  LYS  75           2HD      LYS  75  10.511   9.555   3.009
  659    HD3  LYS  75           3HD      LYS  75  12.174  10.120   3.140
  660    HE2  LYS  75           2HE      LYS  75  10.993  10.954   5.039
  661    HE3  LYS  75           3HE      LYS  75  11.264  12.328   3.968
  662    HZ1  LYS  75           3HZ      LYS  75   9.021  12.297   4.853
  663    HZ2  LYS  75           1HZ      LYS  75   8.739  10.776   4.179
  664    HZ3  LYS  75           2HZ      LYS  75   8.996  12.112   3.175
  665    H    LYS  76           H        LYS  76  11.638   6.973  -0.478
  666    HA   LYS  76           HA       LYS  76  11.246   6.934  -3.280
  667    HB2  LYS  76           2HB      LYS  76  13.128   5.756  -2.200
  668    HB3  LYS  76           3HB      LYS  76  12.008   4.689  -1.358
  669    HG2  LYS  76           2HG      LYS  76  11.236   3.937  -3.721
  670    HG3  LYS  76           3HG      LYS  76  12.693   4.738  -4.311
  671    HD2  LYS  76           2HD      LYS  76  12.611   2.486  -2.272
  672    HD3  LYS  76           3HD      LYS  76  13.027   2.312  -3.974
  673    HE2  LYS  76           2HE      LYS  76  15.014   3.729  -3.643
  674    HE3  LYS  76           3HE      LYS  76  14.595   3.932  -1.937
  675    HZ1  LYS  76           3HZ      LYS  76  16.264   2.200  -2.292
  676    HZ2  LYS  76           1HZ      LYS  76  15.181   1.332  -3.257
  677    HZ3  LYS  76           2HZ      LYS  76  14.853   1.564  -1.612
  678    H    PHE  77           H        PHE  77   9.654   5.214  -0.602
  679    HA   PHE  77           HA       PHE  77   8.049   3.463  -2.206
  680    HB2  PHE  77           2HB      PHE  77   8.935   3.123   0.218
  681    HB3  PHE  77           3HB      PHE  77   7.602   4.139   0.738
  682    HD1  PHE  77           HD1      PHE  77   8.266   1.043  -1.311
  683    HD2  PHE  77           HD2      PHE  77   5.594   3.050   1.355
  684    HE1  PHE  77           HE1      PHE  77   6.859  -0.968  -1.181
  685    HE2  PHE  77           HE2      PHE  77   4.198   1.035   1.473
  686    HZ   PHE  77           HZ       PHE  77   4.829  -0.978   0.211
  687    H    ALA  78           H        ALA  78   7.743   6.665  -0.976
  688    HA   ALA  78           HA       ALA  78   4.969   7.091  -1.162
  689    HB1  ALA  78           3HB      ALA  78   5.557   9.481  -1.264
  690    HB2  ALA  78           1HB      ALA  78   7.247   9.058  -1.566
  691    HB3  ALA  78           2HB      ALA  78   6.494   8.647  -0.024
  692    H    ALA  79           H        ALA  79   7.606   7.616  -3.506
  693    HA   ALA  79           HA       ALA  79   5.987   8.386  -5.706
  694    HB1  ALA  79           3HB      ALA  79   8.029   8.039  -7.040
  695    HB2  ALA  79           1HB      ALA  79   8.784   7.197  -5.679
  696    HB3  ALA  79           2HB      ALA  79   8.388   8.910  -5.549
  697    H    ILE  80           H        ILE  80   7.329   5.267  -4.654
  698    HA   ILE  80           HA       ILE  80   6.627   3.649  -6.828
  699    HB   ILE  80           HB       ILE  80   6.957   2.926  -3.883
  700   HG12  ILE  80          2HG1      ILE  80   9.025   3.808  -4.876
  701   HG13  ILE  80          3HG1      ILE  80   9.207   2.093  -4.567
  702   HG21  ILE  80          1HG2      ILE  80   7.229   0.579  -4.557
  703   HG22  ILE  80          2HG2      ILE  80   6.850   1.007  -6.221
  704   HG23  ILE  80          3HG2      ILE  80   5.620   1.177  -4.973
  705   HD11  ILE  80          3HD1      ILE  80  10.227   2.714  -6.669
  706   HD12  ILE  80          1HD1      ILE  80   8.704   3.368  -7.264
  707   HD13  ILE  80          2HD1      ILE  80   8.867   1.634  -6.968
  708    H    LEU  81           H        LEU  81   4.813   4.254  -3.777
  709    HA   LEU  81           HA       LEU  81   2.528   2.712  -4.495
  710    HB2  LEU  81           2HB      LEU  81   3.045   4.776  -2.335
  711    HB3  LEU  81           3HB      LEU  81   1.415   4.179  -2.602
  712    HG   LEU  81           HG       LEU  81   3.816   2.490  -1.774
  713   HD11  LEU  81          1HD1      LEU  81   2.594   2.185   0.329
  714   HD12  LEU  81          2HD1      LEU  81   1.302   3.244  -0.243
  715   HD13  LEU  81          3HD1      LEU  81   2.920   3.892   0.034
  716   HD21  LEU  81          3HD2      LEU  81   2.221   0.609  -1.590
  717   HD22  LEU  81          1HD2      LEU  81   2.352   1.181  -3.252
  718   HD23  LEU  81          2HD2      LEU  81   0.945   1.613  -2.280
  719    H    ASN  82           H        ASN  82   3.358   6.125  -4.907
  720    HA   ASN  82           HA       ASN  82   0.824   7.173  -5.607
  721    HB2  ASN  82           2HB      ASN  82   2.711   8.643  -5.046
  722    HB3  ASN  82           3HB      ASN  82   3.627   8.075  -6.439
  723   HD21  ASN  82          1HD2      ASN  82   3.066   8.825  -8.499
  724   HD22  ASN  82          2HD2      ASN  82   2.031  10.186  -8.740
  725    H    LYS  83           H        LYS  83   3.347   5.604  -7.507
  726    HA   LYS  83           HA       LYS  83   2.058   5.811 -10.047
  727    HB2  LYS  83           2HB      LYS  83   4.222   3.892  -9.089
  728    HB3  LYS  83           3HB      LYS  83   3.716   4.069 -10.765
  729    HG2  LYS  83           2HG      LYS  83   5.036   6.198  -9.058
  730    HG3  LYS  83           3HG      LYS  83   5.794   5.287 -10.366
  731    HD2  LYS  83           2HD      LYS  83   4.298   6.345 -12.008
  732    HD3  LYS  83           3HD      LYS  83   3.434   7.180 -10.715
  733    HE2  LYS  83           2HE      LYS  83   4.977   8.709 -11.834
  734    HE3  LYS  83           3HE      LYS  83   5.480   8.452 -10.165
  735    HZ1  LYS  83           3HZ      LYS  83   7.157   6.908 -10.944
  736    HZ2  LYS  83           1HZ      LYS  83   7.341   8.413 -11.696
  737    HZ3  LYS  83           2HZ      LYS  83   6.658   7.123 -12.546
  738    H    VAL  84           H        VAL  84   2.202   3.244  -7.566
  739    HA   VAL  84           HA       VAL  84   1.013   1.151  -9.040
  740    HB   VAL  84           HB       VAL  84   1.384   1.649  -6.055
  741   HG11  VAL  84          1HG1      VAL  84  -0.660   0.327  -6.154
  742   HG12  VAL  84          2HG1      VAL  84   0.666  -0.697  -5.602
  743   HG13  VAL  84          3HG1      VAL  84   0.091  -0.819  -7.265
  744   HG21  VAL  84          3HG2      VAL  84   2.632  -0.382  -7.948
  745   HG22  VAL  84          1HG2      VAL  84   3.016  -0.207  -6.233
  746   HG23  VAL  84          2HG2      VAL  84   3.399   1.094  -7.362
  747    H    PHE  85           H        PHE  85  -0.417   3.236  -6.544
  748    HA   PHE  85           HA       PHE  85  -3.088   2.390  -6.754
  749    HB2  PHE  85           2HB      PHE  85  -1.934   5.030  -5.785
  750    HB3  PHE  85           3HB      PHE  85  -3.648   4.642  -5.674
  751    HD1  PHE  85           HD1      PHE  85  -4.111   2.189  -4.593
  752    HD2  PHE  85           HD2      PHE  85  -0.684   4.626  -3.830
  753    HE1  PHE  85           HE1      PHE  85  -3.783   1.060  -2.434
  754    HE2  PHE  85           HE2      PHE  85  -0.362   3.486  -1.681
  755    HZ   PHE  85           HZ       PHE  85  -1.915   1.715  -0.981
  756    H    ALA  86           H        ALA  86  -1.357   4.886  -8.572
  757    HA   ALA  86           HA       ALA  86  -3.648   5.966  -9.915
  758    HB1  ALA  86           3HB      ALA  86  -2.030   7.137 -11.335
  759    HB2  ALA  86           1HB      ALA  86  -0.722   6.144 -10.680
  760    HB3  ALA  86           2HB      ALA  86  -1.588   7.266  -9.632
  761    H    GLU  87           H        GLU  87  -1.605   3.217 -10.471
  762    HA   GLU  87           HA       GLU  87  -2.522   2.703 -13.195
  763    HB2  GLU  87           2HB      GLU  87  -0.800   1.075 -11.263
  764    HB3  GLU  87           3HB      GLU  87  -1.191   0.558 -12.902
  765    HG2  GLU  87           2HG      GLU  87   0.009   2.462 -13.843
  766    HG3  GLU  87           3HG      GLU  87   0.311   3.106 -12.229
  767    H    LEU  88           H        LEU  88  -3.905   2.347 -10.164
  768    HA   LEU  88           HA       LEU  88  -5.404  -0.115 -10.879
  769    HB2  LEU  88           2HB      LEU  88  -5.147   1.248  -8.161
  770    HB3  LEU  88           3HB      LEU  88  -6.028  -0.236  -8.487
  771    HG   LEU  88           HG       LEU  88  -3.018   0.146  -8.595
  772   HD11  LEU  88          1HD1      LEU  88  -3.905  -0.059  -6.338
  773   HD12  LEU  88          2HD1      LEU  88  -2.971  -1.488  -6.767
  774   HD13  LEU  88          3HD1      LEU  88  -4.736  -1.556  -6.771
  775   HD21  LEU  88          3HD2      LEU  88  -3.593  -1.345 -10.425
  776   HD22  LEU  88          1HD2      LEU  88  -4.599  -2.330  -9.359
  777   HD23  LEU  88          2HD2      LEU  88  -2.850  -2.275  -9.126
  778    H    GLY  89           H        GLY  89  -5.735   3.314 -10.107
  779    HA2  GLY  89           2HA      GLY  89  -7.753   4.127 -11.528
  780    HA3  GLY  89           3HA      GLY  89  -8.681   3.189 -10.368
  781    H    TYR  90           H        TYR  90  -6.346   4.267  -8.400
  782    HA   TYR  90           HA       TYR  90  -7.883   6.473  -7.351
  783    HB2  TYR  90           2HB      TYR  90  -5.109   5.464  -6.593
  784    HB3  TYR  90           3HB      TYR  90  -6.018   6.668  -5.690
  785    HD1  TYR  90           HD2      TYR  90  -8.218   5.974  -4.570
  786    HD2  TYR  90           HD1      TYR  90  -5.499   3.109  -6.218
  787    HE1  TYR  90           HE2      TYR  90  -9.275   4.196  -3.237
  788    HE2  TYR  90           HE1      TYR  90  -6.555   1.334  -4.879
  789    HH   TYR  90           HH       TYR  90  -9.527   1.741  -3.289
  790    H    ASN  91           H        ASN  91  -7.636   8.632  -7.759
  791    HA   ASN  91           HA       ASN  91  -5.691   9.439  -9.826
  792    HB2  ASN  91           2HB      ASN  91  -8.229  10.827  -8.850
  793    HB3  ASN  91           3HB      ASN  91  -7.149  11.491 -10.067
  794   HD21  ASN  91          1HD2      ASN  91  -8.460   8.195  -9.623
  795   HD22  ASN  91          2HD2      ASN  91  -9.239   8.139 -11.153
  796    H    ASP  92           H        ASP  92  -3.844   9.679  -8.429
  797    HA   ASP  92           HA       ASP  92  -2.257  10.953  -7.457
  798    HB2  ASP  92           2HB      ASP  92  -2.614  12.408  -9.325
  799    HB3  ASP  92           3HB      ASP  92  -4.070  13.092  -8.617
  800    H    SER  93           H        SER  93  -4.907  13.184  -6.579
  801    HA   SER  93           HA       SER  93  -3.868  13.713  -4.002
  802    HB2  SER  93           2HB      SER  93  -6.632  14.320  -5.104
  803    HB3  SER  93           3HB      SER  93  -5.868  15.108  -3.719
  804    HG   SER  93           HG       SER  93  -4.163  15.303  -5.721
  805    H    ASN  94           H        ASN  94  -5.970  11.164  -5.066
  806    HA   ASN  94           HA       ASN  94  -7.241  10.339  -2.718
  807    HB2  ASN  94           2HB      ASN  94  -5.929   8.682  -4.926
  808    HB3  ASN  94           3HB      ASN  94  -6.884   7.958  -3.633
  809   HD21  ASN  94          1HD2      ASN  94  -9.089   7.890  -3.893
  810   HD22  ASN  94          2HD2      ASN  94  -9.940   8.625  -5.206
  811    H    VAL  95           H        VAL  95  -3.874  10.114  -3.660
  812    HA   VAL  95           HA       VAL  95  -3.074   8.458  -1.349
  813    HB   VAL  95           HB       VAL  95  -1.465   9.339  -3.808
  814   HG11  VAL  95          1HG1      VAL  95  -0.831   7.147  -1.795
  815   HG12  VAL  95          2HG1      VAL  95  -0.022   8.713  -1.905
  816   HG13  VAL  95          3HG1      VAL  95   0.120   7.553  -3.227
  817   HG21  VAL  95          3HG2      VAL  95  -3.387   7.964  -4.492
  818   HG22  VAL  95          1HG2      VAL  95  -2.891   6.693  -3.370
  819   HG23  VAL  95          2HG2      VAL  95  -1.868   7.103  -4.749
  820    H    THR  96           H        THR  96  -2.423   9.682   0.465
  821    HA   THR  96           HA       THR  96  -0.417  11.802   0.037
  822    HB   THR  96           HB       THR  96  -2.832  12.212   1.861
  823    HG1  THR  96           HG1      THR  96  -2.259  13.003  -0.758
  824   HG21  THR  96          3HG2      THR  96  -0.807  13.313   2.758
  825   HG22  THR  96          1HG2      THR  96  -1.955  14.513   2.155
  826   HG23  THR  96          2HG2      THR  96  -0.534  14.093   1.199
  827    H    TRP  97           H        TRP  97   1.271  11.565   1.376
  828    HA   TRP  97           HA       TRP  97   1.279   9.478   3.430
  829    HB2  TRP  97           2HB      TRP  97   3.452  11.074   2.027
  830    HB3  TRP  97           3HB      TRP  97   3.825  10.182   3.498
  831    HD1  TRP  97           HD1      TRP  97   2.380   9.439  -0.045
  832    HE1  TRP  97           HE1      TRP  97   3.033   7.030  -0.660
  833    HE3  TRP  97           HE3      TRP  97   4.724   8.078   4.304
  834    HZ2  TRP  97           HZ2      TRP  97   4.397   4.861   0.515
  835    HZ3  TRP  97           HZ3      TRP  97   5.689   5.816   4.467
  836    HH2  TRP  97           HH2      TRP  97   5.526   4.241   2.610
  837    H    ASP  98           H        ASP  98   2.024   9.795   5.554
  838    HA   ASP  98           HA       ASP  98   2.578  12.387   6.679
  839    HB2  ASP  98           2HB      ASP  98   0.068  12.448   6.593
  840    HB3  ASP  98           3HB      ASP  98   0.004  10.967   7.539
  841    H    GLY  99           H        GLY  99   4.466  11.422   7.344
  842    HA2  GLY  99           2HA      GLY  99   5.926  10.388   8.769
  843    HA3  GLY  99           3HA      GLY  99   4.595  10.322   9.914
  844    H    ASP 100           H        ASP 100   5.488   8.723   6.855
  845    HA   ASP 100           HA       ASP 100   5.723   6.595   6.173
  846    HB2  ASP 100           2HB      ASP 100   5.776   5.856   9.128
  847    HB3  ASP 100           3HB      ASP 100   6.114   4.728   7.816
  848    H    THR 101           H        THR 101   2.980   7.753   7.355
  849    HA   THR 101           HA       THR 101   1.424   5.283   6.836
  850    HB   THR 101           HB       THR 101   0.619   7.650   8.601
  851    HG1  THR 101           HG1      THR 101   2.337   6.107   9.369
  852   HG21  THR 101          3HG2      THR 101  -0.729   4.953   8.180
  853   HG22  THR 101          1HG2      THR 101  -1.329   6.511   7.597
  854   HG23  THR 101          2HG2      THR 101  -1.236   6.192   9.328
  855    H    VAL 102           H        VAL 102   0.613   5.458   4.818
  856    HA   VAL 102           HA       VAL 102  -0.098   8.110   3.726
  857    HB   VAL 102           HB       VAL 102   1.460   6.869   2.323
  858   HG11  VAL 102          1HG1      VAL 102  -0.576   4.636   2.164
  859   HG12  VAL 102          2HG1      VAL 102   0.980   4.569   2.990
  860   HG13  VAL 102          3HG1      VAL 102   0.922   4.735   1.233
  861   HG21  VAL 102          3HG2      VAL 102   0.211   6.876   0.180
  862   HG22  VAL 102          1HG2      VAL 102  -0.146   8.291   1.175
  863   HG23  VAL 102          2HG2      VAL 102  -1.304   6.965   1.082
  864    H    THR 103           H        THR 103  -2.187   8.650   3.784
  865    HA   THR 103           HA       THR 103  -4.290   6.641   4.128
  866    HB   THR 103           HB       THR 103  -4.381   9.696   4.245
  867    HG1  THR 103           HG1      THR 103  -3.622   9.330   6.180
  868   HG21  THR 103          3HG2      THR 103  -6.586   8.746   3.606
  869   HG22  THR 103          1HG2      THR 103  -6.618   9.432   5.234
  870   HG23  THR 103          2HG2      THR 103  -6.528   7.683   5.016
  871    H    VAL 104           H        VAL 104  -4.776   5.768   2.217
  872    HA   VAL 104           HA       VAL 104  -5.163   7.418  -0.199
  873    HB   VAL 104           HB       VAL 104  -4.794   4.383  -0.032
  874   HG11  VAL 104          1HG1      VAL 104  -4.493   4.486  -2.491
  875   HG12  VAL 104          2HG1      VAL 104  -4.850   6.213  -2.468
  876   HG13  VAL 104          3HG1      VAL 104  -6.098   5.050  -2.013
  877   HG21  VAL 104          3HG2      VAL 104  -2.538   4.747  -0.933
  878   HG22  VAL 104          1HG2      VAL 104  -2.733   5.534   0.632
  879   HG23  VAL 104          2HG2      VAL 104  -2.772   6.492  -0.850
  880    H    GLU 105           H        GLU 105  -7.261   7.962  -0.381
  881    HA   GLU 105           HA       GLU 105  -9.333   5.917   0.111
  882    HB2  GLU 105           2HB      GLU 105 -10.736   7.579   1.305
  883    HB3  GLU 105           3HB      GLU 105  -9.245   7.222   2.167
  884    HG2  GLU 105           2HG      GLU 105  -8.267   9.347   1.346
  885    HG3  GLU 105           3HG      GLU 105  -9.778   9.705   0.507
  886    H    GLY 106           H        GLY 106 -11.214   6.159  -1.072
  887    HA2  GLY 106           2HA      GLY 106 -12.034   8.182  -2.729
  888    HA3  GLY 106           3HA      GLY 106 -10.836   7.299  -3.673
  889    H    GLN 107           H        GLN 107 -12.525   6.815  -5.132
  890    HA   GLN 107           HA       GLN 107 -14.791   5.232  -4.214
  891    HB2  GLN 107           2HB      GLN 107 -15.643   5.515  -6.532
  892    HB3  GLN 107           3HB      GLN 107 -15.300   7.040  -5.729
  893    HG2  GLN 107           2HG      GLN 107 -13.108   7.118  -6.992
  894    HG3  GLN 107           3HG      GLN 107 -13.651   5.705  -7.897
  895   HE21  GLN 107          1HE2      GLN 107 -12.981   8.285  -8.955
  896   HE22  GLN 107          2HE2      GLN 107 -14.397   8.903  -9.735
  897    H    LEU 108           H        LEU 108 -14.575   3.136  -4.028
  898    HA   LEU 108           HA       LEU 108 -12.894   1.425  -5.615
  899    HB2  LEU 108           2HB      LEU 108 -13.559   1.034  -3.187
  900    HB3  LEU 108           3HB      LEU 108 -15.195   0.702  -3.732
  901    HG   LEU 108           HG       LEU 108 -14.368  -1.286  -4.987
  902   HD11  LEU 108          1HD1      LEU 108 -12.093  -0.611  -5.501
  903   HD12  LEU 108          2HD1      LEU 108 -12.080  -2.134  -4.614
  904   HD13  LEU 108          3HD1      LEU 108 -11.668  -0.631  -3.787
  905   HD21  LEU 108          3HD2      LEU 108 -15.222  -1.563  -2.733
  906   HD22  LEU 108          1HD2      LEU 108 -13.618  -1.262  -2.059
  907   HD23  LEU 108          2HD2      LEU 108 -13.913  -2.701  -3.039
  908    H    GLU 109           H        GLU 109 -14.068  -0.600  -6.615
  909    HA   GLU 109           HA       GLU 109 -15.398  -1.607  -8.115
  910    HB2  GLU 109           2HB      GLU 109 -17.441  -0.549  -7.164
  911    HB3  GLU 109           3HB      GLU 109 -17.163   0.890  -8.138
  912    HG2  GLU 109           2HG      GLU 109 -17.426  -0.517 -10.193
  913    HG3  GLU 109           3HG      GLU 109 -17.823  -1.891  -9.166
  914    H    GLY 110           H        GLY 110 -14.804   1.841  -8.747
  915    HA2  GLY 110           2HA      GLY 110 -14.091   1.581 -11.512
  916    HA3  GLY 110           3HA      GLY 110 -13.660   2.908 -10.436
  917    H    VAL 111           H        VAL 111 -12.308   1.450  -8.450
  918    HA   VAL 111           HA       VAL 111  -9.793   0.684  -9.667
  919    HB   VAL 111           HB       VAL 111 -10.671   0.540  -6.740
  920   HG11  VAL 111          1HG1      VAL 111  -8.795  -0.990  -7.169
  921   HG12  VAL 111          2HG1      VAL 111  -8.253   0.382  -6.201
  922   HG13  VAL 111          3HG1      VAL 111  -7.878   0.317  -7.925
  923   HG21  VAL 111          3HG2      VAL 111 -10.711   2.853  -7.580
  924   HG22  VAL 111          1HG2      VAL 111  -9.054   2.684  -8.168
  925   HG23  VAL 111          2HG2      VAL 111  -9.384   2.639  -6.434
  926    H    ASP 112           H        ASP 112 -10.017  -1.187 -10.823
  927    HA   ASP 112           HA       ASP 112 -10.416  -3.742  -9.595
  928    HB2  ASP 112           2HB      ASP 112 -12.810  -2.980  -9.767
  929    HB3  ASP 112           3HB      ASP 112 -12.609  -2.738 -11.496
  930    H    LEU 113           H        LEU 113  -9.239  -5.156 -10.823
  931    HA   LEU 113           HA       LEU 113  -8.799  -4.595 -13.712
  932    HB2  LEU 113           2HB      LEU 113  -6.880  -5.963 -11.771
  933    HB3  LEU 113           3HB      LEU 113  -6.608  -5.745 -13.493
  934    HG   LEU 113           HG       LEU 113  -6.714  -3.549 -11.392
  935   HD11  LEU 113          1HD1      LEU 113  -4.408  -4.542 -13.098
  936   HD12  LEU 113          2HD1      LEU 113  -4.631  -4.834 -11.370
  937   HD13  LEU 113          3HD1      LEU 113  -4.358  -3.196 -11.954
  938   HD21  LEU 113          3HD2      LEU 113  -6.151  -1.972 -13.192
  939   HD22  LEU 113          1HD2      LEU 113  -7.726  -2.715 -13.455
  940   HD23  LEU 113          2HD2      LEU 113  -6.330  -3.257 -14.390
  941    H    GLU 114           H        GLU 114  -8.793  -6.394 -15.080
  942    HA   GLU 114           HA       GLU 114 -10.861  -8.271 -14.499
  943    HB2  GLU 114           2HB      GLU 114  -9.001  -8.124 -16.918
  944    HB3  GLU 114           3HB      GLU 114 -10.497  -9.053 -16.835
  945    HG2  GLU 114           2HG      GLU 114 -11.824  -7.044 -16.708
  946    HG3  GLU 114           3HG      GLU 114 -10.381  -6.045 -16.533
  947    H    HIS 115           H        HIS 115  -9.864  -9.367 -12.700
  948    HA   HIS 115           HA       HIS 115  -9.109 -11.975 -13.374
  949    HB2  HIS 115           2HB      HIS 115  -6.919 -12.050 -11.969
  950    HB3  HIS 115           3HB      HIS 115  -6.807 -11.411 -13.596
  951    HD1  HIS 115           HD1      HIS 115  -5.649  -9.241 -13.847
  952    HD2  HIS 115           HD2      HIS 115  -6.865  -9.868  -9.922
  953    HE1  HIS 115           HE1      HIS 115  -4.608  -7.394 -12.512
  954    HE2  HIS 115           HE2      HIS 115  -5.252  -7.866 -10.137
  955    H    HIS 116           H        HIS 116 -11.100 -12.082 -12.293
  956    HA   HIS 116           HA       HIS 116 -11.318 -11.509  -9.461
  957    HB2  HIS 116           2HB      HIS 116 -13.274 -11.333 -11.007
  958    HB3  HIS 116           3HB      HIS 116 -13.199 -13.066 -11.295
  959    HD1  HIS 116           HD1      HIS 116 -13.697 -10.706  -8.311
  960    HD2  HIS 116           HD2      HIS 116 -14.917 -14.433  -9.686
  961    HE1  HIS 116           HE1      HIS 116 -15.485 -11.464  -6.721
  962    HE2  HIS 116           HE2      HIS 116 -16.311 -13.637  -7.674
  963    H    HIS 117           H        HIS 117  -9.387 -12.667  -9.039
  964    HA   HIS 117           HA       HIS 117  -8.985 -15.450  -9.163
  965    HB2  HIS 117           2HB      HIS 117  -7.173 -14.996  -7.488
  966    HB3  HIS 117           3HB      HIS 117  -7.155 -13.815  -8.802
  967    HD1  HIS 117           HD1      HIS 117  -7.625 -14.122  -5.130
  968    HD2  HIS 117           HD2      HIS 117  -8.115 -11.177  -8.020
  969    HE1  HIS 117           HE1      HIS 117  -8.128 -12.017  -3.869
  970    HE2  HIS 117           HE2      HIS 117  -8.249 -10.227  -5.629
  971    H    HIS 118           H        HIS 118 -10.624 -13.380  -6.878
  972    HA   HIS 118           HA       HIS 118 -10.855 -15.365  -4.767
  973    HB2  HIS 118           2HB      HIS 118 -10.414 -13.133  -4.059
  974    HB3  HIS 118           3HB      HIS 118 -11.662 -12.456  -5.087
  975    HD1  HIS 118           HD1      HIS 118 -13.746 -11.854  -3.941
  976    HD2  HIS 118           HD2      HIS 118 -11.609 -14.716  -1.820
  977    HE1  HIS 118           HE1      HIS 118 -15.027 -12.220  -1.816
  978    HE2  HIS 118           HE2      HIS 118 -13.822 -14.090  -0.651
  979    H    HIS 119           H        HIS 119 -12.355 -16.870  -4.976
  980    HA   HIS 119           HA       HIS 119 -15.045 -16.240  -6.054
  981    HB2  HIS 119           2HB      HIS 119 -15.033 -18.618  -6.965
  982    HB3  HIS 119           3HB      HIS 119 -13.906 -17.529  -7.759
  983    HD1  HIS 119           HD1      HIS 119 -11.352 -17.871  -7.212
  984    HD2  HIS 119           HD2      HIS 119 -13.867 -20.874  -5.843
  985    HE1  HIS 119           HE1      HIS 119  -9.836 -19.761  -6.561
  986    HE2  HIS 119           HE2      HIS 119 -11.378 -21.523  -5.635
  987    H    HIS 120           H        HIS 120 -14.334 -15.972  -3.376
  988    HA   HIS 120           HA       HIS 120 -15.678 -18.252  -2.037
  989    HB2  HIS 120           2HB      HIS 120 -13.254 -18.152  -1.446
  990    HB3  HIS 120           3HB      HIS 120 -13.462 -16.494  -0.882
  991    HD1  HIS 120           HD1      HIS 120 -14.868 -16.166   1.329
  992    HD2  HIS 120           HD2      HIS 120 -14.042 -20.132   0.384
  993    HE1  HIS 120           HE1      HIS 120 -15.475 -17.487   3.376
  994    HE2  HIS 120           HE2      HIS 120 -14.769 -19.838   2.844
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1  21.122  -1.798   2.575
    2    H2   MET   1           2H       MET   1  21.615  -3.295   3.193
    3    H3   MET   1           3H       MET   1  20.557  -2.321   4.081
    4    HA   MET   1           HA       MET   1  19.454  -4.168   3.063
    5    HB2  MET   1           2HB      MET   1  17.581  -2.890   2.036
    6    HB3  MET   1           3HB      MET   1  18.144  -2.175   3.536
    7    HG2  MET   1           2HG      MET   1  18.713  -1.164   0.740
    8    HG3  MET   1           3HG      MET   1  17.623  -0.434   1.920
    9    HE1  MET   1           3HE      MET   1  20.105   0.951   0.253
   10    HE2  MET   1           1HE      MET   1  20.724   2.039   1.500
   11    HE3  MET   1           2HE      MET   1  18.988   1.863   1.270
   12    H    SER   2           H        SER   2  20.758  -5.477   1.800
   13    HA   SER   2           HA       SER   2  21.371  -4.961  -0.963
   14    HB2  SER   2           2HB      SER   2  21.321  -7.586   0.596
   15    HB3  SER   2           3HB      SER   2  22.060  -7.347  -0.991
   16    HG   SER   2           HG       SER   2  23.405  -5.736   0.061
   17    H    GLY   3           H        GLY   3  18.939  -6.781   0.812
   18    HA2  GLY   3           2HA      GLY   3  16.859  -6.436  -1.101
   19    HA3  GLY   3           3HA      GLY   3  17.525  -8.070  -1.194
   20    H    LYS   4           H        LYS   4  16.327  -5.681   1.148
   21    HA   LYS   4           HA       LYS   4  15.814  -7.598   3.220
   22    HB2  LYS   4           2HB      LYS   4  15.093  -4.666   2.867
   23    HB3  LYS   4           3HB      LYS   4  14.442  -5.588   4.214
   24    HG2  LYS   4           2HG      LYS   4  17.393  -5.158   3.658
   25    HG3  LYS   4           3HG      LYS   4  16.435  -4.255   4.833
   26    HD2  LYS   4           2HD      LYS   4  17.092  -7.232   4.912
   27    HD3  LYS   4           3HD      LYS   4  17.735  -5.976   5.971
   28    HE2  LYS   4           2HE      LYS   4  14.848  -6.930   5.864
   29    HE3  LYS   4           3HE      LYS   4  16.020  -7.260   7.139
   30    HZ1  LYS   4           3HZ      LYS   4  14.925  -4.593   6.423
   31    HZ2  LYS   4           1HZ      LYS   4  16.092  -4.878   7.617
   32    HZ3  LYS   4           2HZ      LYS   4  14.532  -5.504   7.789
   33    H    LYS   5           H        LYS   5  13.986  -8.636   3.733
   34    HA   LYS   5           HA       LYS   5  11.590  -8.468   2.102
   35    HB2  LYS   5           2HB      LYS   5  12.406 -10.637   3.117
   36    HB3  LYS   5           3HB      LYS   5  12.076  -9.980   4.714
   37    HG2  LYS   5           2HG      LYS   5   9.687  -9.877   4.228
   38    HG3  LYS   5           3HG      LYS   5   9.971 -10.387   2.562
   39    HD2  LYS   5           2HD      LYS   5   9.172 -12.283   3.841
   40    HD3  LYS   5           3HD      LYS   5  10.856 -12.561   3.400
   41    HE2  LYS   5           2HE      LYS   5  11.575 -11.967   5.672
   42    HE3  LYS   5           3HE      LYS   5   9.917 -11.554   6.113
   43    HZ1  LYS   5           3HZ      LYS   5  10.499 -13.725   6.928
   44    HZ2  LYS   5           1HZ      LYS   5  10.906 -14.254   5.374
   45    HZ3  LYS   5           2HZ      LYS   5   9.303 -13.873   5.747
   46    H    VAL   6           H        VAL   6  10.269  -6.776   2.429
   47    HA   VAL   6           HA       VAL   6  10.301  -5.314   4.997
   48    HB   VAL   6           HB       VAL   6  10.795  -3.917   3.008
   49   HG11  VAL   6          1HG1      VAL   6   9.594  -5.207   1.267
   50   HG12  VAL   6          2HG1      VAL   6   9.138  -3.506   1.224
   51   HG13  VAL   6          3HG1      VAL   6   8.044  -4.692   1.940
   52   HG21  VAL   6          3HG2      VAL   6   8.048  -3.272   4.123
   53   HG22  VAL   6          1HG2      VAL   6   9.185  -2.134   3.393
   54   HG23  VAL   6          2HG2      VAL   6   9.586  -2.914   4.921
   55    H    GLU   7           H        GLU   7   8.243  -4.700   5.946
   56    HA   GLU   7           HA       GLU   7   6.101  -6.666   5.390
   57    HB2  GLU   7           2HB      GLU   7   6.975  -5.368   8.001
   58    HB3  GLU   7           3HB      GLU   7   5.574  -6.416   7.824
   59    HG2  GLU   7           2HG      GLU   7   6.941  -8.310   7.265
   60    HG3  GLU   7           3HG      GLU   7   8.385  -7.300   7.140
   61    H    VAL   8           H        VAL   8   4.483  -5.753   4.436
   62    HA   VAL   8           HA       VAL   8   3.884  -2.883   4.647
   63    HB   VAL   8           HB       VAL   8   3.071  -4.977   2.576
   64   HG11  VAL   8          1HG1      VAL   8   2.103  -3.107   1.257
   65   HG12  VAL   8          2HG1      VAL   8   2.424  -2.000   2.593
   66   HG13  VAL   8          3HG1      VAL   8   1.265  -3.315   2.796
   67   HG21  VAL   8          3HG2      VAL   8   4.555  -3.720   1.037
   68   HG22  VAL   8          1HG2      VAL   8   5.455  -4.315   2.432
   69   HG23  VAL   8          2HG2      VAL   8   4.991  -2.614   2.341
   70    H    GLN   9           H        GLN   9   2.230  -2.310   5.904
   71    HA   GLN   9           HA       GLN   9   0.271  -4.297   6.846
   72    HB2  GLN   9           2HB      GLN   9   0.856  -1.493   7.918
   73    HB3  GLN   9           3HB      GLN   9  -0.221  -2.687   8.636
   74    HG2  GLN   9           2HG      GLN   9   1.764  -4.169   8.997
   75    HG3  GLN   9           3HG      GLN   9   2.792  -2.857   8.422
   76   HE21  GLN   9          1HE2      GLN   9  -0.089  -2.465  10.485
   77   HE22  GLN   9          2HE2      GLN   9   0.774  -1.921  11.880
   78    H    VAL  10           H        VAL  10  -1.344  -4.349   5.355
   79    HA   VAL  10           HA       VAL  10  -2.340  -1.872   4.109
   80    HB   VAL  10           HB       VAL  10  -3.163  -4.766   3.544
   81   HG11  VAL  10          1HG1      VAL  10  -4.157  -3.845   1.452
   82   HG12  VAL  10          2HG1      VAL  10  -3.729  -2.213   1.968
   83   HG13  VAL  10          3HG1      VAL  10  -4.909  -3.148   2.888
   84   HG21  VAL  10          3HG2      VAL  10  -1.193  -3.006   2.019
   85   HG22  VAL  10          1HG2      VAL  10  -1.746  -4.606   1.513
   86   HG23  VAL  10          2HG2      VAL  10  -0.785  -4.430   2.982
   87    H    LYS  11           H        LYS  11  -3.730  -0.819   5.396
   88    HA   LYS  11           HA       LYS  11  -5.638  -2.289   7.134
   89    HB2  LYS  11           2HB      LYS  11  -3.997  -0.861   8.326
   90    HB3  LYS  11           3HB      LYS  11  -4.459   0.524   7.347
   91    HG2  LYS  11           2HG      LYS  11  -6.742   0.429   8.359
   92    HG3  LYS  11           3HG      LYS  11  -6.201  -0.895   9.394
   93    HD2  LYS  11           2HD      LYS  11  -5.002   1.910   9.368
   94    HD3  LYS  11           3HD      LYS  11  -6.182   1.329  10.545
   95    HE2  LYS  11           2HE      LYS  11  -4.559  -0.375  11.324
   96    HE3  LYS  11           3HE      LYS  11  -3.389   0.194  10.134
   97    HZ1  LYS  11           3HZ      LYS  11  -3.324   2.314  11.230
   98    HZ2  LYS  11           1HZ      LYS  11  -2.962   1.084  12.331
   99    HZ3  LYS  11           2HZ      LYS  11  -4.486   1.822  12.357
  100    H    ILE  12           H        ILE  12  -7.559  -2.428   5.957
  101    HA   ILE  12           HA       ILE  12  -8.563   0.063   4.691
  102    HB   ILE  12           HB       ILE  12  -7.890  -1.451   2.909
  103   HG12  ILE  12          2HG1      ILE  12 -10.944  -1.420   3.087
  104   HG13  ILE  12          3HG1      ILE  12  -9.962  -0.031   2.633
  105   HG21  ILE  12          1HG2      ILE  12  -8.899  -3.675   2.553
  106   HG22  ILE  12          2HG2      ILE  12  -9.787  -3.531   4.072
  107   HG23  ILE  12          3HG2      ILE  12  -8.023  -3.612   4.083
  108   HD11  ILE  12          3HD1      ILE  12 -10.936  -1.121   0.703
  109   HD12  ILE  12          1HD1      ILE  12 -10.129  -2.632   1.117
  110   HD13  ILE  12          2HD1      ILE  12  -9.177  -1.217   0.656
  111    H    THR  13           H        THR  13 -10.312   0.807   5.653
  112    HA   THR  13           HA       THR  13 -12.036  -0.926   7.267
  113    HB   THR  13           HB       THR  13 -12.102   2.119   7.015
  114    HG1  THR  13           HG1      THR  13 -10.910   0.607   9.116
  115   HG21  THR  13          3HG2      THR  13 -13.231   0.245   9.141
  116   HG22  THR  13          1HG2      THR  13 -14.184   1.096   7.926
  117   HG23  THR  13          2HG2      THR  13 -13.321   2.007   9.166
  118    H    CYS  14           H        CYS  14 -13.828  -1.666   6.371
  119    HA   CYS  14           HA       CYS  14 -15.388  -0.151   4.405
  120    HB2  CYS  14           2HB      CYS  14 -13.976  -1.528   2.987
  121    HB3  CYS  14           3HB      CYS  14 -14.285  -2.957   3.973
  122    H    ASN  15           H        ASN  15 -17.552  -0.556   4.528
  123    HA   ASN  15           HA       ASN  15 -19.577  -1.235   5.219
  124    HB2  ASN  15           2HB      ASN  15 -18.749  -3.563   4.680
  125    HB3  ASN  15           3HB      ASN  15 -18.236  -3.739   6.352
  126   HD21  ASN  15          1HD2      ASN  15 -20.135  -5.293   4.784
  127   HD22  ASN  15          2HD2      ASN  15 -21.635  -5.254   5.636
  128    H    GLY  16           H        GLY  16 -17.645  -2.610   7.867
  129    HA2  GLY  16           2HA      GLY  16 -17.736  -0.286   9.534
  130    HA3  GLY  16           3HA      GLY  16 -18.855  -1.535  10.082
  131    H    LYS  17           H        LYS  17 -16.176  -2.749   8.428
  132    HA   LYS  17           HA       LYS  17 -14.803  -3.567  10.912
  133    HB2  LYS  17           2HB      LYS  17 -15.582  -5.186   8.455
  134    HB3  LYS  17           3HB      LYS  17 -14.282  -5.715   9.513
  135    HG2  LYS  17           2HG      LYS  17 -17.134  -5.232  10.450
  136    HG3  LYS  17           3HG      LYS  17 -16.504  -6.807   9.954
  137    HD2  LYS  17           2HD      LYS  17 -15.450  -5.121  12.273
  138    HD3  LYS  17           3HD      LYS  17 -16.470  -6.555  12.420
  139    HE2  LYS  17           2HE      LYS  17 -14.673  -7.937  11.428
  140    HE3  LYS  17           3HE      LYS  17 -13.657  -6.507  11.253
  141    HZ1  LYS  17           3HZ      LYS  17 -14.635  -7.623  13.820
  142    HZ2  LYS  17           1HZ      LYS  17 -13.634  -6.271  13.643
  143    HZ3  LYS  17           2HZ      LYS  17 -13.073  -7.803  13.190
  144    H    THR  18           H        THR  18 -12.634  -3.405  10.879
  145    HA   THR  18           HA       THR  18 -11.295  -2.351   8.469
  146    HB   THR  18           HB       THR  18 -10.252  -2.516  11.331
  147    HG1  THR  18           HG1      THR  18 -12.035  -1.026  10.962
  148   HG21  THR  18          3HG2      THR  18  -8.423  -2.499   9.645
  149   HG22  THR  18          1HG2      THR  18  -8.478  -0.971  10.526
  150   HG23  THR  18          2HG2      THR  18  -9.129  -1.068   8.890
  151    H    TYR  19           H        TYR  19 -10.133  -3.706   7.287
  152    HA   TYR  19           HA       TYR  19  -9.342  -6.372   8.284
  153    HB2  TYR  19           2HB      TYR  19  -9.710  -5.413   5.396
  154    HB3  TYR  19           3HB      TYR  19  -9.324  -7.056   5.902
  155    HD1  TYR  19           HD2      TYR  19 -12.011  -4.488   5.754
  156    HD2  TYR  19           HD1      TYR  19 -11.077  -8.539   6.777
  157    HE1  TYR  19           HE2      TYR  19 -14.401  -5.010   5.887
  158    HE2  TYR  19           HE1      TYR  19 -13.475  -9.053   6.912
  159    HH   TYR  19           HH       TYR  19 -15.885  -6.901   5.770
  160    H    GLU  20           H        GLU  20  -7.338  -6.019   9.104
  161    HA   GLU  20           HA       GLU  20  -5.279  -4.886   7.321
  162    HB2  GLU  20           2HB      GLU  20  -4.166  -3.791   9.203
  163    HB3  GLU  20           3HB      GLU  20  -5.803  -3.180   9.015
  164    HG2  GLU  20           2HG      GLU  20  -6.572  -4.423  10.935
  165    HG3  GLU  20           3HG      GLU  20  -5.035  -5.279  11.062
  166    H    ARG  21           H        ARG  21  -3.412  -5.919   7.265
  167    HA   ARG  21           HA       ARG  21  -2.531  -7.775   9.288
  168    HB2  ARG  21           2HB      ARG  21  -3.919  -9.297   7.950
  169    HB3  ARG  21           3HB      ARG  21  -3.152  -8.756   6.462
  170    HG2  ARG  21           2HG      ARG  21  -1.015  -9.770   7.174
  171    HG3  ARG  21           3HG      ARG  21  -1.746 -10.261   8.700
  172    HD2  ARG  21           2HD      ARG  21  -3.241 -11.797   7.556
  173    HD3  ARG  21           3HD      ARG  21  -2.698 -11.218   5.981
  174    HE   ARG  21           HE       ARG  21  -0.762 -12.457   6.178
  175   HH11  ARG  21          1HH1      ARG  21  -2.517 -12.647   9.230
  176   HH12  ARG  21          2HH1      ARG  21  -1.541 -13.940   9.843
  177   HH21  ARG  21          1HH2      ARG  21   0.476 -14.164   6.993
  178   HH22  ARG  21          2HH2      ARG  21   0.156 -14.800   8.573
  179    H    THR  22           H        THR  22  -0.333  -8.139   9.170
  180    HA   THR  22           HA       THR  22   1.217  -6.263   7.540
  181    HB   THR  22           HB       THR  22   2.129  -8.051   9.849
  182    HG1  THR  22           HG1      THR  22   0.571  -5.823   9.845
  183   HG21  THR  22          3HG2      THR  22   3.983  -6.435  10.038
  184   HG22  THR  22          1HG2      THR  22   3.362  -5.543   8.638
  185   HG23  THR  22          2HG2      THR  22   3.975  -7.186   8.447
  186    H    TYR  23           H        TYR  23   1.800  -7.056   5.608
  187    HA   TYR  23           HA       TYR  23   2.160  -9.939   5.132
  188    HB2  TYR  23           2HB      TYR  23   1.909  -7.653   3.117
  189    HB3  TYR  23           3HB      TYR  23   1.929  -9.373   2.736
  190    HD1  TYR  23           HD2      TYR  23  -0.039 -10.803   3.289
  191    HD2  TYR  23           HD1      TYR  23  -0.114  -6.577   3.954
  192    HE1  TYR  23           HE2      TYR  23  -2.487 -10.876   3.490
  193    HE2  TYR  23           HE1      TYR  23  -2.555  -6.649   4.150
  194    HH   TYR  23           HH       TYR  23  -4.278  -9.553   4.523
  195    H    GLN  24           H        GLN  24   4.114 -10.774   4.594
  196    HA   GLN  24           HA       GLN  24   6.498  -9.057   4.662
  197    HB2  GLN  24           2HB      GLN  24   6.154 -12.084   4.761
  198    HB3  GLN  24           3HB      GLN  24   7.722 -11.310   4.646
  199    HG2  GLN  24           2HG      GLN  24   7.409 -11.897   6.926
  200    HG3  GLN  24           3HG      GLN  24   7.245 -10.147   6.825
  201   HE21  GLN  24          1HE2      GLN  24   5.210  -9.214   7.217
  202   HE22  GLN  24          2HE2      GLN  24   3.919 -10.095   7.951
  203    H    LEU  25           H        LEU  25   6.914  -8.176   2.727
  204    HA   LEU  25           HA       LEU  25   6.705  -9.748   0.236
  205    HB2  LEU  25           2HB      LEU  25   6.761  -6.713   0.516
  206    HB3  LEU  25           3HB      LEU  25   6.478  -7.627  -0.958
  207    HG   LEU  25           HG       LEU  25   4.602  -7.300   1.415
  208   HD11  LEU  25          1HD1      LEU  25   4.290  -6.526  -1.500
  209   HD12  LEU  25          2HD1      LEU  25   4.580  -5.436  -0.142
  210   HD13  LEU  25          3HD1      LEU  25   3.067  -6.329  -0.240
  211   HD21  LEU  25          3HD2      LEU  25   4.448  -9.643   0.709
  212   HD22  LEU  25          1HD2      LEU  25   4.225  -9.155  -0.974
  213   HD23  LEU  25          2HD2      LEU  25   2.994  -8.774   0.233
  214    H    TYR  26           H        TYR  26   8.689 -10.595  -0.126
  215    HA   TYR  26           HA       TYR  26  11.163  -9.217   0.492
  216    HB2  TYR  26           2HB      TYR  26  10.932 -11.715   0.671
  217    HB3  TYR  26           3HB      TYR  26  10.719 -11.804  -1.073
  218    HD1  TYR  26           HD2      TYR  26  12.688 -11.414  -2.601
  219    HD2  TYR  26           HD1      TYR  26  13.131 -11.300   1.648
  220    HE1  TYR  26           HE2      TYR  26  15.129 -11.546  -2.849
  221    HE2  TYR  26           HE1      TYR  26  15.561 -11.435   1.401
  222    HH   TYR  26           HH       TYR  26  17.151 -10.914  -1.526
  223    H    ALA  27           H        ALA  27  12.215  -7.861  -0.860
  224    HA   ALA  27           HA       ALA  27  12.014  -8.226  -3.780
  225    HB1  ALA  27           3HB      ALA  27  11.773  -5.802  -4.163
  226    HB2  ALA  27           1HB      ALA  27  11.651  -5.529  -2.422
  227    HB3  ALA  27           2HB      ALA  27  10.400  -6.444  -3.261
  228    H    VAL  28           H        VAL  28  13.860  -7.684  -4.887
  229    HA   VAL  28           HA       VAL  28  16.334  -7.186  -3.428
  230    HB   VAL  28           HB       VAL  28  15.838  -7.456  -6.438
  231   HG11  VAL  28          1HG1      VAL  28  18.276  -7.906  -6.612
  232   HG12  VAL  28          2HG1      VAL  28  18.456  -7.589  -4.885
  233   HG13  VAL  28          3HG1      VAL  28  17.957  -6.292  -5.971
  234   HG21  VAL  28          3HG2      VAL  28  16.753  -9.582  -4.451
  235   HG22  VAL  28          1HG2      VAL  28  16.632  -9.793  -6.202
  236   HG23  VAL  28          2HG2      VAL  28  15.177  -9.514  -5.244
  237    H    ARG  29           H        ARG  29  14.160  -5.560  -5.676
  238    HA   ARG  29           HA       ARG  29  15.571  -2.970  -5.339
  239    HB2  ARG  29           2HB      ARG  29  13.867  -3.755  -7.742
  240    HB3  ARG  29           3HB      ARG  29  14.917  -2.350  -7.585
  241    HG2  ARG  29           2HG      ARG  29  16.901  -3.743  -7.747
  242    HG3  ARG  29           3HG      ARG  29  15.926  -5.215  -7.671
  243    HD2  ARG  29           2HD      ARG  29  14.796  -4.481  -9.802
  244    HD3  ARG  29           3HD      ARG  29  15.965  -3.167  -9.908
  245    HE   ARG  29           HE       ARG  29  17.713  -4.948  -9.991
  246   HH11  ARG  29          1HH1      ARG  29  14.434  -5.717 -11.004
  247   HH12  ARG  29          2HH1      ARG  29  14.939  -6.991 -12.067
  248   HH21  ARG  29          1HH2      ARG  29  18.348  -6.577 -11.445
  249   HH22  ARG  29          2HH2      ARG  29  17.147  -7.473 -12.314
  250    H    ASP  30           H        ASP  30  14.191  -1.107  -5.428
  251    HA   ASP  30           HA       ASP  30  11.725  -1.177  -4.047
  252    HB2  ASP  30           2HB      ASP  30  11.538   1.242  -4.759
  253    HB3  ASP  30           3HB      ASP  30  13.082   0.843  -4.016
  254    H    GLU  31           H        GLU  31  12.521  -1.104  -7.489
  255    HA   GLU  31           HA       GLU  31   9.936  -0.693  -8.547
  256    HB2  GLU  31           2HB      GLU  31  12.008  -0.298  -9.825
  257    HB3  GLU  31           3HB      GLU  31  12.366  -2.020  -9.814
  258    HG2  GLU  31           2HG      GLU  31  10.470  -2.494 -11.248
  259    HG3  GLU  31           3HG      GLU  31   9.896  -0.831 -11.126
  260    H    GLU  32           H        GLU  32  11.548  -3.590  -7.399
  261    HA   GLU  32           HA       GLU  32   9.842  -5.521  -8.627
  262    HB2  GLU  32           2HB      GLU  32  11.406  -5.831  -6.028
  263    HB3  GLU  32           3HB      GLU  32  10.752  -7.135  -7.014
  264    HG2  GLU  32           2HG      GLU  32  13.137  -5.375  -7.526
  265    HG3  GLU  32           3HG      GLU  32  13.043  -7.130  -7.518
  266    H    LEU  33           H        LEU  33   9.715  -3.690  -5.621
  267    HA   LEU  33           HA       LEU  33   7.680  -5.183  -4.328
  268    HB2  LEU  33           2HB      LEU  33   9.458  -3.266  -3.511
  269    HB3  LEU  33           3HB      LEU  33   8.014  -2.288  -3.609
  270    HG   LEU  33           HG       LEU  33   8.440  -3.107  -1.308
  271   HD11  LEU  33          1HD1      LEU  33   6.116  -2.674  -1.914
  272   HD12  LEU  33          2HD1      LEU  33   6.255  -3.969  -0.730
  273   HD13  LEU  33          3HD1      LEU  33   5.926  -4.355  -2.421
  274   HD21  LEU  33          3HD2      LEU  33   8.078  -5.892  -2.439
  275   HD22  LEU  33          1HD2      LEU  33   8.196  -5.484  -0.725
  276   HD23  LEU  33          2HD2      LEU  33   9.564  -5.196  -1.790
  277    H    LYS  34           H        LYS  34   7.545  -2.825  -6.872
  278    HA   LYS  34           HA       LYS  34   5.087  -1.563  -6.558
  279    HB2  LYS  34           2HB      LYS  34   6.453  -2.492  -9.107
  280    HB3  LYS  34           3HB      LYS  34   5.030  -1.452  -9.094
  281    HG2  LYS  34           2HG      LYS  34   6.308   0.278  -7.884
  282    HG3  LYS  34           3HG      LYS  34   7.736  -0.761  -7.898
  283    HD2  LYS  34           2HD      LYS  34   7.838   0.953  -9.672
  284    HD3  LYS  34           3HD      LYS  34   7.807  -0.674 -10.356
  285    HE2  LYS  34           2HE      LYS  34   6.349   0.894 -11.607
  286    HE3  LYS  34           3HE      LYS  34   5.420  -0.425 -10.898
  287    HZ1  LYS  34           3HZ      LYS  34   4.331   1.708 -10.618
  288    HZ2  LYS  34           1HZ      LYS  34   5.670   2.306  -9.759
  289    HZ3  LYS  34           2HZ      LYS  34   4.744   1.045  -9.119
  290    H    GLU  35           H        GLU  35   5.647  -4.480  -8.587
  291    HA   GLU  35           HA       GLU  35   2.890  -4.927  -9.028
  292    HB2  GLU  35           2HB      GLU  35   3.632  -7.196  -9.950
  293    HB3  GLU  35           3HB      GLU  35   4.272  -5.766 -10.732
  294    HG2  GLU  35           2HG      GLU  35   6.112  -7.194 -10.657
  295    HG3  GLU  35           3HG      GLU  35   6.373  -6.118  -9.290
  296    H    LYS  36           H        LYS  36   5.054  -6.036  -6.509
  297    HA   LYS  36           HA       LYS  36   3.508  -8.169  -5.450
  298    HB2  LYS  36           2HB      LYS  36   5.419  -6.339  -3.922
  299    HB3  LYS  36           3HB      LYS  36   4.898  -7.956  -3.431
  300    HG2  LYS  36           2HG      LYS  36   6.027  -8.923  -5.390
  301    HG3  LYS  36           3HG      LYS  36   6.515  -7.309  -5.912
  302    HD2  LYS  36           2HD      LYS  36   7.745  -7.135  -3.647
  303    HD3  LYS  36           3HD      LYS  36   7.475  -8.876  -3.500
  304    HE2  LYS  36           2HE      LYS  36   9.032  -7.447  -5.679
  305    HE3  LYS  36           3HE      LYS  36   9.687  -8.493  -4.425
  306    HZ1  LYS  36           3HZ      LYS  36   8.364 -10.317  -5.424
  307    HZ2  LYS  36           1HZ      LYS  36   9.574  -9.705  -6.435
  308    HZ3  LYS  36           2HZ      LYS  36   7.962  -9.277  -6.698
  309    H    LEU  37           H        LEU  37   3.631  -4.692  -4.667
  310    HA   LEU  37           HA       LEU  37   1.629  -4.500  -2.734
  311    HB2  LEU  37           2HB      LEU  37   2.364  -2.558  -4.958
  312    HB3  LEU  37           3HB      LEU  37   1.238  -2.155  -3.669
  313    HG   LEU  37           HG       LEU  37   4.131  -2.935  -3.158
  314   HD11  LEU  37          1HD1      LEU  37   4.624  -0.561  -2.865
  315   HD12  LEU  37          2HD1      LEU  37   2.991  -0.140  -3.387
  316   HD13  LEU  37          3HD1      LEU  37   4.113  -0.911  -4.514
  317   HD21  LEU  37          3HD2      LEU  37   3.766  -1.929  -0.942
  318   HD22  LEU  37          1HD2      LEU  37   2.647  -3.260  -1.226
  319   HD23  LEU  37          2HD2      LEU  37   2.083  -1.590  -1.356
  320    H    LYS  38           H        LYS  38   1.341  -4.236  -6.307
  321    HA   LYS  38           HA       LYS  38  -1.427  -3.888  -6.509
  322    HB2  LYS  38           2HB      LYS  38   0.429  -5.277  -8.488
  323    HB3  LYS  38           3HB      LYS  38  -1.167  -4.629  -8.871
  324    HG2  LYS  38           2HG      LYS  38  -0.409  -2.360  -8.452
  325    HG3  LYS  38           3HG      LYS  38   1.136  -2.941  -7.845
  326    HD2  LYS  38           2HD      LYS  38   1.647  -2.163  -9.999
  327    HD3  LYS  38           3HD      LYS  38   1.519  -3.905 -10.215
  328    HE2  LYS  38           2HE      LYS  38  -0.714  -1.943 -10.857
  329    HE3  LYS  38           3HE      LYS  38   0.456  -2.520 -12.039
  330    HZ1  LYS  38           3HZ      LYS  38  -1.502  -4.180 -10.553
  331    HZ2  LYS  38           1HZ      LYS  38  -0.345  -4.777 -11.630
  332    HZ3  LYS  38           2HZ      LYS  38  -1.575  -3.759 -12.187
  333    H    LYS  39           H        LYS  39   0.426  -6.951  -6.322
  334    HA   LYS  39           HA       LYS  39  -1.679  -8.775  -6.783
  335    HB2  LYS  39           2HB      LYS  39   0.687  -9.284  -4.914
  336    HB3  LYS  39           3HB      LYS  39  -0.313 -10.501  -5.703
  337    HG2  LYS  39           2HG      LYS  39   1.658  -8.628  -7.021
  338    HG3  LYS  39           3HG      LYS  39   1.834 -10.363  -6.803
  339    HD2  LYS  39           2HD      LYS  39   0.068 -10.809  -8.408
  340    HD3  LYS  39           3HD      LYS  39  -0.362  -9.098  -8.496
  341    HE2  LYS  39           2HE      LYS  39   0.955  -9.856 -10.468
  342    HE3  LYS  39           3HE      LYS  39   1.756  -8.566  -9.573
  343    HZ1  LYS  39           3HZ      LYS  39   2.398 -11.446  -9.254
  344    HZ2  LYS  39           1HZ      LYS  39   3.245 -10.129  -8.607
  345    HZ3  LYS  39           2HZ      LYS  39   3.238 -10.391 -10.276
  346    H    VAL  40           H        VAL  40  -0.331  -7.571  -3.717
  347    HA   VAL  40           HA       VAL  40  -2.113  -8.918  -1.963
  348    HB   VAL  40           HB       VAL  40  -0.385  -6.439  -1.481
  349   HG11  VAL  40          1HG1      VAL  40  -0.561  -6.952   0.942
  350   HG12  VAL  40          2HG1      VAL  40  -1.694  -8.259   0.588
  351   HG13  VAL  40          3HG1      VAL  40  -2.142  -6.585   0.252
  352   HG21  VAL  40          3HG2      VAL  40   1.236  -8.019  -0.470
  353   HG22  VAL  40          1HG2      VAL  40   0.926  -8.418  -2.163
  354   HG23  VAL  40          2HG2      VAL  40   0.181  -9.374  -0.881
  355    H    LEU  41           H        LEU  41  -2.278  -5.793  -3.571
  356    HA   LEU  41           HA       LEU  41  -4.362  -4.681  -1.956
  357    HB2  LEU  41           2HB      LEU  41  -3.095  -3.846  -4.575
  358    HB3  LEU  41           3HB      LEU  41  -4.474  -2.973  -3.915
  359    HG   LEU  41           HG       LEU  41  -1.832  -3.358  -2.447
  360   HD11  LEU  41          1HD1      LEU  41  -1.490  -1.917  -4.391
  361   HD12  LEU  41          2HD1      LEU  41  -1.353  -1.015  -2.884
  362   HD13  LEU  41          3HD1      LEU  41  -2.815  -0.871  -3.862
  363   HD21  LEU  41          3HD2      LEU  41  -2.692  -1.731  -0.852
  364   HD22  LEU  41          1HD2      LEU  41  -3.784  -3.105  -0.955
  365   HD23  LEU  41          2HD2      LEU  41  -4.198  -1.584  -1.760
  366    H    ASN  42           H        ASN  42  -4.284  -6.290  -5.159
  367    HA   ASN  42           HA       ASN  42  -7.076  -6.134  -5.642
  368    HB2  ASN  42           2HB      ASN  42  -4.813  -7.785  -6.764
  369    HB3  ASN  42           3HB      ASN  42  -6.446  -8.356  -7.073
  370   HD21  ASN  42          1HD2      ASN  42  -4.215  -5.679  -7.608
  371   HD22  ASN  42          2HD2      ASN  42  -5.066  -5.008  -8.948
  372    H    GLU  43           H        GLU  43  -5.103  -8.551  -3.926
  373    HA   GLU  43           HA       GLU  43  -7.151 -10.470  -3.472
  374    HB2  GLU  43           2HB      GLU  43  -4.554  -9.919  -1.981
  375    HB3  GLU  43           3HB      GLU  43  -5.603 -11.287  -1.612
  376    HG2  GLU  43           2HG      GLU  43  -4.206 -10.794  -4.268
  377    HG3  GLU  43           3HG      GLU  43  -3.698 -11.937  -3.026
  378    H    ARG  44           H        ARG  44  -5.909  -7.813  -1.452
  379    HA   ARG  44           HA       ARG  44  -7.562  -8.306   0.792
  380    HB2  ARG  44           2HB      ARG  44  -5.418  -7.083   0.956
  381    HB3  ARG  44           3HB      ARG  44  -6.082  -5.769   0.000
  382    HG2  ARG  44           2HG      ARG  44  -6.089  -5.052   2.285
  383    HG3  ARG  44           3HG      ARG  44  -7.765  -5.367   1.843
  384    HD2  ARG  44           2HD      ARG  44  -5.997  -7.293   3.411
  385    HD3  ARG  44           3HD      ARG  44  -7.155  -6.178   4.138
  386    HE   ARG  44           HE       ARG  44  -8.915  -7.430   2.861
  387   HH11  ARG  44          1HH1      ARG  44  -5.928  -9.036   3.711
  388   HH12  ARG  44          2HH1      ARG  44  -6.623 -10.625   3.709
  389   HH21  ARG  44          1HH2      ARG  44  -9.822  -9.536   2.810
  390   HH22  ARG  44          2HH2      ARG  44  -8.837 -10.908   3.195
  391    H    MET  45           H        MET  45  -7.894  -6.198  -2.035
  392    HA   MET  45           HA       MET  45 -10.303  -4.928  -0.981
  393    HB2  MET  45           2HB      MET  45  -8.730  -4.427  -3.525
  394    HB3  MET  45           3HB      MET  45 -10.225  -3.588  -3.141
  395    HG2  MET  45           2HG      MET  45  -9.039  -2.908  -0.935
  396    HG3  MET  45           3HG      MET  45  -7.555  -3.393  -1.757
  397    HE1  MET  45           3HE      MET  45 -10.607  -0.881  -1.718
  398    HE2  MET  45           1HE      MET  45 -10.817  -1.687  -3.275
  399    HE3  MET  45           2HE      MET  45 -10.341   0.010  -3.216
  400    H    ASP  46           H        ASP  46  -9.730  -7.744  -2.754
  401    HA   ASP  46           HA       ASP  46 -11.896  -7.711  -4.578
  402    HB2  ASP  46           2HB      ASP  46 -10.102  -9.362  -4.799
  403    HB3  ASP  46           3HB      ASP  46 -10.521 -10.085  -3.255
  404    HA   PRO  47           HA       PRO  47 -14.687  -9.777  -1.041
  405    HB2  PRO  47           2HB      PRO  47 -13.873  -9.438   1.579
  406    HB3  PRO  47           3HB      PRO  47 -13.427 -10.858   0.609
  407    HG2  PRO  47           2HG      PRO  47 -11.820  -8.355   1.111
  408    HG3  PRO  47           3HG      PRO  47 -11.311 -10.057   1.244
  409    HD2  PRO  47           2HD      PRO  47 -10.715  -8.633  -0.943
  410    HD3  PRO  47           3HD      PRO  47 -11.189 -10.342  -1.085
  411    H    ILE  48           H        ILE  48 -12.929  -6.804  -0.652
  412    HA   ILE  48           HA       ILE  48 -14.780  -5.293   0.905
  413    HB   ILE  48           HB       ILE  48 -12.595  -4.384  -1.030
  414   HG12  ILE  48          2HG1      ILE  48 -11.672  -5.772   0.773
  415   HG13  ILE  48          3HG1      ILE  48 -11.185  -4.103   1.013
  416   HG21  ILE  48          1HG2      ILE  48 -12.610  -2.221   0.161
  417   HG22  ILE  48          2HG2      ILE  48 -14.009  -2.751   1.095
  418   HG23  ILE  48          3HG2      ILE  48 -14.143  -2.542  -0.649
  419   HD11  ILE  48          3HD1      ILE  48 -13.354  -5.558   2.516
  420   HD12  ILE  48          1HD1      ILE  48 -12.876  -3.876   2.766
  421   HD13  ILE  48          2HD1      ILE  48 -11.735  -5.176   3.099
  422    H    LYS  49           H        LYS  49 -14.425  -6.005  -2.503
  423    HA   LYS  49           HA       LYS  49 -16.330  -4.143  -3.533
  424    HB2  LYS  49           2HB      LYS  49 -15.381  -6.783  -4.742
  425    HB3  LYS  49           3HB      LYS  49 -16.215  -5.485  -5.604
  426    HG2  LYS  49           2HG      LYS  49 -14.333  -3.983  -5.273
  427    HG3  LYS  49           3HG      LYS  49 -13.519  -5.169  -4.256
  428    HD2  LYS  49           2HD      LYS  49 -13.344  -6.695  -6.236
  429    HD3  LYS  49           3HD      LYS  49 -14.075  -5.434  -7.239
  430    HE2  LYS  49           2HE      LYS  49 -12.171  -3.921  -6.656
  431    HE3  LYS  49           3HE      LYS  49 -11.438  -5.229  -5.728
  432    HZ1  LYS  49           3HZ      LYS  49 -11.287  -6.520  -7.769
  433    HZ2  LYS  49           1HZ      LYS  49 -10.456  -5.052  -7.903
  434    HZ3  LYS  49           2HZ      LYS  49 -11.965  -5.242  -8.651
  435    H    LYS  50           H        LYS  50 -16.542  -7.454  -2.266
  436    HA   LYS  50           HA       LYS  50 -19.284  -7.889  -2.963
  437    HB2  LYS  50           2HB      LYS  50 -17.572  -9.706  -2.522
  438    HB3  LYS  50           3HB      LYS  50 -17.682  -9.320  -0.808
  439    HG2  LYS  50           2HG      LYS  50 -20.151  -9.860  -0.922
  440    HG3  LYS  50           3HG      LYS  50 -19.906 -10.387  -2.586
  441    HD2  LYS  50           2HD      LYS  50 -18.534 -11.612  -0.159
  442    HD3  LYS  50           3HD      LYS  50 -19.986 -12.256  -0.922
  443    HE2  LYS  50           2HE      LYS  50 -18.140 -13.552  -1.726
  444    HE3  LYS  50           3HE      LYS  50 -18.637 -12.511  -3.056
  445    HZ1  LYS  50           3HZ      LYS  50 -16.380 -11.915  -1.238
  446    HZ2  LYS  50           1HZ      LYS  50 -16.777 -11.112  -2.670
  447    HZ3  LYS  50           2HZ      LYS  50 -16.210 -12.700  -2.724
  448    H    LEU  51           H        LEU  51 -17.649  -6.426  -0.229
  449    HA   LEU  51           HA       LEU  51 -19.934  -6.247   1.513
  450    HB2  LEU  51           2HB      LEU  51 -17.429  -4.524   1.395
  451    HB3  LEU  51           3HB      LEU  51 -18.609  -4.494   2.700
  452    HG   LEU  51           HG       LEU  51 -16.881  -6.897   1.970
  453   HD11  LEU  51          1HD1      LEU  51 -16.592  -4.970   4.286
  454   HD12  LEU  51          2HD1      LEU  51 -15.523  -5.092   2.886
  455   HD13  LEU  51          3HD1      LEU  51 -15.638  -6.435   4.020
  456   HD21  LEU  51          3HD2      LEU  51 -18.763  -6.490   4.324
  457   HD22  LEU  51          1HD2      LEU  51 -17.685  -7.873   4.091
  458   HD23  LEU  51          2HD2      LEU  51 -19.010  -7.593   2.968
  459    H    GLY  52           H        GLY  52 -18.378  -4.033  -0.802
  460    HA2  GLY  52           2HA      GLY  52 -19.449  -2.789  -2.434
  461    HA3  GLY  52           3HA      GLY  52 -20.988  -3.043  -1.638
  462    H    CYS  53           H        CYS  53 -18.426  -1.906   0.355
  463    HA   CYS  53           HA       CYS  53 -19.601   0.576   1.023
  464    HB2  CYS  53           2HB      CYS  53 -17.273   1.006   2.021
  465    HB3  CYS  53           3HB      CYS  53 -18.084  -0.464   2.566
  466    H    LYS  54           H        LYS  54 -19.642   2.451  -0.114
  467    HA   LYS  54           HA       LYS  54 -18.551   2.741  -2.708
  468    HB2  LYS  54           2HB      LYS  54 -19.500   5.026  -0.918
  469    HB3  LYS  54           3HB      LYS  54 -19.389   5.037  -2.672
  470    HG2  LYS  54           2HG      LYS  54 -21.350   3.458  -0.983
  471    HG3  LYS  54           3HG      LYS  54 -21.699   4.877  -1.976
  472    HD2  LYS  54           2HD      LYS  54 -20.951   3.479  -3.996
  473    HD3  LYS  54           3HD      LYS  54 -20.952   2.081  -2.912
  474    HE2  LYS  54           2HE      LYS  54 -23.327   3.829  -3.650
  475    HE3  LYS  54           3HE      LYS  54 -23.067   2.145  -4.106
  476    HZ1  LYS  54           3HZ      LYS  54 -23.254   1.531  -1.766
  477    HZ2  LYS  54           1HZ      LYS  54 -24.647   2.332  -2.296
  478    HZ3  LYS  54           2HZ      LYS  54 -23.516   3.145  -1.338
  479    H    ARG  55           H        ARG  55 -17.739   4.506   0.298
  480    HA   ARG  55           HA       ARG  55 -15.055   5.136  -0.763
  481    HB2  ARG  55           2HB      ARG  55 -16.450   7.057   0.035
  482    HB3  ARG  55           3HB      ARG  55 -16.502   6.335   1.642
  483    HG2  ARG  55           2HG      ARG  55 -14.065   6.584   1.860
  484    HG3  ARG  55           3HG      ARG  55 -13.962   7.209   0.216
  485    HD2  ARG  55           2HD      ARG  55 -13.812   9.061   1.738
  486    HD3  ARG  55           3HD      ARG  55 -15.373   9.147   0.920
  487    HE   ARG  55           HE       ARG  55 -16.053   7.856   3.152
  488   HH11  ARG  55          1HH1      ARG  55 -14.088  10.755   2.750
  489   HH12  ARG  55          2HH1      ARG  55 -14.543  11.413   4.289
  490   HH21  ARG  55          1HH2      ARG  55 -16.642   8.747   5.155
  491   HH22  ARG  55          2HH2      ARG  55 -15.990  10.273   5.651
  492    H    VAL  56           H        VAL  56 -13.358   4.068   0.040
  493    HA   VAL  56           HA       VAL  56 -13.591   2.600   2.610
  494    HB   VAL  56           HB       VAL  56 -11.899   1.001   1.770
  495   HG11  VAL  56          1HG1      VAL  56 -14.257   0.451   1.442
  496   HG12  VAL  56          2HG1      VAL  56 -13.298  -0.168   0.100
  497   HG13  VAL  56          3HG1      VAL  56 -14.267   1.292  -0.112
  498   HG21  VAL  56          3HG2      VAL  56 -11.190   0.971  -0.602
  499   HG22  VAL  56          1HG2      VAL  56 -10.670   2.459   0.193
  500   HG23  VAL  56          2HG2      VAL  56 -12.063   2.479  -0.891
  501    H    ARG  57           H        ARG  57 -11.960   2.832   4.089
  502    HA   ARG  57           HA       ARG  57 -10.022   5.016   3.627
  503    HB2  ARG  57           2HB      ARG  57 -11.476   5.313   5.571
  504    HB3  ARG  57           3HB      ARG  57 -11.065   3.714   6.187
  505    HG2  ARG  57           2HG      ARG  57  -8.767   4.434   6.624
  506    HG3  ARG  57           3HG      ARG  57  -9.094   6.015   5.906
  507    HD2  ARG  57           2HD      ARG  57 -10.546   4.933   8.348
  508    HD3  ARG  57           3HD      ARG  57  -9.121   5.972   8.427
  509    HE   ARG  57           HE       ARG  57 -10.625   7.520   6.960
  510   HH11  ARG  57          1HH1      ARG  57 -11.692   5.660   9.745
  511   HH12  ARG  57          2HH1      ARG  57 -12.953   6.777  10.151
  512   HH21  ARG  57          1HH2      ARG  57 -12.255   8.971   7.514
  513   HH22  ARG  57          2HH2      ARG  57 -13.276   8.661   8.885
  514    H    ILE  58           H        ILE  58  -8.259   4.146   2.697
  515    HA   ILE  58           HA       ILE  58  -7.111   1.618   3.711
  516    HB   ILE  58           HB       ILE  58  -6.308   3.149   1.187
  517   HG12  ILE  58          2HG1      ILE  58  -8.172   0.728   1.354
  518   HG13  ILE  58          3HG1      ILE  58  -8.696   2.378   1.035
  519   HG21  ILE  58          1HG2      ILE  58  -4.565   1.636   2.056
  520   HG22  ILE  58          2HG2      ILE  58  -5.199   1.039   0.524
  521   HG23  ILE  58          3HG2      ILE  58  -5.705   0.286   2.038
  522   HD11  ILE  58          3HD1      ILE  58  -8.609   1.071  -1.008
  523   HD12  ILE  58          1HD1      ILE  58  -6.901   0.716  -0.742
  524   HD13  ILE  58          2HD1      ILE  58  -7.421   2.373  -1.064
  525    H    SER  59           H        SER  59  -5.126   1.643   4.647
  526    HA   SER  59           HA       SER  59  -3.427   4.027   4.593
  527    HB2  SER  59           2HB      SER  59  -4.800   4.218   6.688
  528    HB3  SER  59           3HB      SER  59  -4.217   2.634   7.202
  529    HG   SER  59           HG       SER  59  -2.335   4.595   6.512
  530    H    ILE  60           H        ILE  60  -1.780   3.151   3.560
  531    HA   ILE  60           HA       ILE  60  -0.845   0.417   4.199
  532    HB   ILE  60           HB       ILE  60  -0.286   2.198   1.778
  533   HG12  ILE  60          2HG1      ILE  60  -1.952  -0.356   2.004
  534   HG13  ILE  60          3HG1      ILE  60  -2.602   1.275   1.868
  535   HG21  ILE  60          1HG2      ILE  60   0.866   0.248   0.783
  536   HG22  ILE  60          2HG2      ILE  60   0.636  -0.666   2.275
  537   HG23  ILE  60          3HG2      ILE  60   1.666   0.768   2.265
  538   HD11  ILE  60          3HD1      ILE  60  -2.726   0.148  -0.242
  539   HD12  ILE  60          1HD1      ILE  60  -0.995  -0.188  -0.217
  540   HD13  ILE  60          2HD1      ILE  60  -1.573   1.475  -0.353
  541    H    ARG  61           H        ARG  61   0.594   0.576   5.831
  542    HA   ARG  61           HA       ARG  61   2.714   2.630   5.686
  543    HB2  ARG  61           2HB      ARG  61   1.456   2.319   7.875
  544    HB3  ARG  61           3HB      ARG  61   2.144   0.698   7.984
  545    HG2  ARG  61           2HG      ARG  61   4.428   1.691   7.969
  546    HG3  ARG  61           3HG      ARG  61   3.711   3.303   7.900
  547    HD2  ARG  61           2HD      ARG  61   2.543   2.720  10.100
  548    HD3  ARG  61           3HD      ARG  61   3.605   1.301  10.172
  549    HE   ARG  61           HE       ARG  61   4.620   4.077   9.985
  550   HH11  ARG  61          1HH1      ARG  61   4.796   0.904  11.489
  551   HH12  ARG  61          2HH1      ARG  61   6.160   1.330  12.470
  552   HH21  ARG  61          1HH2      ARG  61   6.397   4.595  11.266
  553   HH22  ARG  61          2HH2      ARG  61   7.060   3.412  12.343
  554    H    VAL  62           H        VAL  62   4.710   2.034   5.085
  555    HA   VAL  62           HA       VAL  62   5.333  -0.804   4.621
  556    HB   VAL  62           HB       VAL  62   5.692   1.033   2.837
  557   HG11  VAL  62          1HG1      VAL  62   8.127   1.760   4.507
  558   HG12  VAL  62          2HG1      VAL  62   6.704   2.778   4.271
  559   HG13  VAL  62          3HG1      VAL  62   7.738   2.378   2.899
  560   HG21  VAL  62          3HG2      VAL  62   8.080  -0.686   3.548
  561   HG22  VAL  62          1HG2      VAL  62   7.756   0.023   1.968
  562   HG23  VAL  62          2HG2      VAL  62   6.672  -1.205   2.624
  563    H    LYS  63           H        LYS  63   7.013  -1.830   5.822
  564    HA   LYS  63           HA       LYS  63   7.549  -0.550   8.384
  565    HB2  LYS  63           2HB      LYS  63   6.889  -2.996   8.163
  566    HB3  LYS  63           3HB      LYS  63   8.500  -3.312   7.531
  567    HG2  LYS  63           2HG      LYS  63   9.534  -2.685   9.619
  568    HG3  LYS  63           3HG      LYS  63   8.013  -2.040  10.249
  569    HD2  LYS  63           2HD      LYS  63   7.043  -4.307  10.280
  570    HD3  LYS  63           3HD      LYS  63   8.528  -4.970   9.591
  571    HE2  LYS  63           2HE      LYS  63   9.761  -4.259  11.629
  572    HE3  LYS  63           3HE      LYS  63   8.251  -3.647  12.312
  573    HZ1  LYS  63           3HZ      LYS  63   8.691  -6.470  11.508
  574    HZ2  LYS  63           1HZ      LYS  63   7.358  -5.839  12.339
  575    HZ3  LYS  63           2HZ      LYS  63   8.873  -5.892  13.091
  576    H    HIS  64           H        HIS  64   9.520   0.007   9.186
  577    HA   HIS  64           HA       HIS  64  11.521   0.711   7.137
  578    HB2  HIS  64           2HB      HIS  64  10.696   2.106   9.728
  579    HB3  HIS  64           3HB      HIS  64  11.986   2.658   8.667
  580    HD1  HIS  64           HD1      HIS  64   8.296   2.653   9.046
  581    HD2  HIS  64           HD2      HIS  64  11.093   3.722   6.162
  582    HE1  HIS  64           HE1      HIS  64   7.048   4.057   7.382
  583    HE2  HIS  64           HE2      HIS  64   8.813   4.868   5.783
  584    H    SER  65           H        SER  65  13.567   0.022   7.402
  585    HA   SER  65           HA       SER  65  14.056  -2.009   9.424
  586    HB2  SER  65           2HB      SER  65  14.583  -2.364   7.002
  587    HB3  SER  65           3HB      SER  65  15.818  -1.112   7.103
  588    HG   SER  65           HG       SER  65  16.980  -2.407   8.505
  589    H    ASP  66           H        ASP  66  15.570   1.057   8.414
  590    HA   ASP  66           HA       ASP  66  17.317   0.996  10.811
  591    HB2  ASP  66           2HB      ASP  66  18.544   0.896   8.672
  592    HB3  ASP  66           3HB      ASP  66  17.740   2.356   8.105
  593    H    ALA  67           H        ALA  67  17.047   4.005   9.061
  594    HA   ALA  67           HA       ALA  67  14.911   5.340  10.193
  595    HB1  ALA  67           3HB      ALA  67  15.954   6.678  12.009
  596    HB2  ALA  67           1HB      ALA  67  17.439   5.733  11.849
  597    HB3  ALA  67           2HB      ALA  67  15.958   4.958  12.405
  598    H    ALA  68           H        ALA  68  18.425   5.895   9.866
  599    HA   ALA  68           HA       ALA  68  18.196   8.402   8.492
  600    HB1  ALA  68           3HB      ALA  68  20.577   6.534   8.775
  601    HB2  ALA  68           1HB      ALA  68  20.159   7.864   9.858
  602    HB3  ALA  68           2HB      ALA  68  20.644   8.203   8.197
  603    H    GLU  69           H        GLU  69  18.964   5.071   7.502
  604    HA   GLU  69           HA       GLU  69  19.159   5.469   4.722
  605    HB2  GLU  69           2HB      GLU  69  18.263   3.016   6.300
  606    HB3  GLU  69           3HB      GLU  69  18.571   3.002   4.562
  607    HG2  GLU  69           2HG      GLU  69  20.600   3.540   6.761
  608    HG3  GLU  69           3HG      GLU  69  20.485   2.093   5.757
  609    H    GLU  70           H        GLU  70  16.396   5.058   6.862
  610    HA   GLU  70           HA       GLU  70  14.463   4.477   4.834
  611    HB2  GLU  70           2HB      GLU  70  13.950   5.459   7.659
  612    HB3  GLU  70           3HB      GLU  70  12.810   4.612   6.610
  613    HG2  GLU  70           2HG      GLU  70  15.328   3.501   7.879
  614    HG3  GLU  70           3HG      GLU  70  13.668   3.070   8.262
  615    H    LYS  71           H        LYS  71  15.707   7.464   6.207
  616    HA   LYS  71           HA       LYS  71  13.696   9.259   5.326
  617    HB2  LYS  71           2HB      LYS  71  16.702   9.731   5.557
  618    HB3  LYS  71           3HB      LYS  71  15.490  10.998   5.407
  619    HG2  LYS  71           2HG      LYS  71  15.719   9.057   7.726
  620    HG3  LYS  71           3HG      LYS  71  16.324  10.709   7.724
  621    HD2  LYS  71           2HD      LYS  71  13.381  10.070   7.276
  622    HD3  LYS  71           3HD      LYS  71  14.063  10.259   8.890
  623    HE2  LYS  71           2HE      LYS  71  13.064  12.355   8.252
  624    HE3  LYS  71           3HE      LYS  71  14.811  12.565   8.250
  625    HZ1  LYS  71           3HZ      LYS  71  13.742  13.618   6.360
  626    HZ2  LYS  71           1HZ      LYS  71  13.133  12.127   5.841
  627    HZ3  LYS  71           2HZ      LYS  71  14.803  12.405   5.853
  628    H    LYS  72           H        LYS  72  16.360   7.693   3.721
  629    HA   LYS  72           HA       LYS  72  16.095   9.051   1.166
  630    HB2  LYS  72           2HB      LYS  72  18.299   8.391   1.967
  631    HB3  LYS  72           3HB      LYS  72  17.776   6.725   2.184
  632    HG2  LYS  72           2HG      LYS  72  17.517   6.553  -0.315
  633    HG3  LYS  72           3HG      LYS  72  18.207   8.174  -0.453
  634    HD2  LYS  72           2HD      LYS  72  19.883   6.359  -0.832
  635    HD3  LYS  72           3HD      LYS  72  20.317   7.417   0.514
  636    HE2  LYS  72           2HE      LYS  72  19.608   5.731   2.131
  637    HE3  LYS  72           3HE      LYS  72  18.934   4.725   0.850
  638    HZ1  LYS  72           3HZ      LYS  72  21.141   4.370  -0.004
  639    HZ2  LYS  72           1HZ      LYS  72  21.060   3.921   1.626
  640    HZ3  LYS  72           2HZ      LYS  72  21.798   5.373   1.187
  641    H    GLU  73           H        GLU  73  15.315   5.860   2.561
  642    HA   GLU  73           HA       GLU  73  14.697   4.686  -0.002
  643    HB2  GLU  73           2HB      GLU  73  14.576   3.545   2.807
  644    HB3  GLU  73           3HB      GLU  73  14.189   2.611   1.363
  645    HG2  GLU  73           2HG      GLU  73  16.879   3.844   2.052
  646    HG3  GLU  73           3HG      GLU  73  16.462   2.133   2.107
  647    H    ALA  74           H        ALA  74  12.805   5.911   2.723
  648    HA   ALA  74           HA       ALA  74  10.273   4.938   1.698
  649    HB1  ALA  74           3HB      ALA  74  10.559   5.296   4.119
  650    HB2  ALA  74           1HB      ALA  74   9.222   6.265   3.485
  651    HB3  ALA  74           2HB      ALA  74  10.776   7.024   3.847
  652    H    LYS  75           H        LYS  75  12.127   7.935   1.532
  653    HA   LYS  75           HA       LYS  75  10.379   9.489  -0.046
  654    HB2  LYS  75           2HB      LYS  75  12.331  10.515   0.946
  655    HB3  LYS  75           3HB      LYS  75  13.416   9.397   0.129
  656    HG2  LYS  75           2HG      LYS  75  12.906  10.439  -2.036
  657    HG3  LYS  75           3HG      LYS  75  11.749  11.529  -1.262
  658    HD2  LYS  75           2HD      LYS  75  13.523  12.629  -0.018
  659    HD3  LYS  75           3HD      LYS  75  14.709  11.437  -0.557
  660    HE2  LYS  75           2HE      LYS  75  13.253  13.351  -2.417
  661    HE3  LYS  75           3HE      LYS  75  14.864  13.638  -1.758
  662    HZ1  LYS  75           3HZ      LYS  75  14.049  11.432  -3.572
  663    HZ2  LYS  75           1HZ      LYS  75  15.563  11.536  -2.822
  664    HZ3  LYS  75           2HZ      LYS  75  15.082  12.723  -3.924
  665    H    LYS  76           H        LYS  76  12.793   7.044  -0.925
  666    HA   LYS  76           HA       LYS  76  12.457   7.097  -3.742
  667    HB2  LYS  76           2HB      LYS  76  14.428   6.090  -2.693
  668    HB3  LYS  76           3HB      LYS  76  13.427   4.914  -1.852
  669    HG2  LYS  76           2HG      LYS  76  12.792   3.940  -4.085
  670    HG3  LYS  76           3HG      LYS  76  13.937   5.051  -4.844
  671    HD2  LYS  76           2HD      LYS  76  14.658   2.952  -2.754
  672    HD3  LYS  76           3HD      LYS  76  14.862   2.755  -4.496
  673    HE2  LYS  76           2HE      LYS  76  16.477   4.611  -4.536
  674    HE3  LYS  76           3HE      LYS  76  16.237   4.874  -2.806
  675    HZ1  LYS  76           3HZ      LYS  76  18.228   3.596  -3.297
  676    HZ2  LYS  76           1HZ      LYS  76  17.290   2.372  -4.001
  677    HZ3  LYS  76           2HZ      LYS  76  17.127   2.722  -2.348
  678    H    PHE  77           H        PHE  77  10.878   5.329  -1.126
  679    HA   PHE  77           HA       PHE  77   9.420   3.514  -2.809
  680    HB2  PHE  77           2HB      PHE  77  10.250   3.044  -0.403
  681    HB3  PHE  77           3HB      PHE  77   8.894   4.022   0.147
  682    HD1  PHE  77           HD1      PHE  77   9.756   1.002  -1.872
  683    HD2  PHE  77           HD2      PHE  77   6.715   3.014   0.366
  684    HE1  PHE  77           HE1      PHE  77   8.307  -0.967  -2.050
  685    HE2  PHE  77           HE2      PHE  77   5.279   1.028   0.176
  686    HZ   PHE  77           HZ       PHE  77   6.071  -0.960  -1.029
  687    H    ALA  78           H        ALA  78   8.910   6.693  -1.560
  688    HA   ALA  78           HA       ALA  78   6.136   6.988  -1.636
  689    HB1  ALA  78           3HB      ALA  78   7.657   8.736  -0.794
  690    HB2  ALA  78           1HB      ALA  78   6.557   9.390  -2.010
  691    HB3  ALA  78           2HB      ALA  78   8.236   9.037  -2.431
  692    H    ALA  79           H        ALA  79   8.538   7.314  -4.243
  693    HA   ALA  79           HA       ALA  79   6.803   7.878  -6.382
  694    HB1  ALA  79           3HB      ALA  79   9.491   6.454  -6.442
  695    HB2  ALA  79           1HB      ALA  79   9.239   8.202  -6.512
  696    HB3  ALA  79           2HB      ALA  79   8.675   7.176  -7.831
  697    H    ILE  80           H        ILE  80   7.748   4.843  -4.876
  698    HA   ILE  80           HA       ILE  80   6.803   3.039  -6.862
  699    HB   ILE  80           HB       ILE  80   7.313   2.607  -3.883
  700   HG12  ILE  80          2HG1      ILE  80   9.351   3.275  -5.054
  701   HG13  ILE  80          3HG1      ILE  80   9.464   1.560  -4.674
  702   HG21  ILE  80          1HG2      ILE  80   6.890   0.494  -6.025
  703   HG22  ILE  80          2HG2      ILE  80   5.802   0.851  -4.688
  704   HG23  ILE  80          3HG2      ILE  80   7.397   0.174  -4.366
  705   HD11  ILE  80          3HD1      ILE  80   8.796   2.762  -7.358
  706   HD12  ILE  80          1HD1      ILE  80   8.850   1.033  -6.999
  707   HD13  ILE  80          2HD1      ILE  80  10.313   2.005  -6.881
  708    H    LEU  81           H        LEU  81   5.354   4.262  -3.818
  709    HA   LEU  81           HA       LEU  81   3.009   2.653  -3.969
  710    HB2  LEU  81           2HB      LEU  81   3.834   5.036  -2.298
  711    HB3  LEU  81           3HB      LEU  81   2.179   4.458  -2.228
  712    HG   LEU  81           HG       LEU  81   4.610   2.748  -1.576
  713   HD11  LEU  81          1HD1      LEU  81   3.967   2.949   0.773
  714   HD12  LEU  81          2HD1      LEU  81   2.690   4.088   0.341
  715   HD13  LEU  81          3HD1      LEU  81   4.383   4.516   0.085
  716   HD21  LEU  81          3HD2      LEU  81   2.996   1.149  -0.651
  717   HD22  LEU  81          1HD2      LEU  81   2.689   1.426  -2.363
  718   HD23  LEU  81          2HD2      LEU  81   1.654   2.184  -1.150
  719    H    ASN  82           H        ASN  82   3.687   6.074  -4.696
  720    HA   ASN  82           HA       ASN  82   1.105   6.932  -5.389
  721    HB2  ASN  82           2HB      ASN  82   3.829   7.949  -6.300
  722    HB3  ASN  82           3HB      ASN  82   2.322   8.772  -6.690
  723   HD21  ASN  82          1HD2      ASN  82   3.002  10.624  -5.563
  724   HD22  ASN  82          2HD2      ASN  82   3.022  10.689  -3.837
  725    H    LYS  83           H        LYS  83   3.662   5.536  -7.416
  726    HA   LYS  83           HA       LYS  83   2.330   5.693  -9.909
  727    HB2  LYS  83           2HB      LYS  83   4.700   4.187  -8.850
  728    HB3  LYS  83           3HB      LYS  83   3.983   3.575 -10.333
  729    HG2  LYS  83           2HG      LYS  83   4.973   6.425  -9.955
  730    HG3  LYS  83           3HG      LYS  83   5.904   5.122 -10.701
  731    HD2  LYS  83           2HD      LYS  83   3.268   6.263 -11.733
  732    HD3  LYS  83           3HD      LYS  83   4.866   6.555 -12.423
  733    HE2  LYS  83           2HE      LYS  83   5.047   4.118 -12.942
  734    HE3  LYS  83           3HE      LYS  83   3.412   3.881 -12.320
  735    HZ1  LYS  83           3HZ      LYS  83   2.624   5.428 -14.020
  736    HZ2  LYS  83           1HZ      LYS  83   3.384   4.075 -14.691
  737    HZ3  LYS  83           2HZ      LYS  83   4.193   5.559 -14.633
  738    H    VAL  84           H        VAL  84   2.387   3.154  -7.400
  739    HA   VAL  84           HA       VAL  84   1.092   1.121  -8.926
  740    HB   VAL  84           HB       VAL  84   1.520   1.523  -5.937
  741   HG11  VAL  84          1HG1      VAL  84   0.091  -0.848  -7.206
  742   HG12  VAL  84          2HG1      VAL  84  -0.607   0.305  -6.071
  743   HG13  VAL  84          3HG1      VAL  84   0.662  -0.794  -5.536
  744   HG21  VAL  84          3HG2      VAL  84   2.637  -0.514  -7.907
  745   HG22  VAL  84          1HG2      VAL  84   3.047  -0.415  -6.191
  746   HG23  VAL  84          2HG2      VAL  84   3.491   0.898  -7.282
  747    H    PHE  85           H        PHE  85  -0.064   3.518  -6.607
  748    HA   PHE  85           HA       PHE  85  -2.799   2.878  -6.596
  749    HB2  PHE  85           2HB      PHE  85  -1.511   5.612  -6.151
  750    HB3  PHE  85           3HB      PHE  85  -3.153   5.170  -5.689
  751    HD1  PHE  85           HD1      PHE  85  -2.532   2.357  -4.620
  752    HD2  PHE  85           HD2      PHE  85  -0.639   6.146  -3.974
  753    HE1  PHE  85           HE1      PHE  85  -1.699   1.582  -2.455
  754    HE2  PHE  85           HE2      PHE  85   0.192   5.351  -1.808
  755    HZ   PHE  85           HZ       PHE  85  -0.332   3.069  -1.046
  756    H    ALA  86           H        ALA  86  -0.909   5.075  -8.658
  757    HA   ALA  86           HA       ALA  86  -3.013   6.131 -10.227
  758    HB1  ALA  86           3HB      ALA  86  -0.095   5.739 -10.979
  759    HB2  ALA  86           1HB      ALA  86  -0.766   7.141 -10.139
  760    HB3  ALA  86           2HB      ALA  86  -1.241   6.800 -11.803
  761    H    GLU  87           H        GLU  87  -1.179   3.142 -10.427
  762    HA   GLU  87           HA       GLU  87  -2.083   2.394 -13.095
  763    HB2  GLU  87           2HB      GLU  87  -0.417   0.917 -11.007
  764    HB3  GLU  87           3HB      GLU  87  -0.793   0.253 -12.596
  765    HG2  GLU  87           2HG      GLU  87   0.461   2.025 -13.693
  766    HG3  GLU  87           3HG      GLU  87   0.707   2.853 -12.158
  767    H    LEU  88           H        LEU  88  -3.456   2.337 -10.038
  768    HA   LEU  88           HA       LEU  88  -5.214   0.018 -10.611
  769    HB2  LEU  88           2HB      LEU  88  -4.699   1.420  -7.959
  770    HB3  LEU  88           3HB      LEU  88  -5.821   0.088  -8.201
  771    HG   LEU  88           HG       LEU  88  -2.796  -0.062  -8.483
  772   HD11  LEU  88          1HD1      LEU  88  -4.595  -1.222  -6.348
  773   HD12  LEU  88          2HD1      LEU  88  -3.487   0.142  -6.163
  774   HD13  LEU  88          3HD1      LEU  88  -2.850  -1.468  -6.491
  775   HD21  LEU  88          3HD2      LEU  88  -3.081  -2.492  -8.754
  776   HD22  LEU  88          1HD2      LEU  88  -3.837  -1.600 -10.070
  777   HD23  LEU  88          2HD2      LEU  88  -4.835  -2.293  -8.787
  778    H    GLY  89           H        GLY  89  -5.033   3.409 -10.650
  779    HA2  GLY  89           2HA      GLY  89  -6.795   4.590 -11.805
  780    HA3  GLY  89           3HA      GLY  89  -7.987   3.623 -10.958
  781    H    TYR  90           H        TYR  90  -5.822   4.327  -8.632
  782    HA   TYR  90           HA       TYR  90  -7.419   6.440  -7.455
  783    HB2  TYR  90           2HB      TYR  90  -4.802   5.330  -6.360
  784    HB3  TYR  90           3HB      TYR  90  -6.082   6.135  -5.460
  785    HD1  TYR  90           HD2      TYR  90  -8.509   4.705  -6.281
  786    HD2  TYR  90           HD1      TYR  90  -4.614   3.134  -5.495
  787    HE1  TYR  90           HE2      TYR  90  -9.496   2.521  -5.768
  788    HE2  TYR  90           HE1      TYR  90  -5.600   0.945  -4.980
  789    HH   TYR  90           HH       TYR  90  -7.781   0.019  -4.268
  790    H    ASN  91           H        ASN  91  -6.801   8.577  -7.164
  791    HA   ASN  91           HA       ASN  91  -4.661   9.580  -8.926
  792    HB2  ASN  91           2HB      ASN  91  -6.966  11.075  -7.595
  793    HB3  ASN  91           3HB      ASN  91  -5.810  11.774  -8.728
  794   HD21  ASN  91          1HD2      ASN  91  -8.490   9.563  -8.372
  795   HD22  ASN  91          2HD2      ASN  91  -8.913   9.510 -10.044
  796    H    ASP  92           H        ASP  92  -3.573  11.587  -8.219
  797    HA   ASP  92           HA       ASP  92  -1.915  11.317  -6.012
  798    HB2  ASP  92           2HB      ASP  92  -2.738  13.895  -7.437
  799    HB3  ASP  92           3HB      ASP  92  -1.339  13.732  -6.376
  800    H    SER  93           H        SER  93  -4.885  13.200  -6.385
  801    HA   SER  93           HA       SER  93  -4.827  14.776  -4.102
  802    HB2  SER  93           2HB      SER  93  -7.261  13.748  -5.615
  803    HB3  SER  93           3HB      SER  93  -7.221  15.166  -4.560
  804    HG   SER  93           HG       SER  93  -5.566  15.991  -6.002
  805    H    ASN  94           H        ASN  94  -6.378  11.566  -4.503
  806    HA   ASN  94           HA       ASN  94  -7.417  11.583  -1.779
  807    HB2  ASN  94           2HB      ASN  94  -8.408   9.392  -2.353
  808    HB3  ASN  94           3HB      ASN  94  -8.809  10.625  -3.538
  809   HD21  ASN  94          1HD2      ASN  94  -7.088   7.657  -2.967
  810   HD22  ASN  94          2HD2      ASN  94  -6.701   7.328  -4.615
  811    H    VAL  95           H        VAL  95  -4.480  10.669  -3.253
  812    HA   VAL  95           HA       VAL  95  -3.679   8.799  -1.140
  813    HB   VAL  95           HB       VAL  95  -2.106   9.989  -3.481
  814   HG11  VAL  95          1HG1      VAL  95  -0.578   9.422  -1.619
  815   HG12  VAL  95          2HG1      VAL  95  -0.342   8.316  -2.973
  816   HG13  VAL  95          3HG1      VAL  95  -1.247   7.790  -1.551
  817   HG21  VAL  95          3HG2      VAL  95  -2.294   7.739  -4.498
  818   HG22  VAL  95          1HG2      VAL  95  -3.891   8.428  -4.200
  819   HG23  VAL  95          2HG2      VAL  95  -3.252   7.186  -3.123
  820    H    THR  96           H        THR  96  -3.443   9.831   0.786
  821    HA   THR  96           HA       THR  96  -2.285  12.557   0.908
  822    HB   THR  96           HB       THR  96  -4.023  11.165   2.993
  823    HG1  THR  96           HG1      THR  96  -5.374  11.495   1.323
  824   HG21  THR  96          3HG2      THR  96  -4.314  13.455   3.914
  825   HG22  THR  96          1HG2      THR  96  -3.235  14.096   2.670
  826   HG23  THR  96          2HG2      THR  96  -2.610  13.005   3.906
  827    H    TRP  97           H        TRP  97  -0.132  12.296   1.260
  828    HA   TRP  97           HA       TRP  97   0.964  10.220   2.953
  829    HB2  TRP  97           2HB      TRP  97   2.155  12.449   1.283
  830    HB3  TRP  97           3HB      TRP  97   3.163  11.627   2.474
  831    HD1  TRP  97           HD1      TRP  97   1.212  10.888  -0.788
  832    HE1  TRP  97           HE1      TRP  97   2.149   8.711  -1.772
  833    HE3  TRP  97           HE3      TRP  97   4.395   9.569   3.004
  834    HZ2  TRP  97           HZ2      TRP  97   3.999   6.710  -1.061
  835    HZ3  TRP  97           HZ3      TRP  97   5.722   7.502   2.772
  836    HH2  TRP  97           HH2      TRP  97   5.524   6.101   0.775
  837    H    ASP  98           H        ASP  98   2.032  10.464   4.848
  838    HA   ASP  98           HA       ASP  98   2.334  13.080   6.114
  839    HB2  ASP  98           2HB      ASP  98   0.157  12.063   6.964
  840    HB3  ASP  98           3HB      ASP  98   1.084  10.692   7.562
  841    H    GLY  99           H        GLY  99   4.383  12.406   5.104
  842    HA2  GLY  99           2HA      GLY  99   6.554  11.738   5.140
  843    HA3  GLY  99           3HA      GLY  99   6.408  11.811   6.884
  844    H    ASP 100           H        ASP 100   5.665   9.919   7.960
  845    HA   ASP 100           HA       ASP 100   7.201   7.619   7.280
  846    HB2  ASP 100           2HB      ASP 100   7.132   8.384   9.557
  847    HB3  ASP 100           3HB      ASP 100   5.374   8.402   9.587
  848    H    THR 101           H        THR 101   3.721   8.330   7.296
  849    HA   THR 101           HA       THR 101   3.097   5.653   6.158
  850    HB   THR 101           HB       THR 101   1.461   7.083   8.309
  851    HG1  THR 101           HG1      THR 101   3.481   6.126   9.027
  852   HG21  THR 101          3HG2      THR 101   0.134   4.995   8.430
  853   HG22  THR 101          1HG2      THR 101   1.082   4.305   7.110
  854   HG23  THR 101          2HG2      THR 101   0.035   5.694   6.814
  855    H    VAL 102           H        VAL 102   1.318   5.615   4.698
  856    HA   VAL 102           HA       VAL 102   0.238   8.243   3.847
  857    HB   VAL 102           HB       VAL 102   1.713   7.337   2.096
  858   HG11  VAL 102          1HG1      VAL 102  -0.096   4.893   2.002
  859   HG12  VAL 102          2HG1      VAL 102   1.575   4.932   2.572
  860   HG13  VAL 102          3HG1      VAL 102   1.216   5.255   0.875
  861   HG21  VAL 102          3HG2      VAL 102  -1.215   7.181   1.277
  862   HG22  VAL 102          1HG2      VAL 102   0.151   7.448   0.191
  863   HG23  VAL 102          2HG2      VAL 102  -0.255   8.656   1.410
  864    H    THR 103           H        THR 103  -1.885   8.446   3.682
  865    HA   THR 103           HA       THR 103  -3.708   6.177   4.200
  866    HB   THR 103           HB       THR 103  -4.156   9.146   4.749
  867    HG1  THR 103           HG1      THR 103  -2.599   8.206   6.150
  868   HG21  THR 103          3HG2      THR 103  -6.159   8.405   6.003
  869   HG22  THR 103          1HG2      THR 103  -5.829   6.724   5.560
  870   HG23  THR 103          2HG2      THR 103  -6.278   7.895   4.320
  871    H    VAL 104           H        VAL 104  -4.515   5.540   2.276
  872    HA   VAL 104           HA       VAL 104  -5.115   7.487   0.143
  873    HB   VAL 104           HB       VAL 104  -4.980   4.438  -0.004
  874   HG11  VAL 104          1HG1      VAL 104  -5.236   6.497  -2.246
  875   HG12  VAL 104          2HG1      VAL 104  -6.487   5.367  -1.727
  876   HG13  VAL 104          3HG1      VAL 104  -5.014   4.759  -2.479
  877   HG21  VAL 104          3HG2      VAL 104  -2.764   5.403   0.463
  878   HG22  VAL 104          1HG2      VAL 104  -2.941   6.516  -0.897
  879   HG23  VAL 104          2HG2      VAL 104  -2.824   4.780  -1.186
  880    H    GLU 105           H        GLU 105  -7.190   8.155   0.086
  881    HA   GLU 105           HA       GLU 105  -9.383   6.534   1.095
  882    HB2  GLU 105           2HB      GLU 105  -9.484   8.894   1.608
  883    HB3  GLU 105           3HB      GLU 105  -9.154   9.349  -0.050
  884    HG2  GLU 105           2HG      GLU 105 -11.659   7.783   0.372
  885    HG3  GLU 105           3HG      GLU 105 -11.636   9.391   1.097
  886    H    GLY 106           H        GLY 106 -10.158   4.974  -0.201
  887    HA2  GLY 106           2HA      GLY 106  -9.784   5.130  -3.141
  888    HA3  GLY 106           3HA      GLY 106  -9.966   3.657  -2.188
  889    H    GLN 107           H        GLN 107 -11.482   3.955  -4.389
  890    HA   GLN 107           HA       GLN 107 -14.206   4.317  -3.362
  891    HB2  GLN 107           2HB      GLN 107 -14.896   5.554  -5.398
  892    HB3  GLN 107           3HB      GLN 107 -13.733   6.454  -4.445
  893    HG2  GLN 107           2HG      GLN 107 -13.112   4.959  -7.022
  894    HG3  GLN 107           3HG      GLN 107 -13.372   6.696  -6.884
  895   HE21  GLN 107          1HE2      GLN 107 -11.760   7.959  -5.798
  896   HE22  GLN 107          2HE2      GLN 107 -10.141   7.386  -5.639
  897    H    LEU 108           H        LEU 108 -15.519   2.714  -3.932
  898    HA   LEU 108           HA       LEU 108 -14.545   0.455  -5.414
  899    HB2  LEU 108           2HB      LEU 108 -16.439   0.804  -3.368
  900    HB3  LEU 108           3HB      LEU 108 -17.454   0.456  -4.749
  901    HG   LEU 108           HG       LEU 108 -17.026  -1.611  -3.577
  902   HD11  LEU 108          1HD1      LEU 108 -16.061  -2.999  -5.325
  903   HD12  LEU 108          2HD1      LEU 108 -15.342  -1.587  -6.098
  904   HD13  LEU 108          3HD1      LEU 108 -17.098  -1.762  -6.031
  905   HD21  LEU 108          3HD2      LEU 108 -14.986  -0.938  -2.378
  906   HD22  LEU 108          1HD2      LEU 108 -14.057  -1.042  -3.877
  907   HD23  LEU 108          2HD2      LEU 108 -14.775  -2.495  -3.175
  908    H    GLU 109           H        GLU 109 -14.819   0.064  -7.504
  909    HA   GLU 109           HA       GLU 109 -14.923   0.625  -9.677
  910    HB2  GLU 109           2HB      GLU 109 -17.008   0.158 -10.753
  911    HB3  GLU 109           3HB      GLU 109 -16.865  -0.890  -9.352
  912    HG2  GLU 109           2HG      GLU 109 -18.462   1.659  -9.113
  913    HG3  GLU 109           3HG      GLU 109 -19.173   0.295  -9.966
  914    H    GLY 110           H        GLY 110 -14.992   3.102  -7.866
  915    HA2  GLY 110           2HA      GLY 110 -15.967   5.180  -9.608
  916    HA3  GLY 110           3HA      GLY 110 -14.797   5.358  -8.297
  917    H    VAL 111           H        VAL 111 -13.001   3.381  -9.067
  918    HA   VAL 111           HA       VAL 111 -11.481   4.295 -11.300
  919    HB   VAL 111           HB       VAL 111 -10.118   2.258 -10.914
  920   HG11  VAL 111          1HG1      VAL 111 -10.957   3.555  -8.282
  921   HG12  VAL 111          2HG1      VAL 111  -9.759   4.190  -9.412
  922   HG13  VAL 111          3HG1      VAL 111  -9.451   2.675  -8.567
  923   HG21  VAL 111          3HG2      VAL 111 -11.918   0.617 -10.499
  924   HG22  VAL 111          1HG2      VAL 111 -12.298   1.394  -8.958
  925   HG23  VAL 111          2HG2      VAL 111 -10.745   0.585  -9.184
  926    H    ASP 112           H        ASP 112 -10.876   1.882 -12.703
  927    HA   ASP 112           HA       ASP 112 -12.636   1.922 -14.830
  928    HB2  ASP 112           2HB      ASP 112 -10.348   0.987 -14.954
  929    HB3  ASP 112           3HB      ASP 112 -10.834  -0.385 -13.964
  930    H    LEU 113           H        LEU 113 -14.683   1.274 -15.042
  931    HA   LEU 113           HA       LEU 113 -16.157  -0.304 -13.217
  932    HB2  LEU 113           2HB      LEU 113 -16.786   0.415 -16.114
  933    HB3  LEU 113           3HB      LEU 113 -17.940  -0.275 -14.983
  934    HG   LEU 113           HG       LEU 113 -16.619   2.453 -14.631
  935   HD11  LEU 113          1HD1      LEU 113 -19.427   1.832 -15.598
  936   HD12  LEU 113          2HD1      LEU 113 -18.103   2.448 -16.588
  937   HD13  LEU 113          3HD1      LEU 113 -18.757   3.438 -15.288
  938   HD21  LEU 113          3HD2      LEU 113 -18.923   1.179 -13.105
  939   HD22  LEU 113          1HD2      LEU 113 -18.307   2.819 -12.874
  940   HD23  LEU 113          2HD2      LEU 113 -17.288   1.436 -12.490
  941    H    GLU 114           H        GLU 114 -15.449  -2.313 -12.877
  942    HA   GLU 114           HA       GLU 114 -14.075  -3.924 -14.747
  943    HB2  GLU 114           2HB      GLU 114 -15.301  -4.739 -12.075
  944    HB3  GLU 114           3HB      GLU 114 -14.075  -5.638 -12.972
  945    HG2  GLU 114           2HG      GLU 114 -12.490  -3.772 -12.690
  946    HG3  GLU 114           3HG      GLU 114 -13.701  -2.857 -11.799
  947    H    HIS 115           H        HIS 115 -14.830  -5.287 -16.241
  948    HA   HIS 115           HA       HIS 115 -17.600  -5.745 -16.723
  949    HB2  HIS 115           2HB      HIS 115 -15.133  -7.062 -17.942
  950    HB3  HIS 115           3HB      HIS 115 -16.775  -7.309 -18.530
  951    HD1  HIS 115           HD1      HIS 115 -13.904  -5.099 -18.897
  952    HD2  HIS 115           HD2      HIS 115 -18.005  -4.820 -19.489
  953    HE1  HIS 115           HE1      HIS 115 -14.244  -3.084 -20.349
  954    HE2  HIS 115           HE2      HIS 115 -16.724  -2.976 -20.752
  955    H    HIS 116           H        HIS 116 -15.112  -7.512 -15.004
  956    HA   HIS 116           HA       HIS 116 -16.522  -9.859 -14.327
  957    HB2  HIS 116           2HB      HIS 116 -14.110  -9.460 -13.781
  958    HB3  HIS 116           3HB      HIS 116 -14.574  -8.228 -12.615
  959    HD1  HIS 116           HD1      HIS 116 -14.418 -11.935 -13.099
  960    HD2  HIS 116           HD2      HIS 116 -15.574  -9.245 -10.152
  961    HE1  HIS 116           HE1      HIS 116 -14.607 -13.280 -10.991
  962    HE2  HIS 116           HE2      HIS 116 -15.352 -11.640  -9.234
  963    H    HIS 117           H        HIS 117 -18.572  -9.773 -13.634
  964    HA   HIS 117           HA       HIS 117 -19.805  -7.432 -12.618
  965    HB2  HIS 117           2HB      HIS 117 -20.758 -10.242 -13.194
  966    HB3  HIS 117           3HB      HIS 117 -21.804  -9.145 -12.297
  967    HD1  HIS 117           HD1      HIS 117 -19.880  -9.115 -15.604
  968    HD2  HIS 117           HD2      HIS 117 -23.374  -7.634 -13.913
  969    HE1  HIS 117           HE1      HIS 117 -21.067  -7.902 -17.451
  970    HE2  HIS 117           HE2      HIS 117 -23.269  -7.217 -16.458
  971    H    HIS 118           H        HIS 118 -18.697  -6.926 -10.770
  972    HA   HIS 118           HA       HIS 118 -19.462  -8.401  -8.328
  973    HB2  HIS 118           2HB      HIS 118 -17.906  -6.955  -7.144
  974    HB3  HIS 118           3HB      HIS 118 -17.084  -7.598  -8.550
  975    HD1  HIS 118           HD1      HIS 118 -16.738  -5.851 -10.584
  976    HD2  HIS 118           HD2      HIS 118 -17.910  -4.218  -6.945
  977    HE1  HIS 118           HE1      HIS 118 -16.237  -3.392 -10.741
  978    HE2  HIS 118           HE2      HIS 118 -17.165  -2.417  -8.620
  979    H    HIS 119           H        HIS 119 -19.801  -6.062  -6.650
  980    HA   HIS 119           HA       HIS 119 -22.544  -5.526  -7.150
  981    HB2  HIS 119           2HB      HIS 119 -22.573  -4.611  -5.016
  982    HB3  HIS 119           3HB      HIS 119 -21.009  -5.402  -4.881
  983    HD1  HIS 119           HD1      HIS 119 -22.633  -2.118  -4.772
  984    HD2  HIS 119           HD2      HIS 119 -18.763  -3.528  -5.232
  985    HE1  HIS 119           HE1      HIS 119 -21.159  -0.124  -4.458
  986    HE2  HIS 119           HE2      HIS 119 -18.876  -0.957  -5.084
  987    H    HIS 120           H        HIS 120 -23.570  -3.508  -7.601
  988    HA   HIS 120           HA       HIS 120 -22.334  -1.034  -7.586
  989    HB2  HIS 120           2HB      HIS 120 -22.466  -0.253  -9.913
  990    HB3  HIS 120           3HB      HIS 120 -21.359  -1.609  -9.795
  991    HD1  HIS 120           HD1      HIS 120 -23.791  -0.348 -11.992
  992    HD2  HIS 120           HD2      HIS 120 -22.980  -4.148 -10.530
  993    HE1  HIS 120           HE1      HIS 120 -24.853  -1.939 -13.615
  994    HE2  HIS 120           HE2      HIS 120 -24.432  -4.219 -12.654
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1  17.398  -0.530  -2.262
    2    H2   MET   1           2H       MET   1  15.929  -1.303  -1.961
    3    H3   MET   1           3H       MET   1  16.081  -0.283  -3.296
    4    HA   MET   1           HA       MET   1  16.115  -2.626  -3.908
    5    HB2  MET   1           2HB      MET   1  18.139  -2.502  -5.333
    6    HB3  MET   1           3HB      MET   1  17.236  -0.996  -5.342
    7    HG2  MET   1           2HG      MET   1  18.860   0.045  -3.856
    8    HG3  MET   1           3HG      MET   1  19.738  -1.482  -3.706
    9    HE1  MET   1           3HE      MET   1  22.011  -0.189  -4.411
   10    HE2  MET   1           1HE      MET   1  21.119   1.321  -4.596
   11    HE3  MET   1           2HE      MET   1  22.161   0.746  -5.898
   12    H    SER   2           H        SER   2  18.515  -4.039  -4.289
   13    HA   SER   2           HA       SER   2  19.674  -5.765  -3.452
   14    HB2  SER   2           2HB      SER   2  19.717  -4.209  -0.822
   15    HB3  SER   2           3HB      SER   2  20.684  -5.644  -1.172
   16    HG   SER   2           HG       SER   2  21.087  -3.971  -3.162
   17    H    GLY   3           H        GLY   3  19.563  -7.609  -1.806
   18    HA2  GLY   3           2HA      GLY   3  16.899  -8.607  -1.691
   19    HA3  GLY   3           3HA      GLY   3  18.324  -9.358  -0.988
   20    H    LYS   4           H        LYS   4  15.784  -6.973  -0.461
   21    HA   LYS   4           HA       LYS   4  16.258  -7.077   2.464
   22    HB2  LYS   4           2HB      LYS   4  17.003  -4.899   1.502
   23    HB3  LYS   4           3HB      LYS   4  15.397  -4.639   0.837
   24    HG2  LYS   4           2HG      LYS   4  15.806  -3.333   2.912
   25    HG3  LYS   4           3HG      LYS   4  14.439  -4.435   3.060
   26    HD2  LYS   4           2HD      LYS   4  15.864  -4.358   5.108
   27    HD3  LYS   4           3HD      LYS   4  15.746  -5.977   4.415
   28    HE2  LYS   4           2HE      LYS   4  18.049  -5.463   5.161
   29    HE3  LYS   4           3HE      LYS   4  17.985  -5.733   3.420
   30    HZ1  LYS   4           3HZ      LYS   4  19.351  -3.859   3.838
   31    HZ2  LYS   4           1HZ      LYS   4  18.191  -3.140   4.833
   32    HZ3  LYS   4           2HZ      LYS   4  17.913  -3.271   3.174
   33    H    LYS   5           H        LYS   5  14.597  -7.734   3.603
   34    HA   LYS   5           HA       LYS   5  11.953  -8.108   2.445
   35    HB2  LYS   5           2HB      LYS   5  13.048  -9.826   3.958
   36    HB3  LYS   5           3HB      LYS   5  12.911  -8.681   5.290
   37    HG2  LYS   5           2HG      LYS   5  10.326  -8.686   4.655
   38    HG3  LYS   5           3HG      LYS   5  10.728 -10.204   3.854
   39    HD2  LYS   5           2HD      LYS   5   9.885 -10.674   6.091
   40    HD3  LYS   5           3HD      LYS   5  11.602 -11.086   6.041
   41    HE2  LYS   5           2HE      LYS   5  12.176  -9.021   7.192
   42    HE3  LYS   5           3HE      LYS   5  10.506  -8.457   7.099
   43    HZ1  LYS   5           3HZ      LYS   5  11.525 -10.743   8.696
   44    HZ2  LYS   5           1HZ      LYS   5   9.887 -10.394   8.481
   45    HZ3  LYS   5           2HZ      LYS   5  10.884  -9.288   9.268
   46    H    VAL   6           H        VAL   6  10.744  -6.327   2.349
   47    HA   VAL   6           HA       VAL   6  10.573  -4.440   4.619
   48    HB   VAL   6           HB       VAL   6  10.777  -3.168   2.602
   49   HG11  VAL   6          1HG1      VAL   6   9.462  -3.551   0.544
   50   HG12  VAL   6          2HG1      VAL   6   8.681  -4.948   1.293
   51   HG13  VAL   6          3HG1      VAL   6  10.414  -4.978   0.968
   52   HG21  VAL   6          3HG2      VAL   6   7.793  -3.348   3.140
   53   HG22  VAL   6          1HG2      VAL   6   8.617  -2.031   2.297
   54   HG23  VAL   6          2HG2      VAL   6   8.950  -2.333   4.002
   55    H    GLU   7           H        GLU   7   8.652  -4.225   5.751
   56    HA   GLU   7           HA       GLU   7   6.522  -6.209   5.184
   57    HB2  GLU   7           2HB      GLU   7   7.422  -5.091   7.866
   58    HB3  GLU   7           3HB      GLU   7   6.015  -6.112   7.623
   59    HG2  GLU   7           2HG      GLU   7   7.494  -7.917   6.751
   60    HG3  GLU   7           3HG      GLU   7   8.885  -6.890   7.096
   61    H    VAL   8           H        VAL   8   4.684  -5.391   4.590
   62    HA   VAL   8           HA       VAL   8   4.226  -2.465   4.708
   63    HB   VAL   8           HB       VAL   8   3.167  -4.536   2.707
   64   HG11  VAL   8          1HG1      VAL   8   2.421  -2.598   1.365
   65   HG12  VAL   8          2HG1      VAL   8   2.919  -1.500   2.655
   66   HG13  VAL   8          3HG1      VAL   8   1.612  -2.653   2.932
   67   HG21  VAL   8          3HG2      VAL   8   5.398  -2.487   2.374
   68   HG22  VAL   8          1HG2      VAL   8   4.751  -3.520   1.095
   69   HG23  VAL   8          2HG2      VAL   8   5.589  -4.240   2.469
   70    H    GLN   9           H        GLN   9   2.637  -1.871   6.100
   71    HA   GLN   9           HA       GLN   9   0.641  -3.815   7.025
   72    HB2  GLN   9           2HB      GLN   9   1.916  -2.496   8.735
   73    HB3  GLN   9           3HB      GLN   9   1.304  -0.998   8.034
   74    HG2  GLN   9           2HG      GLN   9  -1.036  -1.856   8.545
   75    HG3  GLN   9           3HG      GLN   9  -0.284  -3.151   9.469
   76   HE21  GLN   9          1HE2      GLN   9  -2.114  -1.171  10.410
   77   HE22  GLN   9          2HE2      GLN   9  -1.307  -0.261  11.637
   78    H    VAL  10           H        VAL  10  -0.967  -3.879   5.507
   79    HA   VAL  10           HA       VAL  10  -2.018  -1.385   4.328
   80    HB   VAL  10           HB       VAL  10  -2.642  -4.306   3.649
   81   HG11  VAL  10          1HG1      VAL  10  -3.509  -1.769   2.198
   82   HG12  VAL  10          2HG1      VAL  10  -4.551  -2.846   3.131
   83   HG13  VAL  10          3HG1      VAL  10  -3.794  -3.424   1.648
   84   HG21  VAL  10          3HG2      VAL  10  -1.304  -3.924   1.596
   85   HG22  VAL  10          1HG2      VAL  10  -0.332  -3.720   3.055
   86   HG23  VAL  10          2HG2      VAL  10  -0.888  -2.304   2.161
   87    H    LYS  11           H        LYS  11  -3.385  -0.447   5.743
   88    HA   LYS  11           HA       LYS  11  -5.299  -2.066   7.326
   89    HB2  LYS  11           2HB      LYS  11  -3.773  -0.616   8.627
   90    HB3  LYS  11           3HB      LYS  11  -4.231   0.785   7.667
   91    HG2  LYS  11           2HG      LYS  11  -6.612   0.458   8.576
   92    HG3  LYS  11           3HG      LYS  11  -5.921  -0.702   9.711
   93    HD2  LYS  11           2HD      LYS  11  -5.129   2.229   9.470
   94    HD3  LYS  11           3HD      LYS  11  -6.185   1.557  10.712
   95    HE2  LYS  11           2HE      LYS  11  -3.295   0.707  10.325
   96    HE3  LYS  11           3HE      LYS  11  -3.812   1.966  11.445
   97    HZ1  LYS  11           3HZ      LYS  11  -4.864  -0.800  11.545
   98    HZ2  LYS  11           1HZ      LYS  11  -5.022   0.407  12.712
   99    HZ3  LYS  11           2HZ      LYS  11  -3.517  -0.306  12.427
  100    H    ILE  12           H        ILE  12  -7.131  -2.276   6.012
  101    HA   ILE  12           HA       ILE  12  -8.188   0.206   4.754
  102    HB   ILE  12           HB       ILE  12  -7.683  -1.404   3.017
  103   HG12  ILE  12          2HG1      ILE  12 -10.700  -1.314   3.490
  104   HG13  ILE  12          3HG1      ILE  12  -9.741  -0.043   2.741
  105   HG21  ILE  12          1HG2      ILE  12  -9.445  -3.435   4.417
  106   HG22  ILE  12          2HG2      ILE  12  -7.685  -3.495   4.295
  107   HG23  ILE  12          3HG2      ILE  12  -8.671  -3.644   2.840
  108   HD11  ILE  12          3HD1      ILE  12 -10.190  -2.808   1.624
  109   HD12  ILE  12          1HD1      ILE  12  -9.214  -1.537   0.882
  110   HD13  ILE  12          2HD1      ILE  12 -10.949  -1.311   1.085
  111    H    THR  13           H        THR  13  -9.954   1.014   5.601
  112    HA   THR  13           HA       THR  13 -11.591  -0.534   7.497
  113    HB   THR  13           HB       THR  13 -11.677   2.477   6.953
  114    HG1  THR  13           HG1      THR  13  -9.875   0.920   8.402
  115   HG21  THR  13          3HG2      THR  13 -12.674   2.606   9.207
  116   HG22  THR  13          1HG2      THR  13 -12.569   0.852   9.376
  117   HG23  THR  13          2HG2      THR  13 -13.650   1.562   8.177
  118    H    CYS  14           H        CYS  14 -13.303  -1.517   6.630
  119    HA   CYS  14           HA       CYS  14 -15.242  -0.172   4.923
  120    HB2  CYS  14           2HB      CYS  14 -13.823  -1.096   3.180
  121    HB3  CYS  14           3HB      CYS  14 -13.720  -2.647   4.003
  122    H    ASN  15           H        ASN  15 -17.314  -1.230   5.029
  123    HA   ASN  15           HA       ASN  15 -19.036  -2.484   5.872
  124    HB2  ASN  15           2HB      ASN  15 -17.655  -4.445   5.116
  125    HB3  ASN  15           3HB      ASN  15 -16.877  -4.496   6.689
  126   HD21  ASN  15          1HD2      ASN  15 -17.535  -6.548   7.246
  127   HD22  ASN  15          2HD2      ASN  15 -19.185  -6.995   7.503
  128    H    GLY  16           H        GLY  16 -17.241  -0.619   7.580
  129    HA2  GLY  16           2HA      GLY  16 -17.296   0.234   9.731
  130    HA3  GLY  16           3HA      GLY  16 -18.476  -0.999  10.161
  131    H    LYS  17           H        LYS  17 -15.850  -2.431   8.696
  132    HA   LYS  17           HA       LYS  17 -14.559  -3.152  11.249
  133    HB2  LYS  17           2HB      LYS  17 -14.930  -4.795   8.697
  134    HB3  LYS  17           3HB      LYS  17 -13.955  -5.314  10.062
  135    HG2  LYS  17           2HG      LYS  17 -16.871  -4.681  10.513
  136    HG3  LYS  17           3HG      LYS  17 -16.429  -6.189   9.725
  137    HD2  LYS  17           2HD      LYS  17 -16.762  -6.570  12.108
  138    HD3  LYS  17           3HD      LYS  17 -15.070  -6.833  11.692
  139    HE2  LYS  17           2HE      LYS  17 -14.488  -4.637  12.634
  140    HE3  LYS  17           3HE      LYS  17 -16.188  -4.325  12.990
  141    HZ1  LYS  17           3HZ      LYS  17 -16.192  -6.104  14.568
  142    HZ2  LYS  17           1HZ      LYS  17 -14.894  -5.086  14.931
  143    HZ3  LYS  17           2HZ      LYS  17 -14.622  -6.564  14.157
  144    H    THR  18           H        THR  18 -12.244  -3.753  10.995
  145    HA   THR  18           HA       THR  18 -10.887  -2.321   8.778
  146    HB   THR  18           HB       THR  18  -9.829  -2.739  11.621
  147    HG1  THR  18           HG1      THR  18 -11.635  -1.144  11.166
  148   HG21  THR  18          3HG2      THR  18  -8.713  -1.072   9.322
  149   HG22  THR  18          1HG2      THR  18  -8.022  -2.588   9.911
  150   HG23  THR  18          2HG2      THR  18  -8.049  -1.167  10.955
  151    H    TYR  19           H        TYR  19  -9.987  -3.674   7.439
  152    HA   TYR  19           HA       TYR  19  -9.220  -6.413   8.231
  153    HB2  TYR  19           2HB      TYR  19  -9.717  -5.299   5.422
  154    HB3  TYR  19           3HB      TYR  19  -9.452  -6.986   5.857
  155    HD1  TYR  19           HD1      TYR  19 -11.244  -8.205   7.209
  156    HD2  TYR  19           HD2      TYR  19 -11.917  -4.337   5.519
  157    HE1  TYR  19           HE1      TYR  19 -13.673  -8.526   7.433
  158    HE2  TYR  19           HE2      TYR  19 -14.340  -4.660   5.738
  159    HH   TYR  19           HH       TYR  19 -15.941  -6.634   5.864
  160    H    GLU  20           H        GLU  20  -7.083  -6.351   8.784
  161    HA   GLU  20           HA       GLU  20  -5.197  -5.102   6.921
  162    HB2  GLU  20           2HB      GLU  20  -4.035  -3.856   8.652
  163    HB3  GLU  20           3HB      GLU  20  -5.717  -3.351   8.565
  164    HG2  GLU  20           2HG      GLU  20  -6.217  -4.698  10.585
  165    HG3  GLU  20           3HG      GLU  20  -4.519  -5.168  10.680
  166    H    ARG  21           H        ARG  21  -3.024  -5.600   7.292
  167    HA   ARG  21           HA       ARG  21  -2.111  -7.577   9.122
  168    HB2  ARG  21           2HB      ARG  21  -3.281  -9.114   7.563
  169    HB3  ARG  21           3HB      ARG  21  -2.421  -8.423   6.194
  170    HG2  ARG  21           2HG      ARG  21  -0.272  -9.276   7.190
  171    HG3  ARG  21           3HG      ARG  21  -1.221 -10.047   8.455
  172    HD2  ARG  21           2HD      ARG  21  -1.373 -10.647   5.493
  173    HD3  ARG  21           3HD      ARG  21  -0.617 -11.658   6.727
  174    HE   ARG  21           HE       ARG  21  -3.326 -11.231   7.412
  175   HH11  ARG  21          1HH1      ARG  21  -1.413 -12.984   5.017
  176   HH12  ARG  21          2HH1      ARG  21  -2.615 -14.213   4.791
  177   HH21  ARG  21          1HH2      ARG  21  -4.876 -12.869   7.122
  178   HH22  ARG  21          2HH2      ARG  21  -4.576 -14.148   5.986
  179    H    THR  22           H        THR  22   0.147  -7.574   9.150
  180    HA   THR  22           HA       THR  22   1.557  -5.722   7.369
  181    HB   THR  22           HB       THR  22   2.616  -7.332   9.748
  182    HG1  THR  22           HG1      THR  22   2.406  -5.248  10.833
  183   HG21  THR  22          3HG2      THR  22   4.392  -6.542   8.241
  184   HG22  THR  22          1HG2      THR  22   4.436  -5.667   9.774
  185   HG23  THR  22          2HG2      THR  22   3.759  -4.898   8.336
  186    H    TYR  23           H        TYR  23   2.250  -6.556   5.501
  187    HA   TYR  23           HA       TYR  23   2.477  -9.456   5.087
  188    HB2  TYR  23           2HB      TYR  23   2.377  -7.166   3.061
  189    HB3  TYR  23           3HB      TYR  23   2.369  -8.883   2.668
  190    HD1  TYR  23           HD1      TYR  23   0.373  -6.107   4.103
  191    HD2  TYR  23           HD2      TYR  23   0.309 -10.194   2.862
  192    HE1  TYR  23           HE1      TYR  23  -2.074  -6.115   4.249
  193    HE2  TYR  23           HE2      TYR  23  -2.145 -10.198   3.013
  194    HH   TYR  23           HH       TYR  23  -3.914  -9.007   4.096
  195    H    GLN  24           H        GLN  24   4.394 -10.387   4.795
  196    HA   GLN  24           HA       GLN  24   6.860  -8.792   4.794
  197    HB2  GLN  24           2HB      GLN  24   6.377 -11.812   4.962
  198    HB3  GLN  24           3HB      GLN  24   7.981 -11.095   4.856
  199    HG2  GLN  24           2HG      GLN  24   7.529 -11.651   7.159
  200    HG3  GLN  24           3HG      GLN  24   7.577  -9.899   7.004
  201   HE21  GLN  24          1HE2      GLN  24   5.662  -8.726   7.362
  202   HE22  GLN  24          2HE2      GLN  24   4.259  -9.434   8.072
  203    H    LEU  25           H        LEU  25   7.297  -7.969   2.865
  204    HA   LEU  25           HA       LEU  25   7.041  -9.570   0.383
  205    HB2  LEU  25           2HB      LEU  25   7.067  -6.524   0.711
  206    HB3  LEU  25           3HB      LEU  25   6.906  -7.392  -0.808
  207    HG   LEU  25           HG       LEU  25   4.870  -7.344   1.452
  208   HD11  LEU  25          1HD1      LEU  25   4.938  -5.263   0.171
  209   HD12  LEU  25          2HD1      LEU  25   3.438  -6.134  -0.128
  210   HD13  LEU  25          3HD1      LEU  25   4.726  -6.156  -1.336
  211   HD21  LEU  25          3HD2      LEU  25   4.830  -9.544   0.405
  212   HD22  LEU  25          1HD2      LEU  25   4.709  -8.814  -1.197
  213   HD23  LEU  25          2HD2      LEU  25   3.387  -8.637  -0.039
  214    H    TYR  26           H        TYR  26   8.951 -10.211  -0.419
  215    HA   TYR  26           HA       TYR  26  11.439  -8.812   0.401
  216    HB2  TYR  26           2HB      TYR  26  11.172 -11.200   1.128
  217    HB3  TYR  26           3HB      TYR  26  11.065 -11.695  -0.558
  218    HD1  TYR  26           HD1      TYR  26  13.318 -10.228   2.014
  219    HD2  TYR  26           HD2      TYR  26  13.090 -11.976  -1.873
  220    HE1  TYR  26           HE1      TYR  26  15.759 -10.455   1.975
  221    HE2  TYR  26           HE2      TYR  26  15.536 -12.203  -1.915
  222    HH   TYR  26           HH       TYR  26  17.467 -11.799   0.867
  223    H    ALA  27           H        ALA  27  12.315  -7.613  -1.158
  224    HA   ALA  27           HA       ALA  27  12.073  -8.442  -3.993
  225    HB1  ALA  27           3HB      ALA  27  11.998  -5.598  -2.919
  226    HB2  ALA  27           1HB      ALA  27  10.636  -6.491  -3.601
  227    HB3  ALA  27           2HB      ALA  27  12.006  -6.060  -4.625
  228    H    VAL  28           H        VAL  28  13.845  -8.067  -5.280
  229    HA   VAL  28           HA       VAL  28  16.444  -7.678  -3.946
  230    HB   VAL  28           HB       VAL  28  15.831  -8.525  -6.825
  231   HG11  VAL  28          1HG1      VAL  28  18.106  -7.634  -6.591
  232   HG12  VAL  28          2HG1      VAL  28  18.146  -9.369  -6.893
  233   HG13  VAL  28          3HG1      VAL  28  18.434  -8.751  -5.264
  234   HG21  VAL  28          3HG2      VAL  28  16.452 -10.308  -4.431
  235   HG22  VAL  28          1HG2      VAL  28  16.276 -10.852  -6.104
  236   HG23  VAL  28          2HG2      VAL  28  14.894 -10.166  -5.250
  237    H    ARG  29           H        ARG  29  14.231  -6.149  -6.163
  238    HA   ARG  29           HA       ARG  29  15.862  -3.675  -6.187
  239    HB2  ARG  29           2HB      ARG  29  14.119  -4.580  -8.535
  240    HB3  ARG  29           3HB      ARG  29  15.205  -3.197  -8.487
  241    HG2  ARG  29           2HG      ARG  29  17.154  -4.672  -8.455
  242    HG3  ARG  29           3HG      ARG  29  16.110  -6.090  -8.347
  243    HD2  ARG  29           2HD      ARG  29  15.184  -5.553 -10.600
  244    HD3  ARG  29           3HD      ARG  29  16.293  -4.176 -10.700
  245    HE   ARG  29           HE       ARG  29  17.711  -6.587 -10.151
  246   HH11  ARG  29          1HH1      ARG  29  16.108  -4.913 -12.806
  247   HH12  ARG  29          2HH1      ARG  29  17.073  -5.674 -14.032
  248   HH21  ARG  29          1HH2      ARG  29  18.969  -7.578 -11.752
  249   HH22  ARG  29          2HH2      ARG  29  18.709  -7.200 -13.426
  250    H    ASP  30           H        ASP  30  14.477  -1.698  -6.333
  251    HA   ASP  30           HA       ASP  30  12.226  -1.853  -4.579
  252    HB2  ASP  30           2HB      ASP  30  12.998   0.514  -6.336
  253    HB3  ASP  30           3HB      ASP  30  12.019   0.564  -4.870
  254    H    GLU  31           H        GLU  31  12.578  -1.692  -8.047
  255    HA   GLU  31           HA       GLU  31   9.889  -1.057  -8.753
  256    HB2  GLU  31           2HB      GLU  31  11.864  -0.609 -10.176
  257    HB3  GLU  31           3HB      GLU  31  12.123  -2.337 -10.396
  258    HG2  GLU  31           2HG      GLU  31  10.073  -2.542 -11.657
  259    HG3  GLU  31           3HG      GLU  31   9.601  -0.892 -11.265
  260    H    GLU  32           H        GLU  32  11.485  -4.015  -7.836
  261    HA   GLU  32           HA       GLU  32   9.623  -5.893  -8.930
  262    HB2  GLU  32           2HB      GLU  32  11.350  -6.244  -6.443
  263    HB3  GLU  32           3HB      GLU  32  10.586  -7.527  -7.372
  264    HG2  GLU  32           2HG      GLU  32  12.848  -5.742  -8.269
  265    HG3  GLU  32           3HG      GLU  32  12.963  -7.443  -7.841
  266    H    LEU  33           H        LEU  33   9.544  -3.749  -6.212
  267    HA   LEU  33           HA       LEU  33   7.657  -5.186  -4.600
  268    HB2  LEU  33           2HB      LEU  33   9.387  -3.029  -4.178
  269    HB3  LEU  33           3HB      LEU  33   7.828  -2.240  -4.156
  270    HG   LEU  33           HG       LEU  33   8.588  -2.819  -1.884
  271   HD11  LEU  33          1HD1      LEU  33   6.190  -4.497  -2.659
  272   HD12  LEU  33          2HD1      LEU  33   6.180  -2.780  -2.253
  273   HD13  LEU  33          3HD1      LEU  33   6.616  -3.965  -1.027
  274   HD21  LEU  33          3HD2      LEU  33   8.567  -5.704  -2.828
  275   HD22  LEU  33          1HD2      LEU  33   8.752  -5.186  -1.150
  276   HD23  LEU  33          2HD2      LEU  33   9.968  -4.752  -2.341
  277    H    LYS  34           H        LYS  34   7.347  -3.160  -7.385
  278    HA   LYS  34           HA       LYS  34   4.846  -1.973  -7.117
  279    HB2  LYS  34           2HB      LYS  34   6.375  -2.972  -9.539
  280    HB3  LYS  34           3HB      LYS  34   4.760  -2.299  -9.734
  281    HG2  LYS  34           2HG      LYS  34   5.469  -0.143  -8.912
  282    HG3  LYS  34           3HG      LYS  34   7.036  -0.785  -8.415
  283    HD2  LYS  34           2HD      LYS  34   7.099   0.557 -10.547
  284    HD3  LYS  34           3HD      LYS  34   7.741  -1.079 -10.696
  285    HE2  LYS  34           2HE      LYS  34   6.376  -0.511 -12.646
  286    HE3  LYS  34           3HE      LYS  34   5.615  -1.814 -11.734
  287    HZ1  LYS  34           3HZ      LYS  34   4.095  -0.188 -10.765
  288    HZ2  LYS  34           1HZ      LYS  34   4.014  -0.152 -12.455
  289    HZ3  LYS  34           2HZ      LYS  34   4.852   1.055 -11.627
  290    H    GLU  35           H        GLU  35   5.515  -5.124  -8.720
  291    HA   GLU  35           HA       GLU  35   2.889  -5.890  -9.242
  292    HB2  GLU  35           2HB      GLU  35   3.757  -8.183  -9.519
  293    HB3  GLU  35           3HB      GLU  35   4.798  -7.009 -10.308
  294    HG2  GLU  35           2HG      GLU  35   6.528  -7.284  -8.744
  295    HG3  GLU  35           3HG      GLU  35   5.466  -7.969  -7.520
  296    H    LYS  36           H        LYS  36   4.816  -6.334  -6.360
  297    HA   LYS  36           HA       LYS  36   3.217  -8.273  -5.051
  298    HB2  LYS  36           2HB      LYS  36   5.141  -6.236  -3.840
  299    HB3  LYS  36           3HB      LYS  36   4.563  -7.704  -3.053
  300    HG2  LYS  36           2HG      LYS  36   5.763  -9.099  -4.657
  301    HG3  LYS  36           3HG      LYS  36   6.233  -7.677  -5.594
  302    HD2  LYS  36           2HD      LYS  36   7.488  -6.853  -3.539
  303    HD3  LYS  36           3HD      LYS  36   7.173  -8.423  -2.791
  304    HE2  LYS  36           2HE      LYS  36   8.657  -8.021  -5.414
  305    HE3  LYS  36           3HE      LYS  36   9.428  -8.260  -3.849
  306    HZ1  LYS  36           3HZ      LYS  36   7.583 -10.211  -5.105
  307    HZ2  LYS  36           1HZ      LYS  36   8.498 -10.439  -3.704
  308    HZ3  LYS  36           2HZ      LYS  36   9.266 -10.298  -5.204
  309    H    LEU  37           H        LEU  37   3.450  -4.722  -4.776
  310    HA   LEU  37           HA       LEU  37   1.406  -4.354  -2.861
  311    HB2  LEU  37           2HB      LEU  37   2.539  -2.449  -4.944
  312    HB3  LEU  37           3HB      LEU  37   1.416  -1.957  -3.684
  313    HG   LEU  37           HG       LEU  37   4.183  -3.111  -3.189
  314   HD11  LEU  37          1HD1      LEU  37   4.302  -0.890  -4.195
  315   HD12  LEU  37          2HD1      LEU  37   4.818  -0.844  -2.513
  316   HD13  LEU  37          3HD1      LEU  37   3.218  -0.248  -2.959
  317   HD21  LEU  37          3HD2      LEU  37   2.160  -1.973  -1.229
  318   HD22  LEU  37          1HD2      LEU  37   3.809  -2.468  -0.840
  319   HD23  LEU  37          2HD2      LEU  37   2.637  -3.667  -1.376
  320    H    LYS  38           H        LYS  38   1.293  -4.342  -6.457
  321    HA   LYS  38           HA       LYS  38  -1.371  -3.561  -6.800
  322    HB2  LYS  38           2HB      LYS  38   0.334  -5.441  -8.487
  323    HB3  LYS  38           3HB      LYS  38  -1.202  -4.751  -9.012
  324    HG2  LYS  38           2HG      LYS  38  -0.294  -2.512  -9.003
  325    HG3  LYS  38           3HG      LYS  38   1.187  -3.064  -8.216
  326    HD2  LYS  38           2HD      LYS  38   1.605  -2.685 -10.594
  327    HD3  LYS  38           3HD      LYS  38   1.761  -4.402 -10.221
  328    HE2  LYS  38           2HE      LYS  38  -0.468  -4.832 -11.157
  329    HE3  LYS  38           3HE      LYS  38  -0.689  -3.106 -11.470
  330    HZ1  LYS  38           3HZ      LYS  38   0.021  -4.390 -13.434
  331    HZ2  LYS  38           1HZ      LYS  38   1.484  -4.742 -12.663
  332    HZ3  LYS  38           2HZ      LYS  38   1.087  -3.142 -13.035
  333    H    LYS  39           H        LYS  39   0.045  -6.794  -6.289
  334    HA   LYS  39           HA       LYS  39  -2.409  -8.226  -6.406
  335    HB2  LYS  39           2HB      LYS  39   0.382  -8.883  -5.435
  336    HB3  LYS  39           3HB      LYS  39  -0.935  -9.971  -5.014
  337    HG2  LYS  39           2HG      LYS  39  -0.136  -9.194  -7.839
  338    HG3  LYS  39           3HG      LYS  39   0.249 -10.720  -7.036
  339    HD2  LYS  39           2HD      LYS  39  -2.143 -11.272  -6.871
  340    HD3  LYS  39           3HD      LYS  39  -2.575  -9.722  -7.597
  341    HE2  LYS  39           2HE      LYS  39  -1.029 -11.947  -8.969
  342    HE3  LYS  39           3HE      LYS  39  -2.727 -11.541  -9.227
  343    HZ1  LYS  39           3HZ      LYS  39  -0.414  -9.789  -9.807
  344    HZ2  LYS  39           1HZ      LYS  39  -2.037  -9.360 -10.010
  345    HZ3  LYS  39           2HZ      LYS  39  -1.365 -10.597 -10.945
  346    H    VAL  40           H        VAL  40  -0.451  -7.210  -3.567
  347    HA   VAL  40           HA       VAL  40  -2.117  -8.265  -1.596
  348    HB   VAL  40           HB       VAL  40  -0.145  -5.926  -1.481
  349   HG11  VAL  40          1HG1      VAL  40  -0.200  -6.114   0.984
  350   HG12  VAL  40          2HG1      VAL  40  -1.520  -7.281   0.870
  351   HG13  VAL  40          3HG1      VAL  40  -1.764  -5.617   0.335
  352   HG21  VAL  40          3HG2      VAL  40   0.110  -8.813  -0.516
  353   HG22  VAL  40          1HG2      VAL  40   1.350  -7.561  -0.363
  354   HG23  VAL  40          2HG2      VAL  40   0.865  -8.134  -1.958
  355    H    LEU  41           H        LEU  41  -2.160  -4.995  -3.057
  356    HA   LEU  41           HA       LEU  41  -4.268  -3.967  -1.431
  357    HB2  LEU  41           2HB      LEU  41  -3.096  -3.041  -4.084
  358    HB3  LEU  41           3HB      LEU  41  -4.396  -2.174  -3.279
  359    HG   LEU  41           HG       LEU  41  -1.668  -2.678  -2.017
  360   HD11  LEU  41          1HD1      LEU  41  -2.684  -0.139  -3.344
  361   HD12  LEU  41          2HD1      LEU  41  -1.432  -1.214  -3.970
  362   HD13  LEU  41          3HD1      LEU  41  -1.155  -0.324  -2.477
  363   HD21  LEU  41          3HD2      LEU  41  -3.470  -2.383  -0.382
  364   HD22  LEU  41          1HD2      LEU  41  -3.944  -0.863  -1.150
  365   HD23  LEU  41          2HD2      LEU  41  -2.368  -1.011  -0.365
  366    H    ASN  42           H        ASN  42  -4.285  -5.037  -4.892
  367    HA   ASN  42           HA       ASN  42  -7.030  -4.546  -5.340
  368    HB2  ASN  42           2HB      ASN  42  -5.303  -4.773  -7.149
  369    HB3  ASN  42           3HB      ASN  42  -5.206  -6.501  -6.819
  370   HD21  ASN  42          1HD2      ASN  42  -5.861  -7.106  -8.879
  371   HD22  ASN  42          2HD2      ASN  42  -7.469  -6.881  -9.460
  372    H    GLU  43           H        GLU  43  -5.351  -7.455  -4.261
  373    HA   GLU  43           HA       GLU  43  -7.659  -9.183  -4.456
  374    HB2  GLU  43           2HB      GLU  43  -4.912  -9.635  -3.230
  375    HB3  GLU  43           3HB      GLU  43  -6.130 -10.883  -3.406
  376    HG2  GLU  43           2HG      GLU  43  -4.705  -9.406  -5.639
  377    HG3  GLU  43           3HG      GLU  43  -4.485 -11.089  -5.177
  378    H    ARG  44           H        ARG  44  -5.986  -7.439  -1.827
  379    HA   ARG  44           HA       ARG  44  -7.603  -8.431   0.302
  380    HB2  ARG  44           2HB      ARG  44  -5.399  -7.100   0.483
  381    HB3  ARG  44           3HB      ARG  44  -6.348  -5.652   0.191
  382    HG2  ARG  44           2HG      ARG  44  -5.875  -5.964   2.578
  383    HG3  ARG  44           3HG      ARG  44  -7.613  -6.049   2.273
  384    HD2  ARG  44           2HD      ARG  44  -7.719  -8.335   2.718
  385    HD3  ARG  44           3HD      ARG  44  -6.029  -8.620   2.302
  386    HE   ARG  44           HE       ARG  44  -5.503  -7.378   4.421
  387   HH11  ARG  44          1HH1      ARG  44  -8.529  -9.171   4.155
  388   HH12  ARG  44          2HH1      ARG  44  -8.618  -9.473   5.867
  389   HH21  ARG  44          1HH2      ARG  44  -5.588  -7.893   6.608
  390   HH22  ARG  44          2HH2      ARG  44  -6.959  -8.750   7.248
  391    H    MET  45           H        MET  45  -7.958  -5.869  -2.048
  392    HA   MET  45           HA       MET  45 -10.429  -4.842  -0.916
  393    HB2  MET  45           2HB      MET  45  -8.874  -4.057  -3.405
  394    HB3  MET  45           3HB      MET  45 -10.372  -3.285  -2.895
  395    HG2  MET  45           2HG      MET  45  -9.181  -2.771  -0.686
  396    HG3  MET  45           3HG      MET  45  -7.695  -3.245  -1.502
  397    HE1  MET  45           3HE      MET  45 -10.323   0.296  -2.881
  398    HE2  MET  45           1HE      MET  45 -10.744  -0.745  -1.520
  399    HE3  MET  45           2HE      MET  45 -10.776  -1.384  -3.166
  400    H    ASP  46           H        ASP  46  -9.666  -7.441  -2.888
  401    HA   ASP  46           HA       ASP  46 -11.746  -7.413  -4.775
  402    HB2  ASP  46           2HB      ASP  46  -9.802  -8.891  -5.004
  403    HB3  ASP  46           3HB      ASP  46 -10.272  -9.801  -3.574
  404    HA   PRO  47           HA       PRO  47 -14.602  -9.749  -1.538
  405    HB2  PRO  47           2HB      PRO  47 -13.893  -9.584   1.125
  406    HB3  PRO  47           3HB      PRO  47 -13.445 -10.952   0.083
  407    HG2  PRO  47           2HG      PRO  47 -11.797  -8.555   0.848
  408    HG3  PRO  47           3HG      PRO  47 -11.332 -10.272   0.821
  409    HD2  PRO  47           2HD      PRO  47 -10.652  -8.609  -1.177
  410    HD3  PRO  47           3HD      PRO  47 -11.087 -10.305  -1.498
  411    H    ILE  48           H        ILE  48 -12.863  -6.770  -0.920
  412    HA   ILE  48           HA       ILE  48 -14.885  -5.399   0.604
  413    HB   ILE  48           HB       ILE  48 -12.555  -4.265  -1.016
  414   HG12  ILE  48          2HG1      ILE  48 -11.752  -5.827   0.699
  415   HG13  ILE  48          3HG1      ILE  48 -11.301  -4.184   1.116
  416   HG21  ILE  48          1HG2      ILE  48 -14.191  -2.511  -0.568
  417   HG22  ILE  48          2HG2      ILE  48 -12.727  -2.246   0.379
  418   HG23  ILE  48          3HG2      ILE  48 -14.170  -2.899   1.154
  419   HD11  ILE  48          3HD1      ILE  48 -13.126  -4.135   2.768
  420   HD12  ILE  48          1HD1      ILE  48 -11.948  -5.411   3.067
  421   HD13  ILE  48          2HD1      ILE  48 -13.510  -5.809   2.360
  422    H    LYS  49           H        LYS  49 -14.207  -5.892  -2.798
  423    HA   LYS  49           HA       LYS  49 -16.006  -3.948  -3.882
  424    HB2  LYS  49           2HB      LYS  49 -14.868  -6.502  -5.099
  425    HB3  LYS  49           3HB      LYS  49 -15.753  -5.274  -6.002
  426    HG2  LYS  49           2HG      LYS  49 -14.007  -3.622  -5.545
  427    HG3  LYS  49           3HG      LYS  49 -13.146  -4.782  -4.537
  428    HD2  LYS  49           2HD      LYS  49 -12.975  -6.261  -6.633
  429    HD3  LYS  49           3HD      LYS  49 -13.537  -4.853  -7.542
  430    HE2  LYS  49           2HE      LYS  49 -11.586  -3.557  -6.686
  431    HE3  LYS  49           3HE      LYS  49 -11.021  -5.004  -5.844
  432    HZ1  LYS  49           3HZ      LYS  49  -9.890  -4.726  -7.946
  433    HZ2  LYS  49           1HZ      LYS  49 -11.357  -4.724  -8.782
  434    HZ3  LYS  49           2HZ      LYS  49 -10.835  -6.125  -7.991
  435    H    LYS  50           H        LYS  50 -16.265  -7.345  -2.941
  436    HA   LYS  50           HA       LYS  50 -18.968  -7.759  -3.760
  437    HB2  LYS  50           2HB      LYS  50 -17.087  -9.493  -3.226
  438    HB3  LYS  50           3HB      LYS  50 -17.520  -9.289  -1.540
  439    HG2  LYS  50           2HG      LYS  50 -19.459 -10.227  -3.692
  440    HG3  LYS  50           3HG      LYS  50 -18.497 -11.313  -2.699
  441    HD2  LYS  50           2HD      LYS  50 -20.675  -9.428  -1.735
  442    HD3  LYS  50           3HD      LYS  50 -20.766 -11.187  -1.826
  443    HE2  LYS  50           2HE      LYS  50 -18.992 -11.372  -0.120
  444    HE3  LYS  50           3HE      LYS  50 -18.884  -9.612  -0.029
  445    HZ1  LYS  50           3HZ      LYS  50 -20.229 -10.539   1.760
  446    HZ2  LYS  50           1HZ      LYS  50 -21.294 -11.217   0.636
  447    HZ3  LYS  50           2HZ      LYS  50 -21.153  -9.541   0.763
  448    H    LEU  51           H        LEU  51 -17.415  -6.504  -0.847
  449    HA   LEU  51           HA       LEU  51 -19.754  -6.331   0.813
  450    HB2  LEU  51           2HB      LEU  51 -17.118  -4.808   0.912
  451    HB3  LEU  51           3HB      LEU  51 -18.368  -4.659   2.135
  452    HG   LEU  51           HG       LEU  51 -16.804  -7.193   1.510
  453   HD11  LEU  51          1HD1      LEU  51 -16.614  -5.334   3.905
  454   HD12  LEU  51          2HD1      LEU  51 -15.426  -5.491   2.609
  455   HD13  LEU  51          3HD1      LEU  51 -15.733  -6.848   3.686
  456   HD21  LEU  51          3HD2      LEU  51 -19.064  -7.746   2.256
  457   HD22  LEU  51          1HD2      LEU  51 -18.880  -6.706   3.674
  458   HD23  LEU  51          2HD2      LEU  51 -17.884  -8.155   3.496
  459    H    GLY  52           H        GLY  52 -18.194  -4.244  -1.549
  460    HA2  GLY  52           2HA      GLY  52 -19.039  -2.566  -2.854
  461    HA3  GLY  52           3HA      GLY  52 -20.615  -2.831  -2.127
  462    H    CYS  53           H        CYS  53 -17.542  -1.938  -0.550
  463    HA   CYS  53           HA       CYS  53 -18.670   0.435   0.630
  464    HB2  CYS  53           2HB      CYS  53 -15.866  -0.718   0.568
  465    HB3  CYS  53           3HB      CYS  53 -16.167   0.887   1.225
  466    H    LYS  54           H        LYS  54 -19.088   2.187  -0.558
  467    HA   LYS  54           HA       LYS  54 -18.264   2.736  -3.189
  468    HB2  LYS  54           2HB      LYS  54 -19.275   4.994  -2.810
  469    HB3  LYS  54           3HB      LYS  54 -20.314   3.690  -2.243
  470    HG2  LYS  54           2HG      LYS  54 -19.557   4.083   0.079
  471    HG3  LYS  54           3HG      LYS  54 -18.530   5.403  -0.484
  472    HD2  LYS  54           2HD      LYS  54 -20.537   6.659  -1.221
  473    HD3  LYS  54           3HD      LYS  54 -21.570   5.327  -0.687
  474    HE2  LYS  54           2HE      LYS  54 -20.807   5.661   1.643
  475    HE3  LYS  54           3HE      LYS  54 -19.756   6.979   1.114
  476    HZ1  LYS  54           3HZ      LYS  54 -21.718   8.207   0.405
  477    HZ2  LYS  54           1HZ      LYS  54 -21.815   7.809   2.044
  478    HZ3  LYS  54           2HZ      LYS  54 -22.720   6.944   0.911
  479    H    ARG  55           H        ARG  55 -16.919   3.662  -0.102
  480    HA   ARG  55           HA       ARG  55 -14.409   4.539  -1.328
  481    HB2  ARG  55           2HB      ARG  55 -15.822   6.618  -0.904
  482    HB3  ARG  55           3HB      ARG  55 -15.847   6.203   0.808
  483    HG2  ARG  55           2HG      ARG  55 -13.242   6.290   0.662
  484    HG3  ARG  55           3HG      ARG  55 -13.494   7.121  -0.875
  485    HD2  ARG  55           2HD      ARG  55 -13.210   8.792   0.834
  486    HD3  ARG  55           3HD      ARG  55 -14.916   8.813   0.365
  487    HE   ARG  55           HE       ARG  55 -14.638   7.055   2.515
  488   HH11  ARG  55          1HH1      ARG  55 -14.324  10.516   1.975
  489   HH12  ARG  55          2HH1      ARG  55 -14.731  10.920   3.611
  490   HH21  ARG  55          1HH2      ARG  55 -15.137   7.595   4.644
  491   HH22  ARG  55          2HH2      ARG  55 -15.190   9.265   5.125
  492    H    VAL  56           H        VAL  56 -12.661   4.102   0.006
  493    HA   VAL  56           HA       VAL  56 -13.114   2.876   2.668
  494    HB   VAL  56           HB       VAL  56 -11.356   1.175   2.186
  495   HG11  VAL  56          1HG1      VAL  56 -13.699   0.533   1.928
  496   HG12  VAL  56          2HG1      VAL  56 -12.701  -0.313   0.746
  497   HG13  VAL  56          3HG1      VAL  56 -13.690   1.062   0.243
  498   HG21  VAL  56          3HG2      VAL  56 -11.487   2.137  -0.701
  499   HG22  VAL  56          1HG2      VAL  56 -10.584   0.737  -0.115
  500   HG23  VAL  56          2HG2      VAL  56 -10.126   2.359   0.400
  501    H    ARG  57           H        ARG  57 -11.439   3.240   4.157
  502    HA   ARG  57           HA       ARG  57  -9.423   5.277   3.394
  503    HB2  ARG  57           2HB      ARG  57 -10.935   5.876   5.255
  504    HB3  ARG  57           3HB      ARG  57 -10.470   4.425   6.137
  505    HG2  ARG  57           2HG      ARG  57  -8.218   5.261   6.458
  506    HG3  ARG  57           3HG      ARG  57  -8.526   6.640   5.398
  507    HD2  ARG  57           2HD      ARG  57 -10.209   7.493   7.018
  508    HD3  ARG  57           3HD      ARG  57  -9.873   6.115   8.070
  509    HE   ARG  57           HE       ARG  57  -7.786   7.020   8.610
  510   HH11  ARG  57          1HH1      ARG  57  -9.483   9.146   6.372
  511   HH12  ARG  57          2HH1      ARG  57  -8.452  10.501   6.698
  512   HH21  ARG  57          1HH2      ARG  57  -6.434   8.808   8.999
  513   HH22  ARG  57          2HH2      ARG  57  -6.733  10.309   8.179
  514    H    ILE  58           H        ILE  58  -7.591   4.314   2.750
  515    HA   ILE  58           HA       ILE  58  -6.642   1.843   4.085
  516    HB   ILE  58           HB       ILE  58  -5.751   2.910   1.358
  517   HG12  ILE  58          2HG1      ILE  58  -7.783   0.695   1.940
  518   HG13  ILE  58          3HG1      ILE  58  -8.152   2.277   1.267
  519   HG21  ILE  58          1HG2      ILE  58  -5.299   0.198   2.685
  520   HG22  ILE  58          2HG2      ILE  58  -4.090   1.467   2.478
  521   HG23  ILE  58          3HG2      ILE  58  -4.760   0.656   1.066
  522   HD11  ILE  58          3HD1      ILE  58  -8.145   0.578  -0.448
  523   HD12  ILE  58          1HD1      ILE  58  -6.478   0.151  -0.063
  524   HD13  ILE  58          2HD1      ILE  58  -6.853   1.742  -0.731
  525    H    SER  59           H        SER  59  -5.270   2.423   5.680
  526    HA   SER  59           HA       SER  59  -3.241   4.522   5.295
  527    HB2  SER  59           2HB      SER  59  -3.992   2.936   7.804
  528    HB3  SER  59           3HB      SER  59  -2.952   4.362   7.728
  529    HG   SER  59           HG       SER  59  -5.450   4.730   6.616
  530    H    ILE  60           H        ILE  60  -1.547   3.640   4.173
  531    HA   ILE  60           HA       ILE  60  -0.534   0.950   4.840
  532    HB   ILE  60           HB       ILE  60   0.185   2.786   2.511
  533   HG12  ILE  60          2HG1      ILE  60  -1.495   0.235   2.505
  534   HG13  ILE  60          3HG1      ILE  60  -2.133   1.869   2.366
  535   HG21  ILE  60          1HG2      ILE  60   1.056  -0.080   3.007
  536   HG22  ILE  60          2HG2      ILE  60   2.085   1.349   3.117
  537   HG23  ILE  60          3HG2      ILE  60   1.411   0.868   1.560
  538   HD11  ILE  60          3HD1      ILE  60  -2.066   0.817   0.213
  539   HD12  ILE  60          1HD1      ILE  60  -0.343   0.478   0.377
  540   HD13  ILE  60          2HD1      ILE  60  -0.910   2.145   0.250
  541    H    ARG  61           H        ARG  61   1.346   0.699   5.919
  542    HA   ARG  61           HA       ARG  61   3.255   2.961   6.147
  543    HB2  ARG  61           2HB      ARG  61   2.406   1.046   8.374
  544    HB3  ARG  61           3HB      ARG  61   3.792   2.132   8.483
  545    HG2  ARG  61           2HG      ARG  61   2.193   4.053   8.068
  546    HG3  ARG  61           3HG      ARG  61   0.871   2.903   8.247
  547    HD2  ARG  61           2HD      ARG  61   2.962   3.418  10.380
  548    HD3  ARG  61           3HD      ARG  61   1.417   4.256  10.296
  549    HE   ARG  61           HE       ARG  61   1.597   1.315  10.608
  550   HH11  ARG  61          1HH1      ARG  61   0.357   4.428  11.685
  551   HH12  ARG  61          2HH1      ARG  61  -0.674   3.739  12.901
  552   HH21  ARG  61          1HH2      ARG  61   0.313   0.433  12.270
  553   HH22  ARG  61          2HH2      ARG  61  -0.695   1.471  13.234
  554    H    VAL  62           H        VAL  62   5.343   2.463   5.799
  555    HA   VAL  62           HA       VAL  62   6.014  -0.273   4.927
  556    HB   VAL  62           HB       VAL  62   6.485   1.647   3.379
  557   HG11  VAL  62          1HG1      VAL  62   8.573   2.550   5.376
  558   HG12  VAL  62          2HG1      VAL  62   7.072   3.401   4.997
  559   HG13  VAL  62          3HG1      VAL  62   8.315   3.213   3.758
  560   HG21  VAL  62          3HG2      VAL  62   8.962   0.181   4.321
  561   HG22  VAL  62          1HG2      VAL  62   8.798   1.025   2.777
  562   HG23  VAL  62          2HG2      VAL  62   7.788  -0.375   3.126
  563    H    LYS  63           H        LYS  63   7.532  -1.535   6.058
  564    HA   LYS  63           HA       LYS  63   8.479  -0.567   8.643
  565    HB2  LYS  63           2HB      LYS  63   7.661  -2.913   8.403
  566    HB3  LYS  63           3HB      LYS  63   8.956  -3.250   7.257
  567    HG2  LYS  63           2HG      LYS  63  10.633  -2.811   9.032
  568    HG3  LYS  63           3HG      LYS  63   9.330  -2.489  10.180
  569    HD2  LYS  63           2HD      LYS  63   8.519  -4.823   9.884
  570    HD3  LYS  63           3HD      LYS  63   9.842  -5.131   8.758
  571    HE2  LYS  63           2HE      LYS  63  10.168  -4.396  11.687
  572    HE3  LYS  63           3HE      LYS  63  10.303  -6.020  11.015
  573    HZ1  LYS  63           3HZ      LYS  63  12.184  -5.245   9.682
  574    HZ2  LYS  63           1HZ      LYS  63  12.469  -5.052  11.336
  575    HZ3  LYS  63           2HZ      LYS  63  12.065  -3.715  10.388
  576    H    HIS  64           H        HIS  64  10.310   0.538   8.776
  577    HA   HIS  64           HA       HIS  64  11.876   1.091   6.462
  578    HB2  HIS  64           2HB      HIS  64  12.450   1.863   9.347
  579    HB3  HIS  64           3HB      HIS  64  13.118   2.625   7.907
  580    HD1  HIS  64           HD1      HIS  64  11.107   3.720  10.348
  581    HD2  HIS  64           HD2      HIS  64  10.332   3.263   6.293
  582    HE1  HIS  64           HE1      HIS  64   9.243   5.314   9.829
  583    HE2  HIS  64           HE2      HIS  64   8.902   5.126   7.352
  584    H    SER  65           H        SER  65  13.777   0.279   5.837
  585    HA   SER  65           HA       SER  65  14.740  -2.187   6.699
  586    HB2  SER  65           2HB      SER  65  15.177  -1.477   4.467
  587    HB3  SER  65           3HB      SER  65  15.961   0.007   4.999
  588    HG   SER  65           HG       SER  65  17.735  -1.100   5.535
  589    H    ASP  66           H        ASP  66  16.124   1.045   7.294
  590    HA   ASP  66           HA       ASP  66  17.378   0.186   9.807
  591    HB2  ASP  66           2HB      ASP  66  18.959   1.528   7.548
  592    HB3  ASP  66           3HB      ASP  66  19.555   1.292   9.186
  593    H    ALA  67           H        ALA  67  18.558   2.287  10.736
  594    HA   ALA  67           HA       ALA  67  16.628   4.294  11.232
  595    HB1  ALA  67           3HB      ALA  67  18.419   5.423  12.482
  596    HB2  ALA  67           1HB      ALA  67  19.622   4.353  11.745
  597    HB3  ALA  67           2HB      ALA  67  18.396   3.694  12.827
  598    H    ALA  68           H        ALA  68  19.672   4.390   9.356
  599    HA   ALA  68           HA       ALA  68  19.402   7.013   8.318
  600    HB1  ALA  68           3HB      ALA  68  21.562   5.835   8.405
  601    HB2  ALA  68           1HB      ALA  68  21.212   6.394   6.769
  602    HB3  ALA  68           2HB      ALA  68  20.999   4.690   7.190
  603    H    GLU  69           H        GLU  69  18.090   3.942   7.326
  604    HA   GLU  69           HA       GLU  69  17.396   4.662   4.650
  605    HB2  GLU  69           2HB      GLU  69  16.496   2.381   6.448
  606    HB3  GLU  69           3HB      GLU  69  15.888   2.590   4.810
  607    HG2  GLU  69           2HG      GLU  69  18.819   2.253   5.498
  608    HG3  GLU  69           3HG      GLU  69  17.749   0.941   5.016
  609    H    GLU  70           H        GLU  70  15.800   5.144   7.754
  610    HA   GLU  70           HA       GLU  70  13.117   4.869   7.172
  611    HB2  GLU  70           2HB      GLU  70  14.311   6.912   9.090
  612    HB3  GLU  70           3HB      GLU  70  12.634   6.373   9.081
  613    HG2  GLU  70           2HG      GLU  70  13.512   4.023   9.492
  614    HG3  GLU  70           3HG      GLU  70  15.085   4.749   9.770
  615    H    LYS  71           H        LYS  71  14.990   7.861   6.792
  616    HA   LYS  71           HA       LYS  71  12.811   9.544   6.026
  617    HB2  LYS  71           2HB      LYS  71  15.759   9.971   5.437
  618    HB3  LYS  71           3HB      LYS  71  14.513  11.208   5.553
  619    HG2  LYS  71           2HG      LYS  71  14.289  10.746   7.976
  620    HG3  LYS  71           3HG      LYS  71  15.550   9.516   7.854
  621    HD2  LYS  71           2HD      LYS  71  15.881  12.496   7.325
  622    HD3  LYS  71           3HD      LYS  71  16.488  11.614   8.727
  623    HE2  LYS  71           2HE      LYS  71  17.939  10.263   7.179
  624    HE3  LYS  71           3HE      LYS  71  17.389  11.280   5.842
  625    HZ1  LYS  71           3HZ      LYS  71  18.841  12.238   8.252
  626    HZ2  LYS  71           1HZ      LYS  71  18.333  13.205   6.964
  627    HZ3  LYS  71           2HZ      LYS  71  19.519  12.025   6.722
  628    H    LYS  72           H        LYS  72  15.290   7.749   4.290
  629    HA   LYS  72           HA       LYS  72  14.614   8.474   1.615
  630    HB2  LYS  72           2HB      LYS  72  16.824   7.536   2.257
  631    HB3  LYS  72           3HB      LYS  72  16.068   6.023   2.737
  632    HG2  LYS  72           2HG      LYS  72  15.302   5.793   0.297
  633    HG3  LYS  72           3HG      LYS  72  16.378   7.141  -0.070
  634    HD2  LYS  72           2HD      LYS  72  17.176   4.445   1.100
  635    HD3  LYS  72           3HD      LYS  72  17.485   5.000  -0.546
  636    HE2  LYS  72           2HE      LYS  72  18.980   6.756   0.314
  637    HE3  LYS  72           3HE      LYS  72  18.642   6.249   1.972
  638    HZ1  LYS  72           3HZ      LYS  72  20.736   5.354   1.088
  639    HZ2  LYS  72           1HZ      LYS  72  19.877   4.515  -0.096
  640    HZ3  LYS  72           2HZ      LYS  72  19.658   4.137   1.536
  641    H    GLU  73           H        GLU  73  13.403   6.128   3.911
  642    HA   GLU  73           HA       GLU  73  12.517   4.122   2.061
  643    HB2  GLU  73           2HB      GLU  73  13.268   3.765   4.494
  644    HB3  GLU  73           3HB      GLU  73  11.725   4.441   5.000
  645    HG2  GLU  73           2HG      GLU  73  11.437   2.108   5.118
  646    HG3  GLU  73           3HG      GLU  73  10.622   2.566   3.627
  647    H    ALA  74           H        ALA  74  10.974   6.638   4.030
  648    HA   ALA  74           HA       ALA  74   8.303   6.257   3.359
  649    HB1  ALA  74           3HB      ALA  74   7.990   8.634   3.883
  650    HB2  ALA  74           1HB      ALA  74   9.736   8.899   3.791
  651    HB3  ALA  74           2HB      ALA  74   9.060   7.864   5.053
  652    H    LYS  75           H        LYS  75  10.676   8.357   1.702
  653    HA   LYS  75           HA       LYS  75   9.077   9.154  -0.490
  654    HB2  LYS  75           2HB      LYS  75  12.117   9.007  -0.272
  655    HB3  LYS  75           3HB      LYS  75  11.224   9.954  -1.462
  656    HG2  LYS  75           2HG      LYS  75  10.274  11.345   0.356
  657    HG3  LYS  75           3HG      LYS  75  11.162  10.384   1.544
  658    HD2  LYS  75           2HD      LYS  75  13.310  11.125   0.540
  659    HD3  LYS  75           3HD      LYS  75  12.416  12.090  -0.644
  660    HE2  LYS  75           2HE      LYS  75  13.234  13.494   1.196
  661    HE3  LYS  75           3HE      LYS  75  11.472  13.462   1.179
  662    HZ1  LYS  75           3HZ      LYS  75  13.169  11.792   2.959
  663    HZ2  LYS  75           1HZ      LYS  75  11.480  11.900   2.982
  664    HZ3  LYS  75           2HZ      LYS  75  12.419  13.236   3.413
  665    H    LYS  76           H        LYS  76  11.385   6.525  -0.113
  666    HA   LYS  76           HA       LYS  76  11.728   5.577  -2.708
  667    HB2  LYS  76           2HB      LYS  76  13.101   4.893  -0.745
  668    HB3  LYS  76           3HB      LYS  76  11.717   4.069  -0.048
  669    HG2  LYS  76           2HG      LYS  76  11.772   2.578  -2.161
  670    HG3  LYS  76           3HG      LYS  76  13.378   3.252  -2.441
  671    HD2  LYS  76           2HD      LYS  76  12.463   1.697   0.014
  672    HD3  LYS  76           3HD      LYS  76  13.551   1.116  -1.243
  673    HE2  LYS  76           2HE      LYS  76  15.248   2.758  -0.565
  674    HE3  LYS  76           3HE      LYS  76  14.147   3.425   0.646
  675    HZ1  LYS  76           3HZ      LYS  76  14.146   1.238   1.748
  676    HZ2  LYS  76           1HZ      LYS  76  15.703   1.908   1.681
  677    HZ3  LYS  76           2HZ      LYS  76  15.268   0.674   0.619
  678    H    PHE  77           H        PHE  77   9.569   4.486  -0.159
  679    HA   PHE  77           HA       PHE  77   8.126   2.592  -1.735
  680    HB2  PHE  77           2HB      PHE  77   8.604   2.579   0.813
  681    HB3  PHE  77           3HB      PHE  77   7.285   3.736   0.964
  682    HD1  PHE  77           HD1      PHE  77   8.018   0.413  -0.638
  683    HD2  PHE  77           HD2      PHE  77   5.162   2.820   1.450
  684    HE1  PHE  77           HE1      PHE  77   6.456  -1.472  -0.586
  685    HE2  PHE  77           HE2      PHE  77   3.607   0.916   1.494
  686    HZ   PHE  77           HZ       PHE  77   4.257  -1.221   0.482
  687    H    ALA  78           H        ALA  78   7.749   5.973  -0.928
  688    HA   ALA  78           HA       ALA  78   5.040   6.369  -1.626
  689    HB1  ALA  78           3HB      ALA  78   5.624   8.740  -1.829
  690    HB2  ALA  78           1HB      ALA  78   7.347   8.334  -1.815
  691    HB3  ALA  78           2HB      ALA  78   6.354   8.033  -0.388
  692    H    ALA  79           H        ALA  79   8.049   6.602  -3.544
  693    HA   ALA  79           HA       ALA  79   6.939   7.390  -5.995
  694    HB1  ALA  79           3HB      ALA  79   9.350   7.508  -5.484
  695    HB2  ALA  79           1HB      ALA  79   9.064   6.617  -6.978
  696    HB3  ALA  79           2HB      ALA  79   9.447   5.747  -5.489
  697    H    ILE  80           H        ILE  80   7.610   4.144  -4.673
  698    HA   ILE  80           HA       ILE  80   6.730   2.644  -6.915
  699    HB   ILE  80           HB       ILE  80   6.839   1.777  -3.985
  700   HG12  ILE  80          2HG1      ILE  80   9.032   2.561  -4.761
  701   HG13  ILE  80          3HG1      ILE  80   9.067   0.813  -4.572
  702   HG21  ILE  80          1HG2      ILE  80   6.983  -0.539  -4.841
  703   HG22  ILE  80          2HG2      ILE  80   6.756   0.047  -6.488
  704   HG23  ILE  80          3HG2      ILE  80   5.459   0.222  -5.305
  705   HD11  ILE  80          3HD1      ILE  80   8.856   0.561  -7.015
  706   HD12  ILE  80          1HD1      ILE  80  10.270   1.504  -6.552
  707   HD13  ILE  80          2HD1      ILE  80   8.845   2.320  -7.188
  708    H    LEU  81           H        LEU  81   5.009   3.747  -3.962
  709    HA   LEU  81           HA       LEU  81   2.551   2.408  -4.437
  710    HB2  LEU  81           2HB      LEU  81   3.370   4.767  -2.719
  711    HB3  LEU  81           3HB      LEU  81   1.676   4.333  -2.854
  712    HG   LEU  81           HG       LEU  81   3.860   2.513  -1.760
  713   HD11  LEU  81          1HD1      LEU  81   1.674   4.037  -0.298
  714   HD12  LEU  81          2HD1      LEU  81   3.403   4.393  -0.268
  715   HD13  LEU  81          3HD1      LEU  81   2.807   2.891   0.427
  716   HD21  LEU  81          3HD2      LEU  81   2.073   1.212  -2.819
  717   HD22  LEU  81          1HD2      LEU  81   0.851   2.078  -1.883
  718   HD23  LEU  81          2HD2      LEU  81   2.018   1.030  -1.070
  719    H    ASN  82           H        ASN  82   3.826   5.545  -5.369
  720    HA   ASN  82           HA       ASN  82   1.557   6.869  -6.309
  721    HB2  ASN  82           2HB      ASN  82   3.666   8.044  -6.033
  722    HB3  ASN  82           3HB      ASN  82   4.478   7.001  -7.192
  723   HD21  ASN  82          1HD2      ASN  82   2.157   9.618  -6.824
  724   HD22  ASN  82          2HD2      ASN  82   2.224  10.171  -8.459
  725    H    LYS  83           H        LYS  83   3.782   4.663  -7.959
  726    HA   LYS  83           HA       LYS  83   2.508   4.652 -10.499
  727    HB2  LYS  83           2HB      LYS  83   4.311   2.536  -9.232
  728    HB3  LYS  83           3HB      LYS  83   3.933   2.669 -10.947
  729    HG2  LYS  83           2HG      LYS  83   5.495   4.684  -9.297
  730    HG3  LYS  83           3HG      LYS  83   6.160   3.557 -10.484
  731    HD2  LYS  83           2HD      LYS  83   4.959   4.688 -12.293
  732    HD3  LYS  83           3HD      LYS  83   4.158   5.755 -11.135
  733    HE2  LYS  83           2HE      LYS  83   6.005   6.893 -12.277
  734    HE3  LYS  83           3HE      LYS  83   6.317   6.765 -10.548
  735    HZ1  LYS  83           3HZ      LYS  83   8.261   6.257 -11.926
  736    HZ2  LYS  83           1HZ      LYS  83   7.441   4.945 -12.605
  737    HZ3  LYS  83           2HZ      LYS  83   7.807   4.953 -10.955
  738    H    VAL  84           H        VAL  84   2.170   2.592  -7.606
  739    HA   VAL  84           HA       VAL  84   0.724   0.486  -8.879
  740    HB   VAL  84           HB       VAL  84   1.118   1.174  -5.930
  741   HG11  VAL  84          1HG1      VAL  84  -0.150  -1.338  -7.097
  742   HG12  VAL  84          2HG1      VAL  84  -0.960  -0.109  -6.122
  743   HG13  VAL  84          3HG1      VAL  84   0.302  -1.107  -5.406
  744   HG21  VAL  84          3HG2      VAL  84   2.405  -0.971  -7.674
  745   HG22  VAL  84          1HG2      VAL  84   2.719  -0.710  -5.956
  746   HG23  VAL  84          2HG2      VAL  84   3.174   0.520  -7.133
  747    H    PHE  85           H        PHE  85  -0.273   3.185  -6.774
  748    HA   PHE  85           HA       PHE  85  -3.047   2.732  -6.771
  749    HB2  PHE  85           2HB      PHE  85  -1.567   5.388  -6.529
  750    HB3  PHE  85           3HB      PHE  85  -3.276   5.161  -6.168
  751    HD1  PHE  85           HD1      PHE  85  -3.175   2.527  -4.701
  752    HD2  PHE  85           HD2      PHE  85  -0.685   5.996  -4.396
  753    HE1  PHE  85           HE1      PHE  85  -2.628   1.945  -2.374
  754    HE2  PHE  85           HE2      PHE  85  -0.146   5.396  -2.074
  755    HZ   PHE  85           HZ       PHE  85  -1.113   3.375  -1.065
  756    H    ALA  86           H        ALA  86  -0.978   4.516  -9.040
  757    HA   ALA  86           HA       ALA  86  -3.036   5.502 -10.751
  758    HB1  ALA  86           3HB      ALA  86  -1.225   5.926 -12.360
  759    HB2  ALA  86           1HB      ALA  86  -0.122   4.931 -11.396
  760    HB3  ALA  86           2HB      ALA  86  -0.764   6.434 -10.738
  761    H    GLU  87           H        GLU  87  -1.425   2.402 -10.500
  762    HA   GLU  87           HA       GLU  87  -2.398   1.347 -13.039
  763    HB2  GLU  87           2HB      GLU  87  -0.996  -0.003 -10.683
  764    HB3  GLU  87           3HB      GLU  87  -1.414  -0.814 -12.193
  765    HG2  GLU  87           2HG      GLU  87   0.110   0.604 -13.452
  766    HG3  GLU  87           3HG      GLU  87   0.434   1.589 -12.031
  767    H    LEU  88           H        LEU  88  -3.704   1.848  -9.946
  768    HA   LEU  88           HA       LEU  88  -5.677  -0.347 -10.170
  769    HB2  LEU  88           2HB      LEU  88  -4.760   1.212  -7.721
  770    HB3  LEU  88           3HB      LEU  88  -6.061   0.030  -7.715
  771    HG   LEU  88           HG       LEU  88  -3.136  -0.574  -8.306
  772   HD11  LEU  88          1HD1      LEU  88  -4.768  -1.246  -5.841
  773   HD12  LEU  88          2HD1      LEU  88  -3.498  -0.025  -5.949
  774   HD13  LEU  88          3HD1      LEU  88  -3.097  -1.728  -6.153
  775   HD21  LEU  88          3HD2      LEU  88  -3.782  -2.950  -8.254
  776   HD22  LEU  88          1HD2      LEU  88  -4.590  -2.076  -9.557
  777   HD23  LEU  88          2HD2      LEU  88  -5.477  -2.484  -8.088
  778    H    GLY  89           H        GLY  89  -5.271   2.902 -10.747
  779    HA2  GLY  89           2HA      GLY  89  -6.816   4.368 -11.638
  780    HA3  GLY  89           3HA      GLY  89  -8.110   3.286 -11.161
  781    H    TYR  90           H        TYR  90  -5.927   4.160  -8.634
  782    HA   TYR  90           HA       TYR  90  -7.860   5.972  -7.408
  783    HB2  TYR  90           2HB      TYR  90  -5.141   5.114  -6.312
  784    HB3  TYR  90           3HB      TYR  90  -6.453   5.873  -5.410
  785    HD1  TYR  90           HD2      TYR  90  -8.804   4.259  -6.331
  786    HD2  TYR  90           HD1      TYR  90  -4.853   3.023  -5.255
  787    HE1  TYR  90           HE2      TYR  90  -9.651   2.024  -5.757
  788    HE2  TYR  90           HE1      TYR  90  -5.707   0.794  -4.687
  789    HH   TYR  90           HH       TYR  90  -7.762  -0.300  -4.108
  790    H    ASN  91           H        ASN  91  -7.553   8.132  -7.116
  791    HA   ASN  91           HA       ASN  91  -5.756   9.467  -8.954
  792    HB2  ASN  91           2HB      ASN  91  -8.168  10.111  -8.629
  793    HB3  ASN  91           3HB      ASN  91  -7.784  10.645  -7.001
  794   HD21  ASN  91          1HD2      ASN  91  -7.424  11.365 -10.407
  795   HD22  ASN  91          2HD2      ASN  91  -6.875  12.989 -10.207
  796    H    ASP  92           H        ASP  92  -4.228  11.123  -8.340
  797    HA   ASP  92           HA       ASP  92  -2.539  10.394  -6.174
  798    HB2  ASP  92           2HB      ASP  92  -2.486  12.793  -8.056
  799    HB3  ASP  92           3HB      ASP  92  -1.210  12.444  -6.892
  800    H    SER  93           H        SER  93  -4.876  13.007  -6.588
  801    HA   SER  93           HA       SER  93  -4.399  14.520  -4.308
  802    HB2  SER  93           2HB      SER  93  -7.138  13.895  -5.479
  803    HB3  SER  93           3HB      SER  93  -6.710  15.298  -4.488
  804    HG   SER  93           HG       SER  93  -5.983  14.686  -7.137
  805    H    ASN  94           H        ASN  94  -5.851  11.333  -4.514
  806    HA   ASN  94           HA       ASN  94  -7.033  11.299  -1.878
  807    HB2  ASN  94           2HB      ASN  94  -6.300   8.921  -3.652
  808    HB3  ASN  94           3HB      ASN  94  -7.409   8.897  -2.280
  809   HD21  ASN  94          1HD2      ASN  94  -8.013   8.044  -4.925
  810   HD22  ASN  94          2HD2      ASN  94  -9.261   9.066  -5.544
  811    H    VAL  95           H        VAL  95  -3.839  10.913  -3.068
  812    HA   VAL  95           HA       VAL  95  -2.919   9.042  -1.003
  813    HB   VAL  95           HB       VAL  95  -1.402  10.284  -3.367
  814   HG11  VAL  95          1HG1      VAL  95   0.112   9.496  -1.601
  815   HG12  VAL  95          2HG1      VAL  95   0.238   8.480  -3.036
  816   HG13  VAL  95          3HG1      VAL  95  -0.653   7.903  -1.626
  817   HG21  VAL  95          3HG2      VAL  95  -1.755   8.141  -4.553
  818   HG22  VAL  95          1HG2      VAL  95  -3.288   8.936  -4.188
  819   HG23  VAL  95          2HG2      VAL  95  -2.757   7.557  -3.221
  820    H    THR  96           H        THR  96  -2.512  10.065   0.931
  821    HA   THR  96           HA       THR  96  -1.009  12.631   0.936
  822    HB   THR  96           HB       THR  96  -3.296  11.907   2.846
  823    HG1  THR  96           HG1      THR  96  -4.378  12.316   1.022
  824   HG21  THR  96          3HG2      THR  96  -1.690  13.534   3.787
  825   HG22  THR  96          1HG2      THR  96  -3.245  14.293   3.442
  826   HG23  THR  96          2HG2      THR  96  -1.878  14.558   2.359
  827    H    TRP  97           H        TRP  97   0.941  12.211   1.839
  828    HA   TRP  97           HA       TRP  97   1.341  10.154   3.885
  829    HB2  TRP  97           2HB      TRP  97   3.245  11.964   2.330
  830    HB3  TRP  97           3HB      TRP  97   3.799  11.014   3.703
  831    HD1  TRP  97           HD1      TRP  97   2.420  10.507   0.114
  832    HE1  TRP  97           HE1      TRP  97   3.127   8.165  -0.687
  833    HE3  TRP  97           HE3      TRP  97   4.514   8.738   4.445
  834    HZ2  TRP  97           HZ2      TRP  97   4.413   5.876   0.363
  835    HZ3  TRP  97           HZ3      TRP  97   5.464   6.462   4.461
  836    HH2  TRP  97           HH2      TRP  97   5.413   5.059   2.456
  837    H    ASP  98           H        ASP  98   1.047  10.613   5.967
  838    HA   ASP  98           HA       ASP  98   2.223  13.040   7.155
  839    HB2  ASP  98           2HB      ASP  98  -0.566  11.940   7.770
  840    HB3  ASP  98           3HB      ASP  98   0.285  13.053   8.837
  841    H    GLY  99           H        GLY  99   3.813  12.299   8.391
  842    HA2  GLY  99           2HA      GLY  99   4.946  11.197  10.056
  843    HA3  GLY  99           3HA      GLY  99   3.390  10.672  10.666
  844    H    ASP 100           H        ASP 100   4.962   9.955   7.566
  845    HA   ASP 100           HA       ASP 100   5.592   8.102   6.475
  846    HB2  ASP 100           2HB      ASP 100   6.180   7.145   9.312
  847    HB3  ASP 100           3HB      ASP 100   6.524   6.151   7.902
  848    H    THR 101           H        THR 101   2.798   8.452   7.579
  849    HA   THR 101           HA       THR 101   1.771   5.749   6.926
  850    HB   THR 101           HB       THR 101   0.350   7.942   8.529
  851    HG1  THR 101           HG1      THR 101   2.195   6.983   9.624
  852   HG21  THR 101          3HG2      THR 101  -1.243   6.164   9.139
  853   HG22  THR 101          1HG2      THR 101  -0.357   4.994   8.159
  854   HG23  THR 101          2HG2      THR 101  -1.189   6.348   7.387
  855    H    VAL 102           H        VAL 102   0.877   5.760   4.900
  856    HA   VAL 102           HA       VAL 102   0.045   8.346   3.738
  857    HB   VAL 102           HB       VAL 102   1.686   7.165   2.397
  858   HG11  VAL 102          1HG1      VAL 102  -0.232   4.840   2.226
  859   HG12  VAL 102          2HG1      VAL 102   1.326   4.862   3.050
  860   HG13  VAL 102          3HG1      VAL 102   1.258   5.013   1.294
  861   HG21  VAL 102          3HG2      VAL 102  -1.045   7.120   1.077
  862   HG22  VAL 102          1HG2      VAL 102   0.503   7.140   0.225
  863   HG23  VAL 102          2HG2      VAL 102   0.022   8.516   1.219
  864    H    THR 103           H        THR 103  -2.006   8.779   3.893
  865    HA   THR 103           HA       THR 103  -4.051   6.717   4.230
  866    HB   THR 103           HB       THR 103  -4.246   9.768   4.448
  867    HG1  THR 103           HG1      THR 103  -3.061   9.233   6.179
  868   HG21  THR 103          3HG2      THR 103  -6.354   9.335   5.626
  869   HG22  THR 103          1HG2      THR 103  -6.169   7.597   5.373
  870   HG23  THR 103          2HG2      THR 103  -6.420   8.673   3.995
  871    H    VAL 104           H        VAL 104  -5.063   6.070   2.449
  872    HA   VAL 104           HA       VAL 104  -5.418   7.862   0.123
  873    HB   VAL 104           HB       VAL 104  -4.755   4.868  -0.036
  874   HG11  VAL 104          1HG1      VAL 104  -4.587   5.231  -2.480
  875   HG12  VAL 104          2HG1      VAL 104  -5.098   6.910  -2.276
  876   HG13  VAL 104          3HG1      VAL 104  -6.208   5.596  -1.881
  877   HG21  VAL 104          3HG2      VAL 104  -2.585   5.538  -0.984
  878   HG22  VAL 104          1HG2      VAL 104  -2.777   6.143   0.659
  879   HG23  VAL 104          2HG2      VAL 104  -2.969   7.236  -0.713
  880    H    GLU 105           H        GLU 105  -7.561   8.228   0.041
  881    HA   GLU 105           HA       GLU 105  -9.474   6.147   0.728
  882    HB2  GLU 105           2HB      GLU 105  -9.765   9.026  -0.179
  883    HB3  GLU 105           3HB      GLU 105 -11.150   7.940  -0.186
  884    HG2  GLU 105           2HG      GLU 105 -11.105   9.323   1.839
  885    HG3  GLU 105           3HG      GLU 105 -10.971   7.609   2.218
  886    H    GLY 106           H        GLY 106  -9.742   4.573  -0.631
  887    HA2  GLY 106           2HA      GLY 106  -9.482   4.959  -3.555
  888    HA3  GLY 106           3HA      GLY 106  -9.338   3.433  -2.683
  889    H    GLN 107           H        GLN 107 -11.136   4.145  -4.907
  890    HA   GLN 107           HA       GLN 107 -13.727   3.643  -3.570
  891    HB2  GLN 107           2HB      GLN 107 -14.821   5.206  -5.166
  892    HB3  GLN 107           3HB      GLN 107 -13.734   6.003  -4.040
  893    HG2  GLN 107           2HG      GLN 107 -12.021   6.172  -5.825
  894    HG3  GLN 107           3HG      GLN 107 -13.138   5.394  -6.949
  895   HE21  GLN 107          1HE2      GLN 107 -14.994   6.557  -7.638
  896   HE22  GLN 107          2HE2      GLN 107 -15.094   8.277  -7.495
  897    H    LEU 108           H        LEU 108 -15.125   2.382  -4.618
  898    HA   LEU 108           HA       LEU 108 -14.626   1.374  -7.286
  899    HB2  LEU 108           2HB      LEU 108 -14.721  -1.034  -6.609
  900    HB3  LEU 108           3HB      LEU 108 -13.261  -0.224  -6.111
  901    HG   LEU 108           HG       LEU 108 -13.909  -1.842  -4.438
  902   HD11  LEU 108          1HD1      LEU 108 -13.961  -0.517  -2.395
  903   HD12  LEU 108          2HD1      LEU 108 -14.404   0.918  -3.322
  904   HD13  LEU 108          3HD1      LEU 108 -12.834   0.157  -3.578
  905   HD21  LEU 108          3HD2      LEU 108 -15.963  -1.809  -3.135
  906   HD22  LEU 108          1HD2      LEU 108 -16.324  -2.016  -4.849
  907   HD23  LEU 108          2HD2      LEU 108 -16.581  -0.449  -4.076
  908    H    GLU 109           H        GLU 109 -16.420   0.259  -8.172
  909    HA   GLU 109           HA       GLU 109 -19.020   0.794  -6.904
  910    HB2  GLU 109           2HB      GLU 109 -18.636   1.402  -9.290
  911    HB3  GLU 109           3HB      GLU 109 -18.298  -0.283  -9.672
  912    HG2  GLU 109           2HG      GLU 109 -20.551   0.356 -10.375
  913    HG3  GLU 109           3HG      GLU 109 -20.600  -0.890  -9.131
  914    H    GLY 110           H        GLY 110 -16.774  -1.758  -7.566
  915    HA2  GLY 110           2HA      GLY 110 -16.699  -3.881  -6.636
  916    HA3  GLY 110           3HA      GLY 110 -18.387  -3.757  -6.173
  917    H    VAL 111           H        VAL 111 -19.851  -3.452  -8.196
  918    HA   VAL 111           HA       VAL 111 -19.504  -5.707  -9.986
  919    HB   VAL 111           HB       VAL 111 -21.703  -5.070 -10.907
  920   HG11  VAL 111          1HG1      VAL 111 -23.072  -5.377  -8.870
  921   HG12  VAL 111          2HG1      VAL 111 -21.677  -4.984  -7.859
  922   HG13  VAL 111          3HG1      VAL 111 -21.662  -6.434  -8.867
  923   HG21  VAL 111          3HG2      VAL 111 -22.989  -3.143 -10.035
  924   HG22  VAL 111          1HG2      VAL 111 -21.517  -2.617 -10.853
  925   HG23  VAL 111          2HG2      VAL 111 -21.590  -2.623  -9.089
  926    H    ASP 112           H        ASP 112 -19.543  -5.507 -12.341
  927    HA   ASP 112           HA       ASP 112 -17.554  -3.723 -13.295
  928    HB2  ASP 112           2HB      ASP 112 -18.192  -6.091 -14.167
  929    HB3  ASP 112           3HB      ASP 112 -19.431  -5.287 -15.120
  930    H    LEU 113           H        LEU 113 -17.711  -2.024 -14.825
  931    HA   LEU 113           HA       LEU 113 -19.923  -0.249 -14.221
  932    HB2  LEU 113           2HB      LEU 113 -17.351   0.243 -15.762
  933    HB3  LEU 113           3HB      LEU 113 -18.486   1.486 -15.260
  934    HG   LEU 113           HG       LEU 113 -16.837  -0.258 -13.380
  935   HD11  LEU 113          1HD1      LEU 113 -15.450   1.365 -14.579
  936   HD12  LEU 113          2HD1      LEU 113 -15.583   1.788 -12.876
  937   HD13  LEU 113          3HD1      LEU 113 -16.516   2.682 -14.080
  938   HD21  LEU 113          3HD2      LEU 113 -17.652   1.227 -11.588
  939   HD22  LEU 113          1HD2      LEU 113 -18.966   0.329 -12.349
  940   HD23  LEU 113          2HD2      LEU 113 -18.721   2.033 -12.737
  941    H    GLU 114           H        GLU 114 -19.330  -2.384 -16.809
  942    HA   GLU 114           HA       GLU 114 -20.767  -0.806 -18.814
  943    HB2  GLU 114           2HB      GLU 114 -20.519  -2.818 -20.268
  944    HB3  GLU 114           3HB      GLU 114 -19.001  -2.182 -19.666
  945    HG2  GLU 114           2HG      GLU 114 -18.755  -4.518 -19.594
  946    HG3  GLU 114           3HG      GLU 114 -19.035  -4.035 -17.927
  947    H    HIS 115           H        HIS 115 -22.439  -2.836 -19.969
  948    HA   HIS 115           HA       HIS 115 -24.806  -2.601 -18.384
  949    HB2  HIS 115           2HB      HIS 115 -24.306  -4.463 -20.752
  950    HB3  HIS 115           3HB      HIS 115 -25.878  -4.018 -20.101
  951    HD1  HIS 115           HD1      HIS 115 -26.879  -1.789 -20.880
  952    HD2  HIS 115           HD2      HIS 115 -23.050  -2.458 -22.356
  953    HE1  HIS 115           HE1      HIS 115 -26.539  -0.073 -22.679
  954    HE2  HIS 115           HE2      HIS 115 -24.234  -0.512 -23.573
  955    H    HIS 116           H        HIS 116 -24.153  -3.542 -16.342
  956    HA   HIS 116           HA       HIS 116 -22.933  -6.144 -16.234
  957    HB2  HIS 116           2HB      HIS 116 -22.306  -4.390 -14.629
  958    HB3  HIS 116           3HB      HIS 116 -23.946  -4.350 -13.986
  959    HD1  HIS 116           HD1      HIS 116 -24.555  -6.097 -12.239
  960    HD2  HIS 116           HD2      HIS 116 -20.840  -6.778 -13.978
  961    HE1  HIS 116           HE1      HIS 116 -23.542  -7.993 -10.946
  962    HE2  HIS 116           HE2      HIS 116 -21.344  -8.440 -12.067
  963    H    HIS 117           H        HIS 117 -23.972  -7.980 -16.331
  964    HA   HIS 117           HA       HIS 117 -26.712  -8.337 -15.306
  965    HB2  HIS 117           2HB      HIS 117 -24.857 -10.187 -16.887
  966    HB3  HIS 117           3HB      HIS 117 -26.427 -10.682 -16.265
  967    HD1  HIS 117           HD1      HIS 117 -27.753 -10.977 -18.354
  968    HD2  HIS 117           HD2      HIS 117 -25.713  -7.363 -18.340
  969    HE1  HIS 117           HE1      HIS 117 -28.508  -9.779 -20.418
  970    HE2  HIS 117           HE2      HIS 117 -27.066  -7.731 -20.502
  971    H    HIS 118           H        HIS 118 -26.820  -8.841 -13.135
  972    HA   HIS 118           HA       HIS 118 -24.685 -10.287 -11.802
  973    HB2  HIS 118           2HB      HIS 118 -26.047  -8.601 -10.555
  974    HB3  HIS 118           3HB      HIS 118 -27.471  -9.624 -10.742
  975    HD1  HIS 118           HD1      HIS 118 -27.900 -10.688  -8.508
  976    HD2  HIS 118           HD2      HIS 118 -23.834 -10.511  -9.361
  977    HE1  HIS 118           HE1      HIS 118 -26.758 -11.855  -6.597
  978    HE2  HIS 118           HE2      HIS 118 -24.331 -11.891  -7.232
  979    H    HIS 119           H        HIS 119 -24.467 -12.276 -12.710
  980    HA   HIS 119           HA       HIS 119 -26.672 -13.858 -13.634
  981    HB2  HIS 119           2HB      HIS 119 -25.049 -15.484 -14.340
  982    HB3  HIS 119           3HB      HIS 119 -24.339 -13.904 -14.637
  983    HD1  HIS 119           HD1      HIS 119 -23.976 -16.952 -12.460
  984    HD2  HIS 119           HD2      HIS 119 -21.998 -13.357 -13.153
  985    HE1  HIS 119           HE1      HIS 119 -21.747 -17.167 -11.319
  986    HE2  HIS 119           HE2      HIS 119 -20.533 -15.034 -11.857
  987    H    HIS 120           H        HIS 120 -27.159 -16.023 -12.930
  988    HA   HIS 120           HA       HIS 120 -26.651 -16.584 -10.060
  989    HB2  HIS 120           2HB      HIS 120 -29.021 -15.964 -10.448
  990    HB3  HIS 120           3HB      HIS 120 -29.170 -17.183 -11.707
  991    HD1  HIS 120           HD1      HIS 120 -29.370 -19.647 -10.939
  992    HD2  HIS 120           HD2      HIS 120 -29.174 -16.944  -7.790
  993    HE1  HIS 120           HE1      HIS 120 -30.065 -20.935  -8.909
  994    HE2  HIS 120           HE2      HIS 120 -29.782 -19.333  -6.997
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1  22.518  -3.805  -4.657
    2    H2   MET   1           2H       MET   1  22.849  -2.891  -6.043
    3    H3   MET   1           3H       MET   1  21.278  -3.424  -5.740
    4    HA   MET   1           HA       MET   1  22.782  -1.537  -4.040
    5    HB2  MET   1           2HB      MET   1  22.161  -0.576  -6.274
    6    HB3  MET   1           3HB      MET   1  20.480  -0.988  -5.974
    7    HG2  MET   1           2HG      MET   1  22.066   0.919  -4.241
    8    HG3  MET   1           3HG      MET   1  21.071   1.429  -5.599
    9    HE1  MET   1           3HE      MET   1  20.106   3.070  -3.556
   10    HE2  MET   1           1HE      MET   1  20.948   2.168  -2.292
   11    HE3  MET   1           2HE      MET   1  19.207   2.430  -2.182
   12    H    SER   2           H        SER   2  19.405  -2.461  -4.894
   13    HA   SER   2           HA       SER   2  18.557  -2.157  -2.122
   14    HB2  SER   2           2HB      SER   2  16.260  -2.604  -3.135
   15    HB3  SER   2           3HB      SER   2  17.095  -1.201  -3.796
   16    HG   SER   2           HG       SER   2  17.091  -3.778  -4.983
   17    H    GLY   3           H        GLY   3  17.970  -3.823  -0.784
   18    HA2  GLY   3           2HA      GLY   3  17.498  -6.538  -1.656
   19    HA3  GLY   3           3HA      GLY   3  19.059  -6.334  -0.855
   20    H    LYS   4           H        LYS   4  15.756  -5.159  -0.437
   21    HA   LYS   4           HA       LYS   4  15.924  -5.677   2.469
   22    HB2  LYS   4           2HB      LYS   4  14.488  -3.474   0.938
   23    HB3  LYS   4           3HB      LYS   4  14.159  -3.814   2.629
   24    HG2  LYS   4           2HG      LYS   4  16.930  -3.069   1.638
   25    HG3  LYS   4           3HG      LYS   4  15.730  -1.865   2.097
   26    HD2  LYS   4           2HD      LYS   4  17.025  -2.094   4.043
   27    HD3  LYS   4           3HD      LYS   4  15.621  -3.099   4.378
   28    HE2  LYS   4           2HE      LYS   4  17.669  -4.199   5.133
   29    HE3  LYS   4           3HE      LYS   4  16.958  -5.114   3.805
   30    HZ1  LYS   4           3HZ      LYS   4  19.358  -4.887   3.588
   31    HZ2  LYS   4           1HZ      LYS   4  19.216  -3.203   3.565
   32    HZ3  LYS   4           2HZ      LYS   4  18.564  -4.125   2.307
   33    H    LYS   5           H        LYS   5  14.565  -7.156   3.232
   34    HA   LYS   5           HA       LYS   5  12.034  -7.783   1.923
   35    HB2  LYS   5           2HB      LYS   5  13.339  -9.580   3.073
   36    HB3  LYS   5           3HB      LYS   5  13.184  -8.709   4.597
   37    HG2  LYS   5           2HG      LYS   5  10.664  -8.939   4.374
   38    HG3  LYS   5           3HG      LYS   5  10.946  -9.976   2.978
   39    HD2  LYS   5           2HD      LYS   5  10.547 -11.421   4.836
   40    HD3  LYS   5           3HD      LYS   5  12.276 -11.510   4.506
   41    HE2  LYS   5           2HE      LYS   5  11.074  -9.735   6.658
   42    HE3  LYS   5           3HE      LYS   5  11.626 -11.380   6.955
   43    HZ1  LYS   5           3HZ      LYS   5  13.319  -9.860   7.583
   44    HZ2  LYS   5           1HZ      LYS   5  13.302  -9.094   6.076
   45    HZ3  LYS   5           2HZ      LYS   5  13.847 -10.686   6.212
   46    H    VAL   6           H        VAL   6  10.591  -6.183   2.112
   47    HA   VAL   6           HA       VAL   6  10.439  -4.513   4.541
   48    HB   VAL   6           HB       VAL   6  10.565  -3.190   2.501
   49   HG11  VAL   6          1HG1      VAL   6   9.844  -4.906   0.877
   50   HG12  VAL   6          2HG1      VAL   6   8.990  -3.381   0.629
   51   HG13  VAL   6          3HG1      VAL   6   8.176  -4.731   1.428
   52   HG21  VAL   6          3HG2      VAL   6   7.677  -3.191   3.443
   53   HG22  VAL   6          1HG2      VAL   6   8.499  -1.876   2.596
   54   HG23  VAL   6          2HG2      VAL   6   9.013  -2.338   4.219
   55    H    GLU   7           H        GLU   7   8.560  -4.417   5.752
   56    HA   GLU   7           HA       GLU   7   6.474  -6.447   5.184
   57    HB2  GLU   7           2HB      GLU   7   7.274  -5.167   7.834
   58    HB3  GLU   7           3HB      GLU   7   5.970  -6.333   7.619
   59    HG2  GLU   7           2HG      GLU   7   7.600  -8.035   6.868
   60    HG3  GLU   7           3HG      GLU   7   8.903  -6.864   7.056
   61    H    VAL   8           H        VAL   8   4.806  -5.581   4.279
   62    HA   VAL   8           HA       VAL   8   4.126  -2.728   4.545
   63    HB   VAL   8           HB       VAL   8   3.340  -4.800   2.428
   64   HG11  VAL   8          1HG1      VAL   8   2.708  -1.825   2.469
   65   HG12  VAL   8          2HG1      VAL   8   1.543  -3.129   2.710
   66   HG13  VAL   8          3HG1      VAL   8   2.348  -2.945   1.152
   67   HG21  VAL   8          3HG2      VAL   8   5.715  -4.130   2.309
   68   HG22  VAL   8          1HG2      VAL   8   5.241  -2.429   2.229
   69   HG23  VAL   8          2HG2      VAL   8   4.816  -3.530   0.915
   70    H    GLN   9           H        GLN   9   2.490  -2.286   5.891
   71    HA   GLN   9           HA       GLN   9   0.568  -4.365   6.705
   72    HB2  GLN   9           2HB      GLN   9   1.022  -1.599   7.932
   73    HB3  GLN   9           3HB      GLN   9   0.090  -2.925   8.623
   74    HG2  GLN   9           2HG      GLN   9   2.213  -4.240   8.835
   75    HG3  GLN   9           3HG      GLN   9   3.099  -2.834   8.250
   76   HE21  GLN   9          1HE2      GLN   9   1.318  -4.184  10.931
   77   HE22  GLN   9          2HE2      GLN   9   1.783  -2.995  12.097
   78    H    VAL  10           H        VAL  10  -1.031  -4.361   5.164
   79    HA   VAL  10           HA       VAL  10  -2.116  -1.819   4.159
   80    HB   VAL  10           HB       VAL  10  -2.721  -4.685   3.276
   81   HG11  VAL  10          1HG1      VAL  10  -3.669  -2.062   2.051
   82   HG12  VAL  10          2HG1      VAL  10  -4.677  -3.229   2.909
   83   HG13  VAL  10          3HG1      VAL  10  -3.937  -3.673   1.371
   84   HG21  VAL  10          3HG2      VAL  10  -0.443  -3.999   2.678
   85   HG22  VAL  10          1HG2      VAL  10  -1.052  -2.512   1.945
   86   HG23  VAL  10          2HG2      VAL  10  -1.443  -4.076   1.226
   87    H    LYS  11           H        LYS  11  -3.524  -0.945   5.442
   88    HA   LYS  11           HA       LYS  11  -5.485  -2.522   7.004
   89    HB2  LYS  11           2HB      LYS  11  -3.922  -1.080   8.308
   90    HB3  LYS  11           3HB      LYS  11  -4.396   0.320   7.359
   91    HG2  LYS  11           2HG      LYS  11  -6.686   0.165   8.279
   92    HG3  LYS  11           3HG      LYS  11  -6.204  -1.236   9.238
   93    HD2  LYS  11           2HD      LYS  11  -5.089   1.586   9.496
   94    HD3  LYS  11           3HD      LYS  11  -6.215   0.812  10.611
   95    HE2  LYS  11           2HE      LYS  11  -4.481  -0.875  11.168
   96    HE3  LYS  11           3HE      LYS  11  -3.353  -0.070  10.074
   97    HZ1  LYS  11           3HZ      LYS  11  -3.483   1.907  11.455
   98    HZ2  LYS  11           1HZ      LYS  11  -3.004   0.576  12.381
   99    HZ3  LYS  11           2HZ      LYS  11  -4.587   1.153  12.482
  100    H    ILE  12           H        ILE  12  -7.680  -2.152   6.520
  101    HA   ILE  12           HA       ILE  12  -8.411   0.249   4.990
  102    HB   ILE  12           HB       ILE  12  -8.033  -1.401   3.231
  103   HG12  ILE  12          2HG1      ILE  12 -11.019  -0.899   3.647
  104   HG13  ILE  12          3HG1      ILE  12  -9.880   0.204   2.885
  105   HG21  ILE  12          1HG2      ILE  12 -10.064  -3.191   4.587
  106   HG22  ILE  12          2HG2      ILE  12  -8.327  -3.472   4.513
  107   HG23  ILE  12          3HG2      ILE  12  -9.288  -3.498   3.033
  108   HD11  ILE  12          3HD1      ILE  12 -11.246  -0.926   1.237
  109   HD12  ILE  12          1HD1      ILE  12 -10.698  -2.498   1.815
  110   HD13  ILE  12          2HD1      ILE  12  -9.555  -1.387   1.057
  111    H    THR  13           H        THR  13 -10.323   1.110   5.586
  112    HA   THR  13           HA       THR  13 -12.052  -0.352   7.482
  113    HB   THR  13           HB       THR  13 -12.059   2.626   6.786
  114    HG1  THR  13           HG1      THR  13 -10.524   1.102   8.535
  115   HG21  THR  13          3HG2      THR  13 -14.214   1.841   7.736
  116   HG22  THR  13          1HG2      THR  13 -13.355   2.863   8.892
  117   HG23  THR  13          2HG2      THR  13 -13.356   1.110   9.093
  118    H    CYS  14           H        CYS  14 -13.855  -1.244   6.668
  119    HA   CYS  14           HA       CYS  14 -15.529  -0.021   4.649
  120    HB2  CYS  14           2HB      CYS  14 -14.190  -1.066   3.009
  121    HB3  CYS  14           3HB      CYS  14 -13.812  -2.434   4.041
  122    H    ASN  15           H        ASN  15 -17.594  -0.662   4.896
  123    HA   ASN  15           HA       ASN  15 -19.498  -1.644   5.556
  124    HB2  ASN  15           2HB      ASN  15 -18.625  -3.832   4.925
  125    HB3  ASN  15           3HB      ASN  15 -17.761  -3.977   6.449
  126   HD21  ASN  15          1HD2      ASN  15 -21.105  -2.804   6.088
  127   HD22  ASN  15          2HD2      ASN  15 -21.832  -4.130   6.920
  128    H    GLY  16           H        GLY  16 -16.942  -1.853   7.976
  129    HA2  GLY  16           2HA      GLY  16 -17.761  -0.295   9.978
  130    HA3  GLY  16           3HA      GLY  16 -18.763  -1.726  10.246
  131    H    LYS  17           H        LYS  17 -15.938  -2.709   8.777
  132    HA   LYS  17           HA       LYS  17 -14.592  -3.351  11.335
  133    HB2  LYS  17           2HB      LYS  17 -14.673  -5.050   8.795
  134    HB3  LYS  17           3HB      LYS  17 -13.876  -5.470  10.309
  135    HG2  LYS  17           2HG      LYS  17 -16.134  -5.495  11.424
  136    HG3  LYS  17           3HG      LYS  17 -16.864  -5.211   9.842
  137    HD2  LYS  17           2HD      LYS  17 -16.969  -7.598  10.389
  138    HD3  LYS  17           3HD      LYS  17 -15.886  -7.349   9.016
  139    HE2  LYS  17           2HE      LYS  17 -13.938  -7.510  10.526
  140    HE3  LYS  17           3HE      LYS  17 -15.019  -7.740  11.901
  141    HZ1  LYS  17           3HZ      LYS  17 -14.835  -9.562   9.565
  142    HZ2  LYS  17           1HZ      LYS  17 -15.787  -9.792  10.943
  143    HZ3  LYS  17           2HZ      LYS  17 -14.100  -9.823  11.064
  144    H    THR  18           H        THR  18 -12.277  -3.714  11.107
  145    HA   THR  18           HA       THR  18 -10.985  -2.186   8.925
  146    HB   THR  18           HB       THR  18  -9.938  -2.522  11.779
  147    HG1  THR  18           HG1      THR  18 -11.955  -1.136  11.265
  148   HG21  THR  18          3HG2      THR  18  -8.392  -0.695  11.162
  149   HG22  THR  18          1HG2      THR  18  -9.064  -0.660   9.534
  150   HG23  THR  18          2HG2      THR  18  -8.175  -2.082  10.091
  151    H    TYR  19           H        TYR  19  -9.879  -3.487   7.623
  152    HA   TYR  19           HA       TYR  19  -9.146  -6.231   8.437
  153    HB2  TYR  19           2HB      TYR  19  -9.300  -5.209   5.562
  154    HB3  TYR  19           3HB      TYR  19  -9.389  -6.871   6.134
  155    HD1  TYR  19           HD2      TYR  19 -11.281  -3.689   5.793
  156    HD2  TYR  19           HD1      TYR  19 -11.544  -7.821   6.852
  157    HE1  TYR  19           HE2      TYR  19 -13.720  -3.529   5.776
  158    HE2  TYR  19           HE1      TYR  19 -14.001  -7.651   6.838
  159    HH   TYR  19           HH       TYR  19 -15.672  -4.856   5.645
  160    H    GLU  20           H        GLU  20  -7.118  -6.047   9.226
  161    HA   GLU  20           HA       GLU  20  -5.031  -4.671   7.655
  162    HB2  GLU  20           2HB      GLU  20  -4.091  -3.713   9.756
  163    HB3  GLU  20           3HB      GLU  20  -5.690  -3.085   9.381
  164    HG2  GLU  20           2HG      GLU  20  -6.680  -4.580  11.086
  165    HG3  GLU  20           3HG      GLU  20  -5.078  -5.206  11.467
  166    H    ARG  21           H        ARG  21  -2.998  -5.525   7.790
  167    HA   ARG  21           HA       ARG  21  -2.190  -7.588   9.578
  168    HB2  ARG  21           2HB      ARG  21  -3.702  -8.990   8.255
  169    HB3  ARG  21           3HB      ARG  21  -2.998  -8.423   6.747
  170    HG2  ARG  21           2HG      ARG  21  -0.989  -9.668   7.096
  171    HG3  ARG  21           3HG      ARG  21  -1.379  -9.974   8.789
  172    HD2  ARG  21           2HD      ARG  21  -2.953 -11.075   6.435
  173    HD3  ARG  21           3HD      ARG  21  -1.710 -11.969   7.317
  174    HE   ARG  21           HE       ARG  21  -4.215 -10.970   8.560
  175   HH11  ARG  21          1HH1      ARG  21  -1.811 -13.517   8.231
  176   HH12  ARG  21          2HH1      ARG  21  -2.568 -14.541   9.408
  177   HH21  ARG  21          1HH2      ARG  21  -5.158 -12.312  10.141
  178   HH22  ARG  21          2HH2      ARG  21  -4.455 -13.861  10.484
  179    H    THR  22           H        THR  22   0.021  -7.940   9.456
  180    HA   THR  22           HA       THR  22   1.604  -6.165   7.773
  181    HB   THR  22           HB       THR  22   2.499  -8.139   9.929
  182    HG1  THR  22           HG1      THR  22   2.593  -6.164  11.224
  183   HG21  THR  22          3HG2      THR  22   3.944  -5.743   8.732
  184   HG22  THR  22          1HG2      THR  22   4.354  -7.440   8.458
  185   HG23  THR  22          2HG2      THR  22   4.531  -6.737  10.066
  186    H    TYR  23           H        TYR  23   1.995  -6.899   5.744
  187    HA   TYR  23           HA       TYR  23   2.307  -9.774   5.160
  188    HB2  TYR  23           2HB      TYR  23   2.069  -7.443   3.185
  189    HB3  TYR  23           3HB      TYR  23   1.979  -9.159   2.805
  190    HD1  TYR  23           HD2      TYR  23  -0.081 -10.469   3.386
  191    HD2  TYR  23           HD1      TYR  23   0.145  -6.262   4.107
  192    HE1  TYR  23           HE2      TYR  23  -2.527 -10.374   3.675
  193    HE2  TYR  23           HE1      TYR  23  -2.280  -6.174   4.394
  194    HH   TYR  23           HH       TYR  23  -4.190  -8.929   4.791
  195    H    GLN  24           H        GLN  24   4.252 -10.593   4.605
  196    HA   GLN  24           HA       GLN  24   6.633  -8.847   4.752
  197    HB2  GLN  24           2HB      GLN  24   6.361 -11.883   5.028
  198    HB3  GLN  24           3HB      GLN  24   7.894 -11.021   5.041
  199    HG2  GLN  24           2HG      GLN  24   7.326 -11.497   7.318
  200    HG3  GLN  24           3HG      GLN  24   7.120  -9.766   7.072
  201   HE21  GLN  24          1HE2      GLN  24   5.677  -9.476   8.766
  202   HE22  GLN  24          2HE2      GLN  24   4.075 -10.130   8.766
  203    H    LEU  25           H        LEU  25   7.283  -8.137   2.858
  204    HA   LEU  25           HA       LEU  25   7.092  -9.785   0.404
  205    HB2  LEU  25           2HB      LEU  25   6.840  -6.746   0.627
  206    HB3  LEU  25           3HB      LEU  25   6.727  -7.681  -0.854
  207    HG   LEU  25           HG       LEU  25   4.739  -7.736   1.451
  208   HD11  LEU  25          1HD1      LEU  25   3.168  -6.686  -0.126
  209   HD12  LEU  25          2HD1      LEU  25   4.447  -6.576  -1.338
  210   HD13  LEU  25          3HD1      LEU  25   4.580  -5.671   0.171
  211   HD21  LEU  25          3HD2      LEU  25   4.854  -9.944   0.431
  212   HD22  LEU  25          1HD2      LEU  25   4.645  -9.251  -1.179
  213   HD23  LEU  25          2HD2      LEU  25   3.334  -9.163   0.003
  214    H    TYR  26           H        TYR  26   9.180 -10.488   0.094
  215    HA   TYR  26           HA       TYR  26  11.441  -8.622   0.407
  216    HB2  TYR  26           2HB      TYR  26  11.868 -10.812   1.364
  217    HB3  TYR  26           3HB      TYR  26  11.358 -11.628  -0.111
  218    HD1  TYR  26           HD1      TYR  26  13.943  -9.146   1.074
  219    HD2  TYR  26           HD2      TYR  26  13.056 -12.335  -1.633
  220    HE1  TYR  26           HE1      TYR  26  16.251  -9.081   0.243
  221    HE2  TYR  26           HE2      TYR  26  15.372 -12.274  -2.456
  222    HH   TYR  26           HH       TYR  26  17.245 -10.651  -2.577
  223    H    ALA  27           H        ALA  27  12.663  -7.894  -1.281
  224    HA   ALA  27           HA       ALA  27  12.351  -8.987  -3.972
  225    HB1  ALA  27           3HB      ALA  27  10.644  -7.207  -3.874
  226    HB2  ALA  27           1HB      ALA  27  11.950  -6.777  -4.980
  227    HB3  ALA  27           2HB      ALA  27  11.875  -6.045  -3.376
  228    H    VAL  28           H        VAL  28  14.095  -8.606  -5.266
  229    HA   VAL  28           HA       VAL  28  16.622  -7.804  -4.058
  230    HB   VAL  28           HB       VAL  28  16.005  -8.875  -6.864
  231   HG11  VAL  28          1HG1      VAL  28  18.404  -9.427  -7.022
  232   HG12  VAL  28          2HG1      VAL  28  18.694  -8.665  -5.456
  233   HG13  VAL  28          3HG1      VAL  28  18.153  -7.689  -6.826
  234   HG21  VAL  28          3HG2      VAL  28  15.361 -10.515  -5.153
  235   HG22  VAL  28          1HG2      VAL  28  16.960 -10.409  -4.408
  236   HG23  VAL  28          2HG2      VAL  28  16.782 -11.076  -6.034
  237    H    ARG  29           H        ARG  29  14.195  -6.544  -6.207
  238    HA   ARG  29           HA       ARG  29  15.612  -3.945  -6.303
  239    HB2  ARG  29           2HB      ARG  29  13.802  -5.020  -8.521
  240    HB3  ARG  29           3HB      ARG  29  14.628  -3.475  -8.504
  241    HG2  ARG  29           2HG      ARG  29  16.784  -4.542  -8.770
  242    HG3  ARG  29           3HG      ARG  29  16.063  -6.142  -8.573
  243    HD2  ARG  29           2HD      ARG  29  16.518  -5.704 -10.936
  244    HD3  ARG  29           3HD      ARG  29  14.777  -5.819 -10.666
  245    HE   ARG  29           HE       ARG  29  16.184  -3.212 -10.885
  246   HH11  ARG  29          1HH1      ARG  29  13.511  -5.296 -11.868
  247   HH12  ARG  29          2HH1      ARG  29  12.761  -4.069 -12.838
  248   HH21  ARG  29          1HH2      ARG  29  15.171  -1.625 -12.159
  249   HH22  ARG  29          2HH2      ARG  29  13.700  -1.997 -13.001
  250    H    ASP  30           H        ASP  30  14.276  -2.198  -5.723
  251    HA   ASP  30           HA       ASP  30  11.797  -2.657  -4.407
  252    HB2  ASP  30           2HB      ASP  30  11.607  -0.115  -4.396
  253    HB3  ASP  30           3HB      ASP  30  13.066  -0.773  -3.670
  254    H    GLU  31           H        GLU  31  12.565  -2.115  -7.753
  255    HA   GLU  31           HA       GLU  31   9.983  -1.456  -8.736
  256    HB2  GLU  31           2HB      GLU  31  12.364  -2.824 -10.034
  257    HB3  GLU  31           3HB      GLU  31  10.874  -2.519 -10.916
  258    HG2  GLU  31           2HG      GLU  31  12.604  -0.388  -9.634
  259    HG3  GLU  31           3HG      GLU  31  12.626  -0.824 -11.340
  260    H    GLU  32           H        GLU  32  11.460  -4.586  -7.861
  261    HA   GLU  32           HA       GLU  32   9.422  -6.247  -8.982
  262    HB2  GLU  32           2HB      GLU  32  11.092  -7.015  -6.557
  263    HB3  GLU  32           3HB      GLU  32  10.347  -8.089  -7.727
  264    HG2  GLU  32           2HG      GLU  32  12.766  -6.333  -8.101
  265    HG3  GLU  32           3HG      GLU  32  12.713  -8.087  -8.071
  266    H    LEU  33           H        LEU  33   9.655  -4.379  -6.082
  267    HA   LEU  33           HA       LEU  33   7.712  -5.757  -4.507
  268    HB2  LEU  33           2HB      LEU  33   9.632  -3.819  -3.990
  269    HB3  LEU  33           3HB      LEU  33   8.167  -2.868  -3.897
  270    HG   LEU  33           HG       LEU  33   8.844  -3.628  -1.672
  271   HD11  LEU  33          1HD1      LEU  33   6.438  -3.397  -2.023
  272   HD12  LEU  33          2HD1      LEU  33   6.799  -4.664  -0.855
  273   HD13  LEU  33          3HD1      LEU  33   6.328  -5.094  -2.502
  274   HD21  LEU  33          3HD2      LEU  33   8.603  -6.470  -2.709
  275   HD22  LEU  33          1HD2      LEU  33   8.887  -6.004  -1.028
  276   HD23  LEU  33          2HD2      LEU  33  10.090  -5.638  -2.257
  277    H    LYS  34           H        LYS  34   7.497  -3.383  -7.040
  278    HA   LYS  34           HA       LYS  34   5.134  -2.016  -6.458
  279    HB2  LYS  34           2HB      LYS  34   6.272  -2.777  -9.180
  280    HB3  LYS  34           3HB      LYS  34   5.006  -1.576  -8.922
  281    HG2  LYS  34           2HG      LYS  34   6.517  -0.133  -7.712
  282    HG3  LYS  34           3HG      LYS  34   7.770  -1.377  -7.701
  283    HD2  LYS  34           2HD      LYS  34   8.299   0.313  -9.371
  284    HD3  LYS  34           3HD      LYS  34   7.949  -1.223 -10.158
  285    HE2  LYS  34           2HE      LYS  34   5.670  -0.400 -10.698
  286    HE3  LYS  34           3HE      LYS  34   6.072   1.146  -9.947
  287    HZ1  LYS  34           3HZ      LYS  34   7.390  -0.046 -12.328
  288    HZ2  LYS  34           1HZ      LYS  34   7.876   1.387 -11.573
  289    HZ3  LYS  34           2HZ      LYS  34   6.357   1.294 -12.310
  290    H    GLU  35           H        GLU  35   5.501  -4.950  -8.510
  291    HA   GLU  35           HA       GLU  35   2.782  -5.366  -9.068
  292    HB2  GLU  35           2HB      GLU  35   3.410  -7.639  -9.756
  293    HB3  GLU  35           3HB      GLU  35   4.594  -6.472 -10.337
  294    HG2  GLU  35           2HG      GLU  35   6.149  -7.105  -8.563
  295    HG3  GLU  35           3HG      GLU  35   4.963  -8.206  -7.871
  296    H    LYS  36           H        LYS  36   4.750  -6.360  -6.326
  297    HA   LYS  36           HA       LYS  36   3.018  -8.305  -5.206
  298    HB2  LYS  36           2HB      LYS  36   5.079  -6.581  -3.751
  299    HB3  LYS  36           3HB      LYS  36   4.390  -8.096  -3.167
  300    HG2  LYS  36           2HG      LYS  36   5.474  -9.322  -4.999
  301    HG3  LYS  36           3HG      LYS  36   6.123  -7.809  -5.640
  302    HD2  LYS  36           2HD      LYS  36   7.387  -7.505  -3.480
  303    HD3  LYS  36           3HD      LYS  36   6.825  -9.103  -2.972
  304    HE2  LYS  36           2HE      LYS  36   8.510  -8.524  -5.433
  305    HE3  LYS  36           3HE      LYS  36   9.111  -9.171  -3.910
  306    HZ1  LYS  36           3HZ      LYS  36   7.180 -10.486  -5.735
  307    HZ2  LYS  36           1HZ      LYS  36   7.651 -11.095  -4.230
  308    HZ3  LYS  36           2HZ      LYS  36   8.786 -10.941  -5.473
  309    H    LEU  37           H        LEU  37   3.520  -4.850  -4.584
  310    HA   LEU  37           HA       LEU  37   1.662  -4.403  -2.541
  311    HB2  LEU  37           2HB      LEU  37   2.616  -2.554  -4.765
  312    HB3  LEU  37           3HB      LEU  37   1.680  -2.009  -3.379
  313    HG   LEU  37           HG       LEU  37   4.394  -3.347  -3.118
  314   HD11  LEU  37          1HD1      LEU  37   4.647  -1.294  -4.397
  315   HD12  LEU  37          2HD1      LEU  37   5.340  -1.120  -2.788
  316   HD13  LEU  37          3HD1      LEU  37   3.778  -0.387  -3.157
  317   HD21  LEU  37          3HD2      LEU  37   3.029  -3.485  -1.094
  318   HD22  LEU  37          1HD2      LEU  37   2.758  -1.739  -1.128
  319   HD23  LEU  37          2HD2      LEU  37   4.379  -2.383  -0.855
  320    H    LYS  38           H        LYS  38   1.282  -4.131  -6.098
  321    HA   LYS  38           HA       LYS  38  -1.393  -3.335  -6.220
  322    HB2  LYS  38           2HB      LYS  38   0.222  -5.029  -8.170
  323    HB3  LYS  38           3HB      LYS  38  -1.338  -4.301  -8.547
  324    HG2  LYS  38           2HG      LYS  38  -0.421  -2.063  -8.330
  325    HG3  LYS  38           3HG      LYS  38   1.116  -2.706  -7.741
  326    HD2  LYS  38           2HD      LYS  38   1.312  -2.049 -10.104
  327    HD3  LYS  38           3HD      LYS  38   1.513  -3.794  -9.929
  328    HE2  LYS  38           2HE      LYS  38  -0.914  -4.054 -10.584
  329    HE3  LYS  38           3HE      LYS  38  -0.949  -2.323 -10.925
  330    HZ1  LYS  38           3HZ      LYS  38   0.785  -4.331 -12.265
  331    HZ2  LYS  38           1HZ      LYS  38   0.811  -2.672 -12.560
  332    HZ3  LYS  38           2HZ      LYS  38  -0.569  -3.568 -12.932
  333    H    LYS  39           H        LYS  39   0.015  -6.595  -6.106
  334    HA   LYS  39           HA       LYS  39  -2.425  -8.034  -6.440
  335    HB2  LYS  39           2HB      LYS  39   0.333  -8.863  -5.470
  336    HB3  LYS  39           3HB      LYS  39  -0.996 -10.009  -5.615
  337    HG2  LYS  39           2HG      LYS  39   0.111  -8.356  -7.904
  338    HG3  LYS  39           3HG      LYS  39   0.554 -10.030  -7.562
  339    HD2  LYS  39           2HD      LYS  39  -1.747 -10.767  -7.977
  340    HD3  LYS  39           3HD      LYS  39  -2.278  -9.095  -8.197
  341    HE2  LYS  39           2HE      LYS  39  -0.254 -10.514  -9.969
  342    HE3  LYS  39           3HE      LYS  39  -1.967 -10.306 -10.347
  343    HZ1  LYS  39           3HZ      LYS  39  -1.674  -7.927 -10.286
  344    HZ2  LYS  39           1HZ      LYS  39  -0.614  -8.616 -11.399
  345    HZ3  LYS  39           2HZ      LYS  39  -0.038  -8.098  -9.902
  346    H    VAL  40           H        VAL  40  -0.523  -7.194  -3.507
  347    HA   VAL  40           HA       VAL  40  -2.174  -8.461  -1.593
  348    HB   VAL  40           HB       VAL  40  -0.396  -5.983  -1.258
  349   HG11  VAL  40          1HG1      VAL  40  -2.052  -6.078   0.557
  350   HG12  VAL  40          2HG1      VAL  40  -0.443  -6.453   1.170
  351   HG13  VAL  40          3HG1      VAL  40  -1.608  -7.752   0.901
  352   HG21  VAL  40          3HG2      VAL  40   0.197  -8.887  -0.568
  353   HG22  VAL  40          1HG2      VAL  40   1.279  -7.512  -0.311
  354   HG23  VAL  40          2HG2      VAL  40   0.854  -8.010  -1.948
  355    H    LEU  41           H        LEU  41  -2.213  -5.210  -3.001
  356    HA   LEU  41           HA       LEU  41  -4.304  -4.118  -1.441
  357    HB2  LEU  41           2HB      LEU  41  -3.029  -3.327  -4.080
  358    HB3  LEU  41           3HB      LEU  41  -4.455  -2.472  -3.509
  359    HG   LEU  41           HG       LEU  41  -1.910  -2.723  -1.854
  360   HD11  LEU  41          1HD1      LEU  41  -2.746  -0.369  -3.568
  361   HD12  LEU  41          2HD1      LEU  41  -1.421  -1.477  -3.919
  362   HD13  LEU  41          3HD1      LEU  41  -1.345  -0.443  -2.494
  363   HD21  LEU  41          3HD2      LEU  41  -2.874  -0.928  -0.521
  364   HD22  LEU  41          1HD2      LEU  41  -3.976  -2.301  -0.575
  365   HD23  LEU  41          2HD2      LEU  41  -4.296  -0.868  -1.562
  366    H    ASN  42           H        ASN  42  -4.307  -5.586  -4.718
  367    HA   ASN  42           HA       ASN  42  -7.096  -5.454  -5.142
  368    HB2  ASN  42           2HB      ASN  42  -4.829  -6.965  -6.447
  369    HB3  ASN  42           3HB      ASN  42  -6.453  -7.568  -6.744
  370   HD21  ASN  42          1HD2      ASN  42  -4.293  -4.851  -7.249
  371   HD22  ASN  42          2HD2      ASN  42  -5.229  -4.109  -8.490
  372    H    GLU  43           H        GLU  43  -5.103  -7.874  -3.511
  373    HA   GLU  43           HA       GLU  43  -7.113  -9.882  -3.219
  374    HB2  GLU  43           2HB      GLU  43  -4.653 -10.283  -3.012
  375    HB3  GLU  43           3HB      GLU  43  -4.629  -9.374  -1.513
  376    HG2  GLU  43           2HG      GLU  43  -6.471 -11.733  -1.677
  377    HG3  GLU  43           3HG      GLU  43  -4.749 -12.063  -1.596
  378    H    ARG  44           H        ARG  44  -6.026  -7.178  -1.206
  379    HA   ARG  44           HA       ARG  44  -7.826  -7.669   0.960
  380    HB2  ARG  44           2HB      ARG  44  -5.565  -6.442   1.087
  381    HB3  ARG  44           3HB      ARG  44  -6.369  -5.057   0.369
  382    HG2  ARG  44           2HG      ARG  44  -6.337  -4.600   2.673
  383    HG3  ARG  44           3HG      ARG  44  -7.984  -5.142   2.367
  384    HD2  ARG  44           2HD      ARG  44  -5.762  -6.857   3.552
  385    HD3  ARG  44           3HD      ARG  44  -7.032  -6.050   4.470
  386    HE   ARG  44           HE       ARG  44  -8.645  -7.543   3.526
  387   HH11  ARG  44          1HH1      ARG  44  -5.317  -8.477   2.861
  388   HH12  ARG  44          2HH1      ARG  44  -5.726 -10.122   2.482
  389   HH21  ARG  44          1HH2      ARG  44  -9.152  -9.717   2.961
  390   HH22  ARG  44          2HH2      ARG  44  -7.877 -10.813   2.541
  391    H    MET  45           H        MET  45  -8.028  -5.861  -2.024
  392    HA   MET  45           HA       MET  45 -10.371  -4.296  -1.222
  393    HB2  MET  45           2HB      MET  45  -8.638  -4.308  -3.725
  394    HB3  MET  45           3HB      MET  45 -10.123  -3.371  -3.628
  395    HG2  MET  45           2HG      MET  45  -7.762  -3.021  -1.767
  396    HG3  MET  45           3HG      MET  45  -8.070  -2.044  -3.202
  397    HE1  MET  45           3HE      MET  45 -10.158  -0.408  -3.464
  398    HE2  MET  45           1HE      MET  45 -11.402  -0.220  -2.229
  399    HE3  MET  45           2HE      MET  45 -11.266  -1.737  -3.116
  400    H    ASP  46           H        ASP  46  -9.753  -7.302  -2.745
  401    HA   ASP  46           HA       ASP  46 -11.851  -7.253  -4.646
  402    HB2  ASP  46           2HB      ASP  46  -9.864  -8.788  -4.793
  403    HB3  ASP  46           3HB      ASP  46 -10.585  -9.771  -3.521
  404    HA   PRO  47           HA       PRO  47 -14.576  -9.689  -1.336
  405    HB2  PRO  47           2HB      PRO  47 -13.935  -9.243   1.324
  406    HB3  PRO  47           3HB      PRO  47 -13.353 -10.646   0.404
  407    HG2  PRO  47           2HG      PRO  47 -11.932  -8.051   0.958
  408    HG3  PRO  47           3HG      PRO  47 -11.319  -9.717   1.107
  409    HD2  PRO  47           2HD      PRO  47 -10.722  -8.238  -1.042
  410    HD3  PRO  47           3HD      PRO  47 -11.072  -9.974  -1.214
  411    H    ILE  48           H        ILE  48 -13.107  -6.573  -0.943
  412    HA   ILE  48           HA       ILE  48 -15.130  -5.241   0.582
  413    HB   ILE  48           HB       ILE  48 -12.884  -4.149  -1.166
  414   HG12  ILE  48          2HG1      ILE  48 -11.968  -5.543   0.589
  415   HG13  ILE  48          3HG1      ILE  48 -11.634  -3.868   0.987
  416   HG21  ILE  48          1HG2      ILE  48 -13.061  -2.041   0.092
  417   HG22  ILE  48          2HG2      ILE  48 -14.481  -2.659   0.934
  418   HG23  ILE  48          3HG2      ILE  48 -14.538  -2.394  -0.808
  419   HD11  ILE  48          3HD1      ILE  48 -13.493  -3.937   2.620
  420   HD12  ILE  48          1HD1      ILE  48 -12.209  -5.093   2.960
  421   HD13  ILE  48          2HD1      ILE  48 -13.720  -5.646   2.243
  422    H    LYS  49           H        LYS  49 -14.541  -5.786  -2.857
  423    HA   LYS  49           HA       LYS  49 -16.493  -3.911  -3.849
  424    HB2  LYS  49           2HB      LYS  49 -15.116  -6.281  -5.158
  425    HB3  LYS  49           3HB      LYS  49 -16.219  -5.207  -6.016
  426    HG2  LYS  49           2HG      LYS  49 -14.717  -3.310  -5.686
  427    HG3  LYS  49           3HG      LYS  49 -13.641  -4.288  -4.680
  428    HD2  LYS  49           2HD      LYS  49 -14.227  -4.800  -7.627
  429    HD3  LYS  49           3HD      LYS  49 -12.771  -4.019  -7.004
  430    HE2  LYS  49           2HE      LYS  49 -12.084  -6.024  -5.879
  431    HE3  LYS  49           3HE      LYS  49 -13.625  -6.814  -6.201
  432    HZ1  LYS  49           3HZ      LYS  49 -11.614  -6.060  -8.245
  433    HZ2  LYS  49           1HZ      LYS  49 -13.084  -6.834  -8.552
  434    HZ3  LYS  49           2HZ      LYS  49 -11.886  -7.620  -7.654
  435    H    LYS  50           H        LYS  50 -16.440  -7.374  -3.093
  436    HA   LYS  50           HA       LYS  50 -19.122  -7.953  -3.775
  437    HB2  LYS  50           2HB      LYS  50 -17.314  -9.630  -3.477
  438    HB3  LYS  50           3HB      LYS  50 -17.275  -9.308  -1.755
  439    HG2  LYS  50           2HG      LYS  50 -19.822 -10.300  -3.053
  440    HG3  LYS  50           3HG      LYS  50 -18.522 -11.432  -2.697
  441    HD2  LYS  50           2HD      LYS  50 -19.934  -9.672  -0.653
  442    HD3  LYS  50           3HD      LYS  50 -20.243 -11.389  -0.917
  443    HE2  LYS  50           2HE      LYS  50 -17.574 -10.236  -0.023
  444    HE3  LYS  50           3HE      LYS  50 -18.773 -10.959   1.048
  445    HZ1  LYS  50           3HZ      LYS  50 -16.993 -12.493   0.412
  446    HZ2  LYS  50           1HZ      LYS  50 -17.467 -12.380  -1.205
  447    HZ3  LYS  50           2HZ      LYS  50 -18.515 -13.045  -0.060
  448    H    LEU  51           H        LEU  51 -17.649  -6.548  -0.879
  449    HA   LEU  51           HA       LEU  51 -20.031  -6.556   0.755
  450    HB2  LEU  51           2HB      LEU  51 -17.561  -4.779   0.962
  451    HB3  LEU  51           3HB      LEU  51 -18.825  -4.890   2.176
  452    HG   LEU  51           HG       LEU  51 -16.843  -7.067   1.414
  453   HD11  LEU  51          1HD1      LEU  51 -17.134  -5.484   3.981
  454   HD12  LEU  51          2HD1      LEU  51 -15.847  -5.329   2.782
  455   HD13  LEU  51          3HD1      LEU  51 -16.005  -6.817   3.711
  456   HD21  LEU  51          3HD2      LEU  51 -18.970  -8.133   1.899
  457   HD22  LEU  51          1HD2      LEU  51 -19.105  -7.240   3.418
  458   HD23  LEU  51          2HD2      LEU  51 -17.826  -8.437   3.203
  459    H    GLY  52           H        GLY  52 -18.546  -4.349  -1.559
  460    HA2  GLY  52           2HA      GLY  52 -19.469  -2.679  -2.842
  461    HA3  GLY  52           3HA      GLY  52 -21.018  -2.947  -2.062
  462    H    CYS  53           H        CYS  53 -17.922  -2.138  -0.516
  463    HA   CYS  53           HA       CYS  53 -19.017   0.175   0.828
  464    HB2  CYS  53           2HB      CYS  53 -16.186  -0.926   0.695
  465    HB3  CYS  53           3HB      CYS  53 -16.657   0.468   1.668
  466    H    LYS  54           H        LYS  54 -19.353   2.014  -0.253
  467    HA   LYS  54           HA       LYS  54 -18.396   2.572  -2.859
  468    HB2  LYS  54           2HB      LYS  54 -19.685   4.531  -0.902
  469    HB3  LYS  54           3HB      LYS  54 -19.628   4.687  -2.656
  470    HG2  LYS  54           2HG      LYS  54 -21.112   2.517  -1.132
  471    HG3  LYS  54           3HG      LYS  54 -21.854   3.948  -1.849
  472    HD2  LYS  54           2HD      LYS  54 -21.389   3.187  -4.079
  473    HD3  LYS  54           3HD      LYS  54 -20.297   1.928  -3.502
  474    HE2  LYS  54           2HE      LYS  54 -22.458   0.995  -4.245
  475    HE3  LYS  54           3HE      LYS  54 -22.183   0.700  -2.528
  476    HZ1  LYS  54           3HZ      LYS  54 -24.448   1.392  -2.982
  477    HZ2  LYS  54           1HZ      LYS  54 -23.907   2.848  -3.651
  478    HZ3  LYS  54           2HZ      LYS  54 -23.665   2.526  -2.007
  479    H    ARG  55           H        ARG  55 -17.645   4.162   0.272
  480    HA   ARG  55           HA       ARG  55 -15.049   5.079  -0.847
  481    HB2  ARG  55           2HB      ARG  55 -16.479   6.939  -0.034
  482    HB3  ARG  55           3HB      ARG  55 -16.595   6.181   1.548
  483    HG2  ARG  55           2HG      ARG  55 -14.188   6.529   1.927
  484    HG3  ARG  55           3HG      ARG  55 -14.005   7.209   0.308
  485    HD2  ARG  55           2HD      ARG  55 -15.440   9.109   0.915
  486    HD3  ARG  55           3HD      ARG  55 -15.733   8.405   2.510
  487    HE   ARG  55           HE       ARG  55 -13.028   8.639   2.445
  488   HH11  ARG  55          1HH1      ARG  55 -15.619  10.964   1.839
  489   HH12  ARG  55          2HH1      ARG  55 -14.683  12.318   2.392
  490   HH21  ARG  55          1HH2      ARG  55 -11.849  10.442   3.221
  491   HH22  ARG  55          2HH2      ARG  55 -12.563  12.022   3.167
  492    H    VAL  56           H        VAL  56 -13.234   4.321   0.027
  493    HA   VAL  56           HA       VAL  56 -13.292   2.750   2.537
  494    HB   VAL  56           HB       VAL  56 -11.549   1.247   1.570
  495   HG11  VAL  56          1HG1      VAL  56 -14.140   1.295  -0.018
  496   HG12  VAL  56          2HG1      VAL  56 -13.875   0.512   1.542
  497   HG13  VAL  56          3HG1      VAL  56 -13.035  -0.079   0.108
  498   HG21  VAL  56          3HG2      VAL  56 -12.103   2.661  -1.076
  499   HG22  VAL  56          1HG2      VAL  56 -11.119   1.207  -0.875
  500   HG23  VAL  56          2HG2      VAL  56 -10.600   2.729  -0.152
  501    H    ARG  57           H        ARG  57 -11.538   3.047   3.884
  502    HA   ARG  57           HA       ARG  57  -9.494   5.058   3.117
  503    HB2  ARG  57           2HB      ARG  57 -10.804   5.764   5.048
  504    HB3  ARG  57           3HB      ARG  57 -10.562   4.215   5.851
  505    HG2  ARG  57           2HG      ARG  57  -8.216   4.690   6.217
  506    HG3  ARG  57           3HG      ARG  57  -8.299   6.135   5.207
  507    HD2  ARG  57           2HD      ARG  57  -9.848   5.799   7.799
  508    HD3  ARG  57           3HD      ARG  57  -8.270   6.584   7.679
  509    HE   ARG  57           HE       ARG  57 -10.354   7.635   5.940
  510   HH11  ARG  57          1HH1      ARG  57  -8.737   8.009   9.059
  511   HH12  ARG  57          2HH1      ARG  57  -9.210   9.673   9.225
  512   HH21  ARG  57          1HH2      ARG  57 -10.861   9.828   6.126
  513   HH22  ARG  57          2HH2      ARG  57 -10.417  10.705   7.561
  514    H    ILE  58           H        ILE  58  -7.809   3.944   2.303
  515    HA   ILE  58           HA       ILE  58  -6.933   1.389   3.512
  516    HB   ILE  58           HB       ILE  58  -5.960   2.646   0.890
  517   HG12  ILE  58          2HG1      ILE  58  -8.071   0.448   1.165
  518   HG13  ILE  58          3HG1      ILE  58  -8.423   2.127   0.771
  519   HG21  ILE  58          1HG2      ILE  58  -5.670  -0.199   1.942
  520   HG22  ILE  58          2HG2      ILE  58  -4.395   1.018   1.886
  521   HG23  ILE  58          3HG2      ILE  58  -5.078   0.394   0.386
  522   HD11  ILE  58          3HD1      ILE  58  -7.115   1.916  -1.294
  523   HD12  ILE  58          1HD1      ILE  58  -8.443   0.761  -1.216
  524   HD13  ILE  58          2HD1      ILE  58  -6.794   0.221  -0.911
  525    H    SER  59           H        SER  59  -5.508   1.857   5.178
  526    HA   SER  59           HA       SER  59  -3.483   3.974   4.783
  527    HB2  SER  59           2HB      SER  59  -5.006   4.080   6.810
  528    HB3  SER  59           3HB      SER  59  -4.264   2.591   7.393
  529    HG   SER  59           HG       SER  59  -2.927   5.043   6.843
  530    H    ILE  60           H        ILE  60  -1.802   3.067   3.790
  531    HA   ILE  60           HA       ILE  60  -0.798   0.381   4.433
  532    HB   ILE  60           HB       ILE  60   0.034   2.365   2.257
  533   HG12  ILE  60          2HG1      ILE  60  -1.661  -0.157   1.962
  534   HG13  ILE  60          3HG1      ILE  60  -2.293   1.485   1.966
  535   HG21  ILE  60          1HG2      ILE  60   1.283   0.499   1.226
  536   HG22  ILE  60          2HG2      ILE  60   0.852  -0.547   2.578
  537   HG23  ILE  60          3HG2      ILE  60   1.888   0.854   2.846
  538   HD11  ILE  60          3HD1      ILE  60  -2.147   0.672  -0.274
  539   HD12  ILE  60          1HD1      ILE  60  -0.437   0.289  -0.084
  540   HD13  ILE  60          2HD1      ILE  60  -0.979   1.970  -0.059
  541    H    ARG  61           H        ARG  61   0.608   0.389   6.153
  542    HA   ARG  61           HA       ARG  61   2.547   2.607   6.436
  543    HB2  ARG  61           2HB      ARG  61   1.234   1.968   8.482
  544    HB3  ARG  61           3HB      ARG  61   1.920   0.344   8.401
  545    HG2  ARG  61           2HG      ARG  61   4.177   1.262   8.729
  546    HG3  ARG  61           3HG      ARG  61   3.524   2.899   8.725
  547    HD2  ARG  61           2HD      ARG  61   2.172   2.249  10.773
  548    HD3  ARG  61           3HD      ARG  61   3.107   0.745  10.812
  549    HE   ARG  61           HE       ARG  61   4.783   3.043  10.647
  550   HH11  ARG  61          1HH1      ARG  61   2.978   1.149  12.996
  551   HH12  ARG  61          2HH1      ARG  61   3.977   1.648  14.322
  552   HH21  ARG  61          1HH2      ARG  61   6.054   3.704  12.372
  553   HH22  ARG  61          2HH2      ARG  61   5.720   3.097  13.967
  554    H    VAL  62           H        VAL  62   4.511   2.274   5.625
  555    HA   VAL  62           HA       VAL  62   5.297  -0.440   4.793
  556    HB   VAL  62           HB       VAL  62   5.314   1.629   3.191
  557   HG11  VAL  62          1HG1      VAL  62   6.489   3.222   4.668
  558   HG12  VAL  62          2HG1      VAL  62   7.332   3.007   3.131
  559   HG13  VAL  62          3HG1      VAL  62   7.942   2.218   4.589
  560   HG21  VAL  62          3HG2      VAL  62   7.270   0.787   1.963
  561   HG22  VAL  62          1HG2      VAL  62   6.271  -0.527   2.588
  562   HG23  VAL  62          2HG2      VAL  62   7.783  -0.107   3.395
  563    H    LYS  63           H        LYS  63   7.239  -1.390   5.549
  564    HA   LYS  63           HA       LYS  63   8.360  -0.254   8.008
  565    HB2  LYS  63           2HB      LYS  63   7.604  -2.664   7.880
  566    HB3  LYS  63           3HB      LYS  63   8.917  -2.972   6.750
  567    HG2  LYS  63           2HG      LYS  63  10.578  -2.536   8.436
  568    HG3  LYS  63           3HG      LYS  63   9.364  -1.905   9.555
  569    HD2  LYS  63           2HD      LYS  63   8.333  -4.149   9.714
  570    HD3  LYS  63           3HD      LYS  63   9.524  -4.786   8.577
  571    HE2  LYS  63           2HE      LYS  63  10.197  -3.599  11.288
  572    HE3  LYS  63           3HE      LYS  63  10.032  -5.324  10.954
  573    HZ1  LYS  63           3HZ      LYS  63  11.839  -5.091   9.315
  574    HZ2  LYS  63           1HZ      LYS  63  12.329  -4.713  10.887
  575    HZ3  LYS  63           2HZ      LYS  63  12.035  -3.479   9.775
  576    H    HIS  64           H        HIS  64  10.595   0.071   8.273
  577    HA   HIS  64           HA       HIS  64  11.967   0.885   5.764
  578    HB2  HIS  64           2HB      HIS  64  12.758   2.632   7.960
  579    HB3  HIS  64           3HB      HIS  64  11.905   3.062   6.476
  580    HD1  HIS  64           HD1      HIS  64  11.392   2.466  10.103
  581    HD2  HIS  64           HD2      HIS  64   9.056   3.170   6.749
  582    HE1  HIS  64           HE1      HIS  64   9.068   2.823  10.967
  583    HE2  HIS  64           HE2      HIS  64   7.663   3.073   8.919
  584    H    SER  65           H        SER  65  14.272   1.019   5.909
  585    HA   SER  65           HA       SER  65  15.404  -1.349   6.926
  586    HB2  SER  65           2HB      SER  65  16.193  -0.251   4.850
  587    HB3  SER  65           3HB      SER  65  16.783   1.125   5.779
  588    HG   SER  65           HG       SER  65  17.703  -1.409   6.523
  589    H    ASP  66           H        ASP  66  15.909   2.056   7.856
  590    HA   ASP  66           HA       ASP  66  16.994   1.336  10.467
  591    HB2  ASP  66           2HB      ASP  66  18.956   1.111   8.999
  592    HB3  ASP  66           3HB      ASP  66  18.658   2.686   8.283
  593    H    ALA  67           H        ALA  67  17.397   3.301  11.797
  594    HA   ALA  67           HA       ALA  67  15.140   5.011  11.717
  595    HB1  ALA  67           3HB      ALA  67  16.058   5.977  13.774
  596    HB2  ALA  67           1HB      ALA  67  17.606   5.174  13.472
  597    HB3  ALA  67           2HB      ALA  67  16.159   4.217  13.793
  598    H    ALA  68           H        ALA  68  18.361   5.499  10.434
  599    HA   ALA  68           HA       ALA  68  17.946   8.369   9.953
  600    HB1  ALA  68           3HB      ALA  68  20.220   7.559  10.442
  601    HB2  ALA  68           1HB      ALA  68  20.143   8.270   8.831
  602    HB3  ALA  68           2HB      ALA  68  20.173   6.512   9.023
  603    H    GLU  69           H        GLU  69  17.627   5.300   8.352
  604    HA   GLU  69           HA       GLU  69  17.337   6.320   5.673
  605    HB2  GLU  69           2HB      GLU  69  16.933   3.521   6.791
  606    HB3  GLU  69           3HB      GLU  69  16.839   3.938   5.082
  607    HG2  GLU  69           2HG      GLU  69  19.280   4.204   6.850
  608    HG3  GLU  69           3HG      GLU  69  19.008   2.973   5.623
  609    H    GLU  70           H        GLU  70  15.175   6.095   8.275
  610    HA   GLU  70           HA       GLU  70  12.730   5.250   7.533
  611    HB2  GLU  70           2HB      GLU  70  13.228   7.998   8.760
  612    HB3  GLU  70           3HB      GLU  70  11.710   7.118   8.845
  613    HG2  GLU  70           2HG      GLU  70  14.312   6.209  10.080
  614    HG3  GLU  70           3HG      GLU  70  13.052   7.089  10.938
  615    H    LYS  71           H        LYS  71  14.048   8.394   6.621
  616    HA   LYS  71           HA       LYS  71  11.727   9.260   5.144
  617    HB2  LYS  71           2HB      LYS  71  14.466  10.564   5.480
  618    HB3  LYS  71           3HB      LYS  71  13.002  11.363   4.910
  619    HG2  LYS  71           2HG      LYS  71  11.955  11.142   7.083
  620    HG3  LYS  71           3HG      LYS  71  13.283  10.138   7.675
  621    HD2  LYS  71           2HD      LYS  71  14.828  12.091   7.423
  622    HD3  LYS  71           3HD      LYS  71  13.458  13.082   6.908
  623    HE2  LYS  71           2HE      LYS  71  12.368  12.661   9.101
  624    HE3  LYS  71           3HE      LYS  71  13.775  11.717   9.599
  625    HZ1  LYS  71           3HZ      LYS  71  13.778  14.617   8.933
  626    HZ2  LYS  71           1HZ      LYS  71  15.134  13.714   9.380
  627    HZ3  LYS  71           2HZ      LYS  71  13.874  13.945  10.483
  628    H    LYS  72           H        LYS  72  14.878   7.904   4.409
  629    HA   LYS  72           HA       LYS  72  14.964   8.579   1.616
  630    HB2  LYS  72           2HB      LYS  72  17.011   8.122   3.018
  631    HB3  LYS  72           3HB      LYS  72  16.528   6.436   3.138
  632    HG2  LYS  72           2HG      LYS  72  18.259   6.617   1.481
  633    HG3  LYS  72           3HG      LYS  72  16.747   6.241   0.651
  634    HD2  LYS  72           2HD      LYS  72  16.511   8.628   0.010
  635    HD3  LYS  72           3HD      LYS  72  18.021   9.007   0.849
  636    HE2  LYS  72           2HE      LYS  72  19.239   7.500  -0.698
  637    HE3  LYS  72           3HE      LYS  72  17.729   7.151  -1.542
  638    HZ1  LYS  72           3HZ      LYS  72  19.099   9.778  -1.372
  639    HZ2  LYS  72           1HZ      LYS  72  17.580   9.543  -2.076
  640    HZ3  LYS  72           2HZ      LYS  72  18.945   8.801  -2.738
  641    H    GLU  73           H        GLU  73  13.843   5.821   3.519
  642    HA   GLU  73           HA       GLU  73  13.305   4.138   1.199
  643    HB2  GLU  73           2HB      GLU  73  12.577   3.620   4.124
  644    HB3  GLU  73           3HB      GLU  73  12.545   2.445   2.816
  645    HG2  GLU  73           2HG      GLU  73  14.954   3.673   4.170
  646    HG3  GLU  73           3HG      GLU  73  14.495   1.977   4.078
  647    H    ALA  74           H        ALA  74  11.565   6.235   3.427
  648    HA   ALA  74           HA       ALA  74   8.914   5.632   2.636
  649    HB1  ALA  74           3HB      ALA  74  10.030   8.276   3.642
  650    HB2  ALA  74           1HB      ALA  74   9.421   6.961   4.649
  651    HB3  ALA  74           2HB      ALA  74   8.320   7.830   3.575
  652    H    LYS  75           H        LYS  75  11.228   8.115   1.475
  653    HA   LYS  75           HA       LYS  75   9.528   9.070  -0.618
  654    HB2  LYS  75           2HB      LYS  75  11.321  10.445   0.504
  655    HB3  LYS  75           3HB      LYS  75  12.530   9.501  -0.355
  656    HG2  LYS  75           2HG      LYS  75  11.773  10.343  -2.502
  657    HG3  LYS  75           3HG      LYS  75  10.360  11.096  -1.764
  658    HD2  LYS  75           2HD      LYS  75  11.979  12.826  -2.264
  659    HD3  LYS  75           3HD      LYS  75  11.877  12.646  -0.513
  660    HE2  LYS  75           2HE      LYS  75  14.200  12.921  -1.189
  661    HE3  LYS  75           3HE      LYS  75  13.966  11.291  -0.560
  662    HZ1  LYS  75           3HZ      LYS  75  13.852  10.479  -2.841
  663    HZ2  LYS  75           1HZ      LYS  75  15.308  11.293  -2.569
  664    HZ3  LYS  75           2HZ      LYS  75  14.067  12.046  -3.435
  665    H    LYS  76           H        LYS  76  12.137   6.632  -0.525
  666    HA   LYS  76           HA       LYS  76  12.305   5.941  -3.231
  667    HB2  LYS  76           2HB      LYS  76  13.749   4.889  -1.517
  668    HB3  LYS  76           3HB      LYS  76  12.355   4.107  -0.784
  669    HG2  LYS  76           2HG      LYS  76  12.040   2.748  -2.827
  670    HG3  LYS  76           3HG      LYS  76  13.437   3.522  -3.568
  671    HD2  LYS  76           2HD      LYS  76  13.600   1.911  -0.990
  672    HD3  LYS  76           3HD      LYS  76  13.812   1.192  -2.583
  673    HE2  LYS  76           2HE      LYS  76  16.001   1.593  -1.720
  674    HE3  LYS  76           3HE      LYS  76  15.727   2.820  -2.953
  675    HZ1  LYS  76           3HZ      LYS  76  16.762   3.770  -1.012
  676    HZ2  LYS  76           1HZ      LYS  76  15.523   3.201  -0.009
  677    HZ3  LYS  76           2HZ      LYS  76  15.201   4.396  -1.164
  678    H    PHE  77           H        PHE  77  10.095   4.705  -0.736
  679    HA   PHE  77           HA       PHE  77   8.458   3.181  -2.505
  680    HB2  PHE  77           2HB      PHE  77   8.607   3.633   0.412
  681    HB3  PHE  77           3HB      PHE  77   6.940   3.545  -0.142
  682    HD1  PHE  77           HD1      PHE  77  10.110   1.648   0.212
  683    HD2  PHE  77           HD2      PHE  77   6.027   1.473  -1.074
  684    HE1  PHE  77           HE1      PHE  77  10.229  -0.815   0.117
  685    HE2  PHE  77           HE2      PHE  77   6.162  -0.976  -1.157
  686    HZ   PHE  77           HZ       PHE  77   8.249  -2.118  -0.565
  687    H    ALA  78           H        ALA  78   8.468   6.532  -1.643
  688    HA   ALA  78           HA       ALA  78   5.786   7.183  -2.187
  689    HB1  ALA  78           3HB      ALA  78   8.233   8.911  -2.675
  690    HB2  ALA  78           1HB      ALA  78   7.354   8.771  -1.151
  691    HB3  ALA  78           2HB      ALA  78   6.560   9.469  -2.566
  692    H    ALA  79           H        ALA  79   8.619   6.965  -4.350
  693    HA   ALA  79           HA       ALA  79   7.261   7.492  -6.786
  694    HB1  ALA  79           3HB      ALA  79   9.808   5.907  -6.308
  695    HB2  ALA  79           1HB      ALA  79   9.707   7.654  -6.529
  696    HB3  ALA  79           2HB      ALA  79   9.277   6.573  -7.857
  697    H    ILE  80           H        ILE  80   8.051   4.469  -5.083
  698    HA   ILE  80           HA       ILE  80   7.230   2.597  -7.023
  699    HB   ILE  80           HB       ILE  80   7.497   2.380  -3.993
  700   HG12  ILE  80          2HG1      ILE  80   9.618   2.817  -5.101
  701   HG13  ILE  80          3HG1      ILE  80   9.616   1.147  -4.557
  702   HG21  ILE  80          1HG2      ILE  80   7.114   0.060  -5.905
  703   HG22  ILE  80          2HG2      ILE  80   5.946   0.617  -4.711
  704   HG23  ILE  80          3HG2      ILE  80   7.486  -0.064  -4.185
  705   HD11  ILE  80          3HD1      ILE  80  10.615   1.345  -6.749
  706   HD12  ILE  80          1HD1      ILE  80   9.157   2.095  -7.393
  707   HD13  ILE  80          2HD1      ILE  80   9.126   0.412  -6.858
  708    H    LEU  81           H        LEU  81   5.478   4.001  -4.282
  709    HA   LEU  81           HA       LEU  81   3.048   2.520  -4.717
  710    HB2  LEU  81           2HB      LEU  81   3.863   4.756  -2.830
  711    HB3  LEU  81           3HB      LEU  81   2.200   4.201  -2.909
  712    HG   LEU  81           HG       LEU  81   4.515   2.325  -2.281
  713   HD11  LEU  81          1HD1      LEU  81   4.457   4.054  -0.553
  714   HD12  LEU  81          2HD1      LEU  81   3.930   2.502   0.090
  715   HD13  LEU  81          3HD1      LEU  81   2.739   3.754  -0.279
  716   HD21  LEU  81          3HD2      LEU  81   2.751   0.858  -1.383
  717   HD22  LEU  81          1HD2      LEU  81   2.499   1.207  -3.093
  718   HD23  LEU  81          2HD2      LEU  81   1.519   2.025  -1.873
  719    H    ASN  82           H        ASN  82   4.289   5.716  -5.609
  720    HA   ASN  82           HA       ASN  82   1.903   6.964  -6.468
  721    HB2  ASN  82           2HB      ASN  82   4.126   8.124  -6.227
  722    HB3  ASN  82           3HB      ASN  82   4.703   7.289  -7.665
  723   HD21  ASN  82          1HD2      ASN  82   5.099   9.247  -8.726
  724   HD22  ASN  82          2HD2      ASN  82   3.832  10.255  -9.327
  725    H    LYS  83           H        LYS  83   4.149   4.780  -8.111
  726    HA   LYS  83           HA       LYS  83   2.870   4.668 -10.642
  727    HB2  LYS  83           2HB      LYS  83   4.648   2.629  -9.241
  728    HB3  LYS  83           3HB      LYS  83   4.168   2.528 -10.929
  729    HG2  LYS  83           2HG      LYS  83   5.861   4.718  -9.692
  730    HG3  LYS  83           3HG      LYS  83   6.453   3.383 -10.683
  731    HD2  LYS  83           2HD      LYS  83   5.131   4.247 -12.606
  732    HD3  LYS  83           3HD      LYS  83   4.572   5.590 -11.605
  733    HE2  LYS  83           2HE      LYS  83   6.970   6.295 -11.330
  734    HE3  LYS  83           3HE      LYS  83   7.425   5.037 -12.485
  735    HZ1  LYS  83           3HZ      LYS  83   5.514   7.231 -13.086
  736    HZ2  LYS  83           1HZ      LYS  83   6.147   6.114 -14.180
  737    HZ3  LYS  83           2HZ      LYS  83   7.155   7.277 -13.482
  738    H    VAL  84           H        VAL  84   2.484   2.765  -7.663
  739    HA   VAL  84           HA       VAL  84   0.943   0.631  -8.745
  740    HB   VAL  84           HB       VAL  84   1.399   1.618  -5.892
  741   HG11  VAL  84          1HG1      VAL  84   0.362  -0.481  -5.058
  742   HG12  VAL  84          2HG1      VAL  84  -0.176  -0.856  -6.696
  743   HG13  VAL  84          3HG1      VAL  84  -0.807   0.565  -5.865
  744   HG21  VAL  84          3HG2      VAL  84   2.387  -0.871  -7.342
  745   HG22  VAL  84          1HG2      VAL  84   2.782  -0.416  -5.680
  746   HG23  VAL  84          2HG2      VAL  84   3.336   0.582  -7.025
  747    H    PHE  85           H        PHE  85   0.044   3.523  -6.862
  748    HA   PHE  85           HA       PHE  85  -2.768   3.113  -6.885
  749    HB2  PHE  85           2HB      PHE  85  -1.263   5.743  -6.496
  750    HB3  PHE  85           3HB      PHE  85  -2.946   5.445  -6.064
  751    HD1  PHE  85           HD1      PHE  85  -2.673   2.685  -4.829
  752    HD2  PHE  85           HD2      PHE  85  -0.301   6.221  -4.351
  753    HE1  PHE  85           HE1      PHE  85  -1.948   1.910  -2.610
  754    HE2  PHE  85           HE2      PHE  85   0.417   5.429  -2.135
  755    HZ   PHE  85           HZ       PHE  85  -0.402   3.277  -1.266
  756    H    ALA  86           H        ALA  86  -0.582   4.651  -9.172
  757    HA   ALA  86           HA       ALA  86  -2.509   5.883 -10.873
  758    HB1  ALA  86           3HB      ALA  86  -0.106   6.412 -10.969
  759    HB2  ALA  86           1HB      ALA  86  -0.718   5.936 -12.551
  760    HB3  ALA  86           2HB      ALA  86   0.237   4.799 -11.590
  761    H    GLU  87           H        GLU  87  -1.255   2.612 -10.606
  762    HA   GLU  87           HA       GLU  87  -2.533   1.640 -13.055
  763    HB2  GLU  87           2HB      GLU  87  -0.904   0.223 -10.900
  764    HB3  GLU  87           3HB      GLU  87  -1.489  -0.540 -12.379
  765    HG2  GLU  87           2HG      GLU  87  -0.094   0.936 -13.743
  766    HG3  GLU  87           3HG      GLU  87   0.417   1.823 -12.309
  767    H    LEU  88           H        LEU  88  -3.588   2.396 -10.028
  768    HA   LEU  88           HA       LEU  88  -5.657   0.284  -9.882
  769    HB2  LEU  88           2HB      LEU  88  -4.662   2.225  -7.752
  770    HB3  LEU  88           3HB      LEU  88  -6.004   1.114  -7.528
  771    HG   LEU  88           HG       LEU  88  -3.116   0.287  -8.022
  772   HD11  LEU  88          1HD1      LEU  88  -3.094  -0.438  -5.681
  773   HD12  LEU  88          2HD1      LEU  88  -4.721   0.210  -5.451
  774   HD13  LEU  88          3HD1      LEU  88  -3.378   1.296  -5.819
  775   HD21  LEU  88          3HD2      LEU  88  -4.653  -1.377  -8.915
  776   HD22  LEU  88          1HD2      LEU  88  -5.527  -1.433  -7.382
  777   HD23  LEU  88          2HD2      LEU  88  -3.854  -1.993  -7.472
  778    H    GLY  89           H        GLY  89  -5.039   3.724 -10.234
  779    HA2  GLY  89           2HA      GLY  89  -6.508   5.169 -11.412
  780    HA3  GLY  89           3HA      GLY  89  -7.886   4.240 -10.850
  781    H    TYR  90           H        TYR  90  -5.700   4.806  -8.316
  782    HA   TYR  90           HA       TYR  90  -7.343   6.874  -7.090
  783    HB2  TYR  90           2HB      TYR  90  -4.763   5.575  -6.093
  784    HB3  TYR  90           3HB      TYR  90  -5.840   6.586  -5.135
  785    HD1  TYR  90           HD2      TYR  90  -8.510   5.548  -5.622
  786    HD2  TYR  90           HD1      TYR  90  -4.844   3.375  -5.254
  787    HE1  TYR  90           HE2      TYR  90  -9.757   3.559  -4.890
  788    HE2  TYR  90           HE1      TYR  90  -6.098   1.387  -4.523
  789    HH   TYR  90           HH       TYR  90  -8.296   0.871  -3.463
  790    H    ASN  91           H        ASN  91  -6.768   9.031  -6.832
  791    HA   ASN  91           HA       ASN  91  -4.598  10.081  -8.533
  792    HB2  ASN  91           2HB      ASN  91  -6.984  11.429  -7.184
  793    HB3  ASN  91           3HB      ASN  91  -5.750  12.318  -8.073
  794   HD21  ASN  91          1HD2      ASN  91  -5.724  12.213 -10.331
  795   HD22  ASN  91          2HD2      ASN  91  -7.037  11.542 -11.233
  796    H    ASP  92           H        ASP  92  -3.425  12.031  -7.691
  797    HA   ASP  92           HA       ASP  92  -1.970  11.593  -5.325
  798    HB2  ASP  92           2HB      ASP  92  -2.366  14.248  -6.787
  799    HB3  ASP  92           3HB      ASP  92  -1.091  13.906  -5.622
  800    H    SER  93           H        SER  93  -4.906  13.380  -5.922
  801    HA   SER  93           HA       SER  93  -5.140  14.828  -3.504
  802    HB2  SER  93           2HB      SER  93  -7.576  14.975  -4.170
  803    HB3  SER  93           3HB      SER  93  -6.457  15.435  -5.455
  804    HG   SER  93           HG       SER  93  -8.178  13.272  -5.290
  805    H    ASN  94           H        ASN  94  -6.207  11.576  -4.479
  806    HA   ASN  94           HA       ASN  94  -7.615  10.930  -2.065
  807    HB2  ASN  94           2HB      ASN  94  -6.463   9.064  -4.196
  808    HB3  ASN  94           3HB      ASN  94  -7.605   8.593  -2.941
  809   HD21  ASN  94          1HD2      ASN  94  -9.802   9.247  -3.155
  810   HD22  ASN  94          2HD2      ASN  94 -10.429   9.851  -4.646
  811    H    VAL  95           H        VAL  95  -4.280  10.960  -2.935
  812    HA   VAL  95           HA       VAL  95  -3.422   9.004  -0.901
  813    HB   VAL  95           HB       VAL  95  -1.844  10.462  -3.091
  814   HG11  VAL  95          1HG1      VAL  95   0.012   8.911  -2.628
  815   HG12  VAL  95          2HG1      VAL  95  -0.893   8.206  -1.287
  816   HG13  VAL  95          3HG1      VAL  95  -0.366   9.887  -1.206
  817   HG21  VAL  95          3HG2      VAL  95  -1.797   8.304  -4.281
  818   HG22  VAL  95          1HG2      VAL  95  -3.457   8.842  -4.015
  819   HG23  VAL  95          2HG2      VAL  95  -2.773   7.565  -3.009
  820    H    THR  96           H        THR  96  -2.744   9.766   1.099
  821    HA   THR  96           HA       THR  96  -1.309  12.360   1.219
  822    HB   THR  96           HB       THR  96  -3.472  12.674   2.356
  823    HG1  THR  96           HG1      THR  96  -1.518  12.465   4.411
  824   HG21  THR  96          3HG2      THR  96  -4.022  10.398   3.077
  825   HG22  THR  96          1HG2      THR  96  -4.018  11.488   4.467
  826   HG23  THR  96          2HG2      THR  96  -2.660  10.395   4.196
  827    H    TRP  97           H        TRP  97   0.579  12.398   2.388
  828    HA   TRP  97           HA       TRP  97   1.616   9.827   3.441
  829    HB2  TRP  97           2HB      TRP  97   2.973  12.125   1.988
  830    HB3  TRP  97           3HB      TRP  97   3.912  11.038   3.008
  831    HD1  TRP  97           HD1      TRP  97   1.903  11.025  -0.303
  832    HE1  TRP  97           HE1      TRP  97   2.550   8.903  -1.617
  833    HE3  TRP  97           HE3      TRP  97   4.812   8.716   3.227
  834    HZ2  TRP  97           HZ2      TRP  97   4.092   6.578  -1.218
  835    HZ3  TRP  97           HZ3      TRP  97   5.842   6.543   2.682
  836    HH2  TRP  97           HH2      TRP  97   5.484   5.498   0.499
  837    H    ASP  98           H        ASP  98   2.418   9.769   5.444
  838    HA   ASP  98           HA       ASP  98   2.848  12.176   7.056
  839    HB2  ASP  98           2HB      ASP  98   0.855   9.967   7.794
  840    HB3  ASP  98           3HB      ASP  98   1.516  11.092   8.975
  841    H    GLY  99           H        GLY  99   5.015  11.585   6.859
  842    HA2  GLY  99           2HA      GLY  99   6.974  10.853   7.784
  843    HA3  GLY  99           3HA      GLY  99   6.041   9.942   8.959
  844    H    ASP 100           H        ASP 100   5.251   7.838   8.336
  845    HA   ASP 100           HA       ASP 100   6.876   6.457   6.265
  846    HB2  ASP 100           2HB      ASP 100   7.188   4.597   7.819
  847    HB3  ASP 100           3HB      ASP 100   7.797   6.079   8.539
  848    H    THR 101           H        THR 101   3.807   7.212   7.273
  849    HA   THR 101           HA       THR 101   2.564   4.730   6.228
  850    HB   THR 101           HB       THR 101   1.362   6.718   8.223
  851    HG1  THR 101           HG1      THR 101   3.251   5.216   8.850
  852   HG21  THR 101          3HG2      THR 101  -0.324   4.946   8.626
  853   HG22  THR 101          1HG2      THR 101   0.422   3.942   7.380
  854   HG23  THR 101          2HG2      THR 101  -0.353   5.465   6.941
  855    H    VAL 102           H        VAL 102   1.271   4.989   4.496
  856    HA   VAL 102           HA       VAL 102   0.447   7.693   3.609
  857    HB   VAL 102           HB       VAL 102   2.043   6.758   2.015
  858   HG11  VAL 102          1HG1      VAL 102   1.860   4.370   2.521
  859   HG12  VAL 102          2HG1      VAL 102   1.696   4.657   0.787
  860   HG13  VAL 102          3HG1      VAL 102   0.265   4.314   1.764
  861   HG21  VAL 102          3HG2      VAL 102  -0.778   6.593   0.892
  862   HG22  VAL 102          1HG2      VAL 102   0.697   6.807  -0.058
  863   HG23  VAL 102          2HG2      VAL 102   0.188   8.058   1.075
  864    H    THR 103           H        THR 103  -1.698   8.019   3.725
  865    HA   THR 103           HA       THR 103  -3.554   5.714   3.772
  866    HB   THR 103           HB       THR 103  -4.013   8.564   4.772
  867    HG1  THR 103           HG1      THR 103  -2.581   7.397   6.095
  868   HG21  THR 103          3HG2      THR 103  -6.071   7.656   5.791
  869   HG22  THR 103          1HG2      THR 103  -5.765   6.083   5.063
  870   HG23  THR 103          2HG2      THR 103  -6.120   7.480   4.036
  871    H    VAL 104           H        VAL 104  -4.383   5.372   1.860
  872    HA   VAL 104           HA       VAL 104  -5.124   7.583   0.053
  873    HB   VAL 104           HB       VAL 104  -4.801   4.603  -0.577
  874   HG11  VAL 104          1HG1      VAL 104  -5.194   6.962  -2.460
  875   HG12  VAL 104          2HG1      VAL 104  -6.377   5.700  -2.105
  876   HG13  VAL 104          3HG1      VAL 104  -4.882   5.294  -2.950
  877   HG21  VAL 104          3HG2      VAL 104  -2.641   5.578   0.016
  878   HG22  VAL 104          1HG2      VAL 104  -2.887   6.894  -1.136
  879   HG23  VAL 104          2HG2      VAL 104  -2.701   5.237  -1.713
  880    H    GLU 105           H        GLU 105  -7.224   8.138   0.453
  881    HA   GLU 105           HA       GLU 105  -9.223   6.045   0.996
  882    HB2  GLU 105           2HB      GLU 105  -9.505   9.090   1.039
  883    HB3  GLU 105           3HB      GLU 105 -10.804   7.943   1.365
  884    HG2  GLU 105           2HG      GLU 105  -9.372   7.059   3.283
  885    HG3  GLU 105           3HG      GLU 105  -8.328   8.454   3.021
  886    H    GLY 106           H        GLY 106 -10.046   5.136  -0.750
  887    HA2  GLY 106           2HA      GLY 106 -10.342   6.698  -3.269
  888    HA3  GLY 106           3HA      GLY 106  -9.900   4.997  -3.196
  889    H    GLN 107           H        GLN 107 -11.869   5.497  -4.766
  890    HA   GLN 107           HA       GLN 107 -14.292   4.568  -3.352
  891    HB2  GLN 107           2HB      GLN 107 -15.716   5.735  -4.905
  892    HB3  GLN 107           3HB      GLN 107 -14.565   6.904  -4.283
  893    HG2  GLN 107           2HG      GLN 107 -14.399   5.575  -7.011
  894    HG3  GLN 107           3HG      GLN 107 -15.041   7.185  -6.702
  895   HE21  GLN 107          1HE2      GLN 107 -12.760   6.283  -8.362
  896   HE22  GLN 107          2HE2      GLN 107 -11.399   7.194  -7.809
  897    H    LEU 108           H        LEU 108 -15.358   2.864  -4.239
  898    HA   LEU 108           HA       LEU 108 -13.920   1.138  -6.063
  899    HB2  LEU 108           2HB      LEU 108 -16.452   0.898  -4.448
  900    HB3  LEU 108           3HB      LEU 108 -16.170  -0.239  -5.757
  901    HG   LEU 108           HG       LEU 108 -14.104  -1.024  -4.691
  902   HD11  LEU 108          1HD1      LEU 108 -13.477  -0.354  -2.423
  903   HD12  LEU 108          2HD1      LEU 108 -14.708   0.915  -2.451
  904   HD13  LEU 108          3HD1      LEU 108 -13.342   0.982  -3.566
  905   HD21  LEU 108          3HD2      LEU 108 -16.215  -2.104  -4.191
  906   HD22  LEU 108          1HD2      LEU 108 -16.478  -1.018  -2.824
  907   HD23  LEU 108          2HD2      LEU 108 -15.133  -2.165  -2.799
  908    H    GLU 109           H        GLU 109 -15.188   0.027  -7.830
  909    HA   GLU 109           HA       GLU 109 -16.129   0.042  -9.880
  910    HB2  GLU 109           2HB      GLU 109 -18.179   0.468  -8.389
  911    HB3  GLU 109           3HB      GLU 109 -18.033   2.173  -8.799
  912    HG2  GLU 109           2HG      GLU 109 -18.350   1.569 -11.209
  913    HG3  GLU 109           3HG      GLU 109 -18.586  -0.109 -10.721
  914    H    GLY 110           H        GLY 110 -13.937   1.889  -9.209
  915    HA2  GLY 110           2HA      GLY 110 -14.099   4.429 -10.396
  916    HA3  GLY 110           3HA      GLY 110 -12.627   3.497 -10.177
  917    H    VAL 111           H        VAL 111 -12.108   1.898 -11.812
  918    HA   VAL 111           HA       VAL 111 -13.557   1.892 -14.370
  919    HB   VAL 111           HB       VAL 111 -10.497   2.177 -14.218
  920   HG11  VAL 111          1HG1      VAL 111 -12.250   1.875 -16.693
  921   HG12  VAL 111          2HG1      VAL 111 -11.168   0.646 -16.032
  922   HG13  VAL 111          3HG1      VAL 111 -10.504   2.143 -16.685
  923   HG21  VAL 111          3HG2      VAL 111 -11.598   4.352 -13.877
  924   HG22  VAL 111          1HG2      VAL 111 -12.504   4.146 -15.376
  925   HG23  VAL 111          2HG2      VAL 111 -10.746   4.315 -15.422
  926    H    ASP 112           H        ASP 112 -10.626   0.707 -12.838
  927    HA   ASP 112           HA       ASP 112 -11.396  -1.784 -11.939
  928    HB2  ASP 112           2HB      ASP 112 -10.687  -1.838 -14.825
  929    HB3  ASP 112           3HB      ASP 112  -9.674  -2.924 -13.890
  930    H    LEU 113           H        LEU 113  -9.813  -2.405 -10.528
  931    HA   LEU 113           HA       LEU 113  -7.296  -1.012 -10.337
  932    HB2  LEU 113           2HB      LEU 113  -8.104  -3.632  -8.995
  933    HB3  LEU 113           3HB      LEU 113  -6.826  -2.545  -8.483
  934    HG   LEU 113           HG       LEU 113  -9.810  -1.949  -8.354
  935   HD11  LEU 113          1HD1      LEU 113  -9.173  -3.661  -6.749
  936   HD12  LEU 113          2HD1      LEU 113  -9.560  -2.157  -5.917
  937   HD13  LEU 113          3HD1      LEU 113  -7.873  -2.641  -6.126
  938   HD21  LEU 113          3HD2      LEU 113  -7.483  -0.275  -7.347
  939   HD22  LEU 113          1HD2      LEU 113  -9.192   0.043  -7.036
  940   HD23  LEU 113          2HD2      LEU 113  -8.570   0.124  -8.681
  941    H    GLU 114           H        GLU 114  -7.904  -4.483 -10.581
  942    HA   GLU 114           HA       GLU 114  -7.045  -4.709 -13.305
  943    HB2  GLU 114           2HB      GLU 114  -5.301  -6.383 -12.993
  944    HB3  GLU 114           3HB      GLU 114  -4.844  -4.938 -12.104
  945    HG2  GLU 114           2HG      GLU 114  -5.622  -6.038  -9.999
  946    HG3  GLU 114           3HG      GLU 114  -5.977  -7.494 -10.920
  947    H    HIS 115           H        HIS 115  -7.182  -7.380 -13.698
  948    HA   HIS 115           HA       HIS 115  -9.880  -8.110 -13.093
  949    HB2  HIS 115           2HB      HIS 115  -7.610  -9.808 -14.243
  950    HB3  HIS 115           3HB      HIS 115  -9.306 -10.284 -14.210
  951    HD1  HIS 115           HD1      HIS 115  -6.852  -8.412 -16.203
  952    HD2  HIS 115           HD2      HIS 115 -10.990  -8.649 -15.926
  953    HE1  HIS 115           HE1      HIS 115  -7.734  -7.378 -18.318
  954    HE2  HIS 115           HE2      HIS 115 -10.231  -7.480 -18.091
  955    H    HIS 116           H        HIS 116 -10.558 -10.072 -11.948
  956    HA   HIS 116           HA       HIS 116  -9.594 -10.238  -9.301
  957    HB2  HIS 116           2HB      HIS 116 -11.922 -10.776  -9.704
  958    HB3  HIS 116           3HB      HIS 116 -11.502 -12.021 -10.874
  959    HD1  HIS 116           HD1      HIS 116 -11.905 -11.433  -7.213
  960    HD2  HIS 116           HD2      HIS 116 -10.731 -14.529  -9.720
  961    HE1  HIS 116           HE1      HIS 116 -11.841 -13.485  -5.772
  962    HE2  HIS 116           HE2      HIS 116 -11.342 -15.360  -7.363
  963    H    HIS 117           H        HIS 117  -7.694 -11.093  -8.742
  964    HA   HIS 117           HA       HIS 117  -7.059 -13.854  -9.617
  965    HB2  HIS 117           2HB      HIS 117  -5.219 -12.050  -9.758
  966    HB3  HIS 117           3HB      HIS 117  -5.247 -11.993  -7.998
  967    HD1  HIS 117           HD1      HIS 117  -3.474 -13.420  -7.001
  968    HD2  HIS 117           HD2      HIS 117  -4.765 -14.924 -10.649
  969    HE1  HIS 117           HE1      HIS 117  -2.080 -15.460  -7.420
  970    HE2  HIS 117           HE2      HIS 117  -3.071 -16.486  -9.484
  971    H    HIS 118           H        HIS 118  -7.038 -15.453  -7.993
  972    HA   HIS 118           HA       HIS 118  -9.145 -15.301  -6.201
  973    HB2  HIS 118           2HB      HIS 118  -8.285 -17.414  -7.188
  974    HB3  HIS 118           3HB      HIS 118  -6.856 -17.314  -6.168
  975    HD1  HIS 118           HD1      HIS 118 -10.523 -18.112  -6.058
  976    HD2  HIS 118           HD2      HIS 118  -7.239 -18.159  -3.507
  977    HE1  HIS 118           HE1      HIS 118 -11.269 -19.347  -4.001
  978    HE2  HIS 118           HE2      HIS 118  -9.291 -19.306  -2.457
  979    H    HIS 119           H        HIS 119  -5.677 -15.291  -5.449
  980    HA   HIS 119           HA       HIS 119  -6.006 -13.759  -3.022
  981    HB2  HIS 119           2HB      HIS 119  -6.603 -16.173  -2.374
  982    HB3  HIS 119           3HB      HIS 119  -4.950 -16.618  -2.768
  983    HD1  HIS 119           HD1      HIS 119  -3.146 -16.085  -1.028
  984    HD2  HIS 119           HD2      HIS 119  -6.897 -14.591  -0.021
  985    HE1  HIS 119           HE1      HIS 119  -2.967 -15.350   1.367
  986    HE2  HIS 119           HE2      HIS 119  -5.186 -14.295   1.891
  987    H    HIS 120           H        HIS 120  -3.907 -13.233  -2.082
  988    HA   HIS 120           HA       HIS 120  -1.649 -13.388  -3.951
  989    HB2  HIS 120           2HB      HIS 120  -2.174 -11.120  -3.247
  990    HB3  HIS 120           3HB      HIS 120  -2.176 -11.580  -1.546
  991    HD1  HIS 120           HD1      HIS 120   0.039 -11.657  -0.349
  992    HD2  HIS 120           HD2      HIS 120   0.478 -10.941  -4.414
  993    HE1  HIS 120           HE1      HIS 120   2.458 -11.112  -0.674
  994    HE2  HIS 120           HE2      HIS 120   2.733 -10.888  -3.162
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1  21.313  -1.205   2.685
    2    H2   MET   1           2H       MET   1  19.833  -1.975   2.877
    3    H3   MET   1           3H       MET   1  19.981  -0.727   1.760
    4    HA   MET   1           HA       MET   1  21.565  -2.051   0.496
    5    HB2  MET   1           2HB      MET   1  20.705  -4.320   2.355
    6    HB3  MET   1           3HB      MET   1  21.779  -4.465   0.965
    7    HG2  MET   1           2HG      MET   1  23.125  -4.499   2.934
    8    HG3  MET   1           3HG      MET   1  23.393  -2.944   2.144
    9    HE1  MET   1           3HE      MET   1  23.712  -2.081   5.990
   10    HE2  MET   1           1HE      MET   1  24.466  -1.853   4.412
   11    HE3  MET   1           2HE      MET   1  24.321  -3.474   5.095
   12    H    SER   2           H        SER   2  20.777  -3.218  -1.295
   13    HA   SER   2           HA       SER   2  17.946  -3.359  -1.763
   14    HB2  SER   2           2HB      SER   2  20.251  -4.519  -3.402
   15    HB3  SER   2           3HB      SER   2  18.603  -4.236  -3.972
   16    HG   SER   2           HG       SER   2  19.198  -2.279  -4.421
   17    H    GLY   3           H        GLY   3  16.985  -5.539  -2.619
   18    HA2  GLY   3           2HA      GLY   3  16.289  -7.687  -2.131
   19    HA3  GLY   3           3HA      GLY   3  17.901  -8.011  -1.498
   20    H    LYS   4           H        LYS   4  15.131  -5.934  -0.647
   21    HA   LYS   4           HA       LYS   4  15.668  -6.420   2.221
   22    HB2  LYS   4           2HB      LYS   4  15.880  -4.051   1.375
   23    HB3  LYS   4           3HB      LYS   4  14.182  -4.081   0.915
   24    HG2  LYS   4           2HG      LYS   4  14.506  -2.894   3.046
   25    HG3  LYS   4           3HG      LYS   4  13.531  -4.351   3.282
   26    HD2  LYS   4           2HD      LYS   4  15.499  -5.551   4.149
   27    HD3  LYS   4           3HD      LYS   4  16.515  -4.143   3.847
   28    HE2  LYS   4           2HE      LYS   4  15.984  -4.261   6.206
   29    HE3  LYS   4           3HE      LYS   4  15.158  -2.865   5.512
   30    HZ1  LYS   4           3HZ      LYS   4  13.117  -4.085   5.480
   31    HZ2  LYS   4           1HZ      LYS   4  13.776  -4.184   7.030
   32    HZ3  LYS   4           2HZ      LYS   4  13.882  -5.505   5.986
   33    H    LYS   5           H        LYS   5  14.136  -7.316   3.484
   34    HA   LYS   5           HA       LYS   5  11.506  -8.020   2.449
   35    HB2  LYS   5           2HB      LYS   5  12.728  -9.632   3.875
   36    HB3  LYS   5           3HB      LYS   5  12.780  -8.457   5.184
   37    HG2  LYS   5           2HG      LYS   5  10.267  -8.518   5.284
   38    HG3  LYS   5           3HG      LYS   5  10.288  -9.783   4.052
   39    HD2  LYS   5           2HD      LYS   5  10.034 -10.805   6.255
   40    HD3  LYS   5           3HD      LYS   5  11.616 -11.232   5.595
   41    HE2  LYS   5           2HE      LYS   5  12.601  -9.353   6.974
   42    HE3  LYS   5           3HE      LYS   5  11.016  -9.153   7.722
   43    HZ1  LYS   5           3HZ      LYS   5  12.426 -10.525   9.087
   44    HZ2  LYS   5           1HZ      LYS   5  12.690 -11.607   7.818
   45    HZ3  LYS   5           2HZ      LYS   5  11.150 -11.452   8.488
   46    H    VAL   6           H        VAL   6   9.878  -6.698   2.619
   47    HA   VAL   6           HA       VAL   6   9.779  -4.522   4.638
   48    HB   VAL   6           HB       VAL   6   9.806  -3.399   2.539
   49   HG11  VAL   6          1HG1      VAL   6   8.532  -4.107   0.531
   50   HG12  VAL   6          2HG1      VAL   6   7.914  -5.506   1.415
   51   HG13  VAL   6          3HG1      VAL   6   9.640  -5.370   1.077
   52   HG21  VAL   6          3HG2      VAL   6   7.560  -2.482   2.161
   53   HG22  VAL   6          1HG2      VAL   6   7.887  -2.638   3.888
   54   HG23  VAL   6          2HG2      VAL   6   6.841  -3.806   3.080
   55    H    GLU   7           H        GLU   7   8.002  -4.519   5.985
   56    HA   GLU   7           HA       GLU   7   5.864  -6.497   5.466
   57    HB2  GLU   7           2HB      GLU   7   6.733  -5.186   8.084
   58    HB3  GLU   7           3HB      GLU   7   5.264  -6.146   7.907
   59    HG2  GLU   7           2HG      GLU   7   6.806  -8.037   7.036
   60    HG3  GLU   7           3HG      GLU   7   8.135  -7.065   7.655
   61    H    VAL   8           H        VAL   8   4.233  -5.682   4.481
   62    HA   VAL   8           HA       VAL   8   3.592  -2.813   4.484
   63    HB   VAL   8           HB       VAL   8   2.582  -5.084   2.675
   64   HG11  VAL   8          1HG1      VAL   8   1.705  -3.336   1.191
   65   HG12  VAL   8          2HG1      VAL   8   2.240  -2.082   2.310
   66   HG13  VAL   8          3HG1      VAL   8   0.971  -3.208   2.792
   67   HG21  VAL   8          3HG2      VAL   8   4.086  -4.171   0.948
   68   HG22  VAL   8          1HG2      VAL   8   4.992  -4.684   2.374
   69   HG23  VAL   8          2HG2      VAL   8   4.688  -2.968   2.092
   70    H    GLN   9           H        GLN   9   2.182  -2.289   6.056
   71    HA   GLN   9           HA       GLN   9   0.327  -4.301   7.164
   72    HB2  GLN   9           2HB      GLN   9   1.183  -1.575   8.256
   73    HB3  GLN   9           3HB      GLN   9   0.267  -2.805   9.128
   74    HG2  GLN   9           2HG      GLN   9   2.172  -4.282   9.209
   75    HG3  GLN   9           3HG      GLN   9   3.076  -3.260   8.088
   76   HE21  GLN   9          1HE2      GLN   9   3.994  -1.346   8.834
   77   HE22  GLN   9          2HE2      GLN   9   4.211  -1.016  10.520
   78    H    VAL  10           H        VAL  10  -1.468  -4.242   5.922
   79    HA   VAL  10           HA       VAL  10  -2.570  -1.697   4.931
   80    HB   VAL  10           HB       VAL  10  -3.174  -4.587   4.106
   81   HG11  VAL  10          1HG1      VAL  10  -4.226  -2.006   2.879
   82   HG12  VAL  10          2HG1      VAL  10  -5.176  -3.178   3.795
   83   HG13  VAL  10          3HG1      VAL  10  -4.482  -3.632   2.238
   84   HG21  VAL  10          3HG2      VAL  10  -0.934  -3.833   3.417
   85   HG22  VAL  10          1HG2      VAL  10  -1.632  -2.403   2.650
   86   HG23  VAL  10          2HG2      VAL  10  -1.989  -4.011   2.015
   87    H    LYS  11           H        LYS  11  -4.012  -0.818   6.252
   88    HA   LYS  11           HA       LYS  11  -6.048  -2.488   7.620
   89    HB2  LYS  11           2HB      LYS  11  -4.463  -1.356   9.174
   90    HB3  LYS  11           3HB      LYS  11  -4.858   0.199   8.458
   91    HG2  LYS  11           2HG      LYS  11  -7.160   0.036   9.298
   92    HG3  LYS  11           3HG      LYS  11  -6.828  -1.577   9.939
   93    HD2  LYS  11           2HD      LYS  11  -6.763   0.148  11.717
   94    HD3  LYS  11           3HD      LYS  11  -5.203  -0.656  11.525
   95    HE2  LYS  11           2HE      LYS  11  -4.930   1.769  11.842
   96    HE3  LYS  11           3HE      LYS  11  -4.352   1.281  10.249
   97    HZ1  LYS  11           3HZ      LYS  11  -6.515   2.047   9.345
   98    HZ2  LYS  11           1HZ      LYS  11  -5.624   3.286  10.065
   99    HZ3  LYS  11           2HZ      LYS  11  -6.936   2.608  10.880
  100    H    ILE  12           H        ILE  12  -7.780  -2.342   6.330
  101    HA   ILE  12           HA       ILE  12  -8.442   0.219   4.979
  102    HB   ILE  12           HB       ILE  12  -7.785  -1.517   3.378
  103   HG12  ILE  12          2HG1      ILE  12 -10.804  -1.062   3.272
  104   HG13  ILE  12          3HG1      ILE  12  -9.588   0.085   2.723
  105   HG21  ILE  12          1HG2      ILE  12  -8.278  -3.535   4.674
  106   HG22  ILE  12          2HG2      ILE  12  -9.054  -3.621   3.091
  107   HG23  ILE  12          3HG2      ILE  12 -10.012  -3.235   4.522
  108   HD11  ILE  12          3HD1      ILE  12 -10.607  -1.109   0.873
  109   HD12  ILE  12          1HD1      ILE  12 -10.078  -2.651   1.545
  110   HD13  ILE  12          2HD1      ILE  12  -8.887  -1.474   0.986
  111    H    THR  13           H        THR  13 -10.357   1.140   5.511
  112    HA   THR  13           HA       THR  13 -12.343  -0.402   7.050
  113    HB   THR  13           HB       THR  13 -12.136   2.605   6.565
  114    HG1  THR  13           HG1      THR  13 -11.601   1.019   8.890
  115   HG21  THR  13          3HG2      THR  13 -14.024   1.053   8.380
  116   HG22  THR  13          1HG2      THR  13 -14.488   1.961   6.937
  117   HG23  THR  13          2HG2      THR  13 -13.851   2.808   8.347
  118    H    CYS  14           H        CYS  14 -13.936  -1.296   5.978
  119    HA   CYS  14           HA       CYS  14 -15.049  -0.095   3.502
  120    HB2  CYS  14           2HB      CYS  14 -13.563  -2.030   3.006
  121    HB3  CYS  14           3HB      CYS  14 -14.565  -3.064   4.018
  122    H    ASN  15           H        ASN  15 -17.053   0.504   3.973
  123    HA   ASN  15           HA       ASN  15 -19.286   0.356   4.235
  124    HB2  ASN  15           2HB      ASN  15 -18.882  -2.099   3.475
  125    HB3  ASN  15           3HB      ASN  15 -19.047  -2.535   5.165
  126   HD21  ASN  15          1HD2      ASN  15 -20.703  -1.334   2.336
  127   HD22  ASN  15          2HD2      ASN  15 -22.307  -1.583   2.924
  128    H    GLY  16           H        GLY  16 -17.112   0.262   6.671
  129    HA2  GLY  16           2HA      GLY  16 -17.808   1.528   8.693
  130    HA3  GLY  16           3HA      GLY  16 -19.147   0.401   8.845
  131    H    LYS  17           H        LYS  17 -16.718  -1.505   7.806
  132    HA   LYS  17           HA       LYS  17 -15.830  -2.204  10.547
  133    HB2  LYS  17           2HB      LYS  17 -15.986  -3.953   8.044
  134    HB3  LYS  17           3HB      LYS  17 -15.400  -4.482   9.617
  135    HG2  LYS  17           2HG      LYS  17 -18.229  -3.595   8.983
  136    HG3  LYS  17           3HG      LYS  17 -17.691  -5.258   9.198
  137    HD2  LYS  17           2HD      LYS  17 -17.701  -3.091  11.337
  138    HD3  LYS  17           3HD      LYS  17 -18.850  -4.423  11.209
  139    HE2  LYS  17           2HE      LYS  17 -15.877  -4.649  11.798
  140    HE3  LYS  17           3HE      LYS  17 -17.201  -4.932  12.925
  141    HZ1  LYS  17           3HZ      LYS  17 -17.907  -6.783  11.478
  142    HZ2  LYS  17           1HZ      LYS  17 -16.376  -7.006  12.155
  143    HZ3  LYS  17           2HZ      LYS  17 -16.522  -6.555  10.537
  144    H    THR  18           H        THR  18 -13.636  -2.712  10.909
  145    HA   THR  18           HA       THR  18 -11.742  -1.527   8.954
  146    HB   THR  18           HB       THR  18 -11.504  -1.674  12.007
  147    HG1  THR  18           HG1      THR  18 -13.122  -0.198  11.327
  148   HG21  THR  18          3HG2      THR  18  -9.799  -0.176   9.970
  149   HG22  THR  18          1HG2      THR  18  -9.292  -1.600  10.886
  150   HG23  THR  18          2HG2      THR  18  -9.634  -0.088  11.725
  151    H    TYR  19           H        TYR  19 -10.481  -2.995   8.018
  152    HA   TYR  19           HA       TYR  19  -9.957  -5.644   9.250
  153    HB2  TYR  19           2HB      TYR  19  -9.911  -4.875   6.285
  154    HB3  TYR  19           3HB      TYR  19  -9.746  -6.495   6.949
  155    HD1  TYR  19           HD1      TYR  19 -11.740  -7.723   7.765
  156    HD2  TYR  19           HD2      TYR  19 -12.117  -3.803   6.094
  157    HE1  TYR  19           HE1      TYR  19 -14.165  -8.053   7.522
  158    HE2  TYR  19           HE2      TYR  19 -14.543  -4.132   5.856
  159    HH   TYR  19           HH       TYR  19 -16.148  -5.981   5.676
  160    H    GLU  20           H        GLU  20  -7.858  -5.688  10.044
  161    HA   GLU  20           HA       GLU  20  -5.751  -4.231   8.531
  162    HB2  GLU  20           2HB      GLU  20  -4.570  -3.859  10.587
  163    HB3  GLU  20           3HB      GLU  20  -6.221  -3.318  10.785
  164    HG2  GLU  20           2HG      GLU  20  -5.851  -4.322  12.829
  165    HG3  GLU  20           3HG      GLU  20  -6.586  -5.649  11.935
  166    H    ARG  21           H        ARG  21  -3.828  -5.279   8.022
  167    HA   ARG  21           HA       ARG  21  -3.253  -7.995   8.804
  168    HB2  ARG  21           2HB      ARG  21  -5.033  -8.462   7.157
  169    HB3  ARG  21           3HB      ARG  21  -4.228  -7.458   5.957
  170    HG2  ARG  21           2HG      ARG  21  -3.859  -9.810   5.444
  171    HG3  ARG  21           3HG      ARG  21  -2.330  -9.055   5.895
  172    HD2  ARG  21           2HD      ARG  21  -2.584  -9.999   8.176
  173    HD3  ARG  21           3HD      ARG  21  -4.053 -10.827   7.659
  174    HE   ARG  21           HE       ARG  21  -1.289 -11.509   7.017
  175   HH11  ARG  21          1HH1      ARG  21  -4.677 -12.115   6.237
  176   HH12  ARG  21          2HH1      ARG  21  -4.345 -13.652   5.503
  177   HH21  ARG  21          1HH2      ARG  21  -0.892 -13.532   6.076
  178   HH22  ARG  21          2HH2      ARG  21  -2.208 -14.447   5.411
  179    H    THR  22           H        THR  22  -1.112  -7.975   8.944
  180    HA   THR  22           HA       THR  22   0.571  -6.269   7.278
  181    HB   THR  22           HB       THR  22   1.298  -8.195   9.535
  182    HG1  THR  22           HG1      THR  22   0.121  -5.796   9.586
  183   HG21  THR  22          3HG2      THR  22   3.228  -7.759   8.043
  184   HG22  THR  22          1HG2      THR  22   3.449  -6.953   9.597
  185   HG23  THR  22          2HG2      THR  22   2.951  -6.022   8.185
  186    H    TYR  23           H        TYR  23   1.160  -7.014   5.342
  187    HA   TYR  23           HA       TYR  23   1.515  -9.880   4.763
  188    HB2  TYR  23           2HB      TYR  23   1.576  -7.477   2.866
  189    HB3  TYR  23           3HB      TYR  23   1.570  -9.175   2.396
  190    HD1  TYR  23           HD1      TYR  23  -0.501  -6.409   3.749
  191    HD2  TYR  23           HD2      TYR  23  -0.521 -10.461   2.391
  192    HE1  TYR  23           HE1      TYR  23  -2.955  -6.358   3.636
  193    HE2  TYR  23           HE2      TYR  23  -2.978 -10.403   2.274
  194    HH   TYR  23           HH       TYR  23  -4.773  -7.565   2.343
  195    H    GLN  24           H        GLN  24   3.522 -10.708   4.296
  196    HA   GLN  24           HA       GLN  24   5.877  -8.955   4.735
  197    HB2  GLN  24           2HB      GLN  24   5.671 -12.003   4.968
  198    HB3  GLN  24           3HB      GLN  24   7.141 -11.064   5.195
  199    HG2  GLN  24           2HG      GLN  24   6.356 -11.563   7.379
  200    HG3  GLN  24           3HG      GLN  24   5.968  -9.864   7.106
  201   HE21  GLN  24          1HE2      GLN  24   4.306  -9.827   8.635
  202   HE22  GLN  24          2HE2      GLN  24   2.800 -10.645   8.399
  203    H    LEU  25           H        LEU  25   6.768  -8.283   2.920
  204    HA   LEU  25           HA       LEU  25   6.789  -9.971   0.480
  205    HB2  LEU  25           2HB      LEU  25   6.873  -6.924   0.684
  206    HB3  LEU  25           3HB      LEU  25   6.981  -7.842  -0.812
  207    HG   LEU  25           HG       LEU  25   4.551  -7.697   1.018
  208   HD11  LEU  25          1HD1      LEU  25   3.479  -6.477  -0.821
  209   HD12  LEU  25          2HD1      LEU  25   4.974  -6.533  -1.756
  210   HD13  LEU  25          3HD1      LEU  25   4.910  -5.626  -0.243
  211   HD21  LEU  25          3HD2      LEU  25   4.873  -9.199  -1.606
  212   HD22  LEU  25          1HD2      LEU  25   3.358  -8.981  -0.724
  213   HD23  LEU  25          2HD2      LEU  25   4.668  -9.913  -0.004
  214    H    TYR  26           H        TYR  26   8.688  -9.677  -0.908
  215    HA   TYR  26           HA       TYR  26  11.146  -8.601   0.251
  216    HB2  TYR  26           2HB      TYR  26  11.043 -10.895   1.214
  217    HB3  TYR  26           3HB      TYR  26  10.826 -11.583  -0.389
  218    HD1  TYR  26           HD1      TYR  26  13.267  -9.844   1.834
  219    HD2  TYR  26           HD2      TYR  26  12.757 -12.016  -1.812
  220    HE1  TYR  26           HE1      TYR  26  15.702 -10.070   1.619
  221    HE2  TYR  26           HE2      TYR  26  15.193 -12.240  -2.020
  222    HH   TYR  26           HH       TYR  26  17.226 -11.171  -1.223
  223    H    ALA  27           H        ALA  27  12.351  -7.739  -1.392
  224    HA   ALA  27           HA       ALA  27  12.243  -8.841  -4.104
  225    HB1  ALA  27           3HB      ALA  27  10.339  -7.274  -4.051
  226    HB2  ALA  27           1HB      ALA  27  11.606  -6.698  -5.126
  227    HB3  ALA  27           2HB      ALA  27  11.412  -5.975  -3.529
  228    H    VAL  28           H        VAL  28  13.988  -8.354  -5.327
  229    HA   VAL  28           HA       VAL  28  16.426  -7.516  -4.166
  230    HB   VAL  28           HB       VAL  28  15.736  -7.705  -7.144
  231   HG11  VAL  28          1HG1      VAL  28  18.462  -7.841  -5.791
  232   HG12  VAL  28          2HG1      VAL  28  17.851  -6.512  -6.780
  233   HG13  VAL  28          3HG1      VAL  28  18.149  -8.088  -7.513
  234   HG21  VAL  28          3HG2      VAL  28  16.836  -9.892  -5.339
  235   HG22  VAL  28          1HG2      VAL  28  16.596 -10.012  -7.086
  236   HG23  VAL  28          2HG2      VAL  28  15.207  -9.823  -6.015
  237    H    ARG  29           H        ARG  29  14.250  -5.965  -6.529
  238    HA   ARG  29           HA       ARG  29  15.541  -3.328  -6.071
  239    HB2  ARG  29           2HB      ARG  29  13.991  -4.259  -8.537
  240    HB3  ARG  29           3HB      ARG  29  14.825  -2.718  -8.346
  241    HG2  ARG  29           2HG      ARG  29  16.997  -3.915  -8.237
  242    HG3  ARG  29           3HG      ARG  29  16.148  -5.451  -8.439
  243    HD2  ARG  29           2HD      ARG  29  17.053  -4.817 -10.576
  244    HD3  ARG  29           3HD      ARG  29  15.299  -4.615 -10.658
  245    HE   ARG  29           HE       ARG  29  16.762  -2.214  -9.937
  246   HH11  ARG  29          1HH1      ARG  29  15.445  -4.056 -12.632
  247   HH12  ARG  29          2HH1      ARG  29  15.431  -2.695 -13.706
  248   HH21  ARG  29          1HH2      ARG  29  16.793  -0.463 -11.383
  249   HH22  ARG  29          2HH2      ARG  29  16.191  -0.661 -13.002
  250    H    ASP  30           H        ASP  30  14.105  -1.474  -6.163
  251    HA   ASP  30           HA       ASP  30  11.602  -1.753  -4.819
  252    HB2  ASP  30           2HB      ASP  30  11.437   0.677  -5.003
  253    HB3  ASP  30           3HB      ASP  30  13.074   0.237  -4.547
  254    H    GLU  31           H        GLU  31  12.589  -1.439  -8.167
  255    HA   GLU  31           HA       GLU  31  10.204  -1.150  -9.565
  256    HB2  GLU  31           2HB      GLU  31  12.594  -2.940 -10.198
  257    HB3  GLU  31           3HB      GLU  31  11.343  -2.512 -11.362
  258    HG2  GLU  31           2HG      GLU  31  13.184  -0.533  -9.996
  259    HG3  GLU  31           3HG      GLU  31  13.450  -1.204 -11.605
  260    H    GLU  32           H        GLU  32  11.567  -4.015  -8.036
  261    HA   GLU  32           HA       GLU  32   9.629  -5.880  -9.061
  262    HB2  GLU  32           2HB      GLU  32  11.694  -6.169  -6.849
  263    HB3  GLU  32           3HB      GLU  32  10.778  -7.494  -7.558
  264    HG2  GLU  32           2HG      GLU  32  12.776  -5.741  -9.013
  265    HG3  GLU  32           3HG      GLU  32  13.078  -7.371  -8.423
  266    H    LEU  33           H        LEU  33   9.784  -3.770  -6.295
  267    HA   LEU  33           HA       LEU  33   7.968  -5.194  -4.603
  268    HB2  LEU  33           2HB      LEU  33   9.612  -2.940  -4.292
  269    HB3  LEU  33           3HB      LEU  33   8.013  -2.240  -4.229
  270    HG   LEU  33           HG       LEU  33   8.793  -2.702  -1.969
  271   HD11  LEU  33          1HD1      LEU  33   6.611  -4.691  -2.681
  272   HD12  LEU  33          2HD1      LEU  33   6.388  -2.986  -2.285
  273   HD13  LEU  33          3HD1      LEU  33   6.989  -4.096  -1.059
  274   HD21  LEU  33          3HD2      LEU  33   9.342  -4.948  -1.165
  275   HD22  LEU  33          1HD2      LEU  33  10.415  -4.468  -2.476
  276   HD23  LEU  33          2HD2      LEU  33   9.104  -5.612  -2.782
  277    H    LYS  34           H        LYS  34   7.590  -3.035  -7.306
  278    HA   LYS  34           HA       LYS  34   5.090  -1.898  -6.956
  279    HB2  LYS  34           2HB      LYS  34   6.522  -2.776  -9.492
  280    HB3  LYS  34           3HB      LYS  34   5.006  -1.878  -9.524
  281    HG2  LYS  34           2HG      LYS  34   6.035   0.029  -8.442
  282    HG3  LYS  34           3HG      LYS  34   7.534  -0.870  -8.186
  283    HD2  LYS  34           2HD      LYS  34   7.542   0.785 -10.128
  284    HD3  LYS  34           3HD      LYS  34   8.070  -0.856 -10.504
  285    HE2  LYS  34           2HE      LYS  34   6.580   0.111 -12.252
  286    HE3  LYS  34           3HE      LYS  34   5.919  -1.360 -11.538
  287    HZ1  LYS  34           3HZ      LYS  34   5.127   1.419 -10.868
  288    HZ2  LYS  34           1HZ      LYS  34   4.498   0.035 -10.135
  289    HZ3  LYS  34           2HZ      LYS  34   4.218   0.322 -11.775
  290    H    GLU  35           H        GLU  35   5.726  -4.827  -8.907
  291    HA   GLU  35           HA       GLU  35   3.138  -5.640  -9.481
  292    HB2  GLU  35           2HB      GLU  35   4.187  -7.961  -9.752
  293    HB3  GLU  35           3HB      GLU  35   5.001  -6.666 -10.628
  294    HG2  GLU  35           2HG      GLU  35   6.766  -6.554  -8.969
  295    HG3  GLU  35           3HG      GLU  35   5.910  -7.668  -7.913
  296    H    LYS  36           H        LYS  36   4.980  -6.117  -6.544
  297    HA   LYS  36           HA       LYS  36   3.321  -8.194  -5.433
  298    HB2  LYS  36           2HB      LYS  36   5.439  -6.503  -4.032
  299    HB3  LYS  36           3HB      LYS  36   4.798  -8.060  -3.497
  300    HG2  LYS  36           2HG      LYS  36   5.742  -9.123  -5.541
  301    HG3  LYS  36           3HG      LYS  36   6.435  -7.567  -6.001
  302    HD2  LYS  36           2HD      LYS  36   7.780  -7.603  -3.878
  303    HD3  LYS  36           3HD      LYS  36   7.154  -9.226  -3.555
  304    HE2  LYS  36           2HE      LYS  36   8.932  -8.341  -5.848
  305    HE3  LYS  36           3HE      LYS  36   9.317  -9.487  -4.570
  306    HZ1  LYS  36           3HZ      LYS  36   8.875 -10.712  -6.524
  307    HZ2  LYS  36           1HZ      LYS  36   7.435  -9.877  -6.835
  308    HZ3  LYS  36           2HZ      LYS  36   7.537 -10.936  -5.519
  309    H    LEU  37           H        LEU  37   3.725  -4.697  -4.915
  310    HA   LEU  37           HA       LEU  37   1.764  -4.343  -2.921
  311    HB2  LEU  37           2HB      LEU  37   2.783  -2.430  -5.057
  312    HB3  LEU  37           3HB      LEU  37   1.696  -1.940  -3.764
  313    HG   LEU  37           HG       LEU  37   4.480  -3.080  -3.302
  314   HD11  LEU  37          1HD1      LEU  37   4.628  -0.934  -4.455
  315   HD12  LEU  37          2HD1      LEU  37   5.172  -0.786  -2.786
  316   HD13  LEU  37          3HD1      LEU  37   3.577  -0.186  -3.249
  317   HD21  LEU  37          3HD2      LEU  37   4.193  -2.261  -0.993
  318   HD22  LEU  37          1HD2      LEU  37   2.968  -3.461  -1.402
  319   HD23  LEU  37          2HD2      LEU  37   2.546  -1.748  -1.367
  320    H    LYS  38           H        LYS  38   1.492  -4.268  -6.511
  321    HA   LYS  38           HA       LYS  38  -1.230  -3.662  -6.747
  322    HB2  LYS  38           2HB      LYS  38   0.462  -5.470  -8.533
  323    HB3  LYS  38           3HB      LYS  38  -1.109  -4.799  -8.971
  324    HG2  LYS  38           2HG      LYS  38  -0.185  -2.518  -8.848
  325    HG3  LYS  38           3HG      LYS  38   1.383  -3.178  -8.370
  326    HD2  LYS  38           2HD      LYS  38   1.431  -2.634 -10.744
  327    HD3  LYS  38           3HD      LYS  38   1.517  -4.386 -10.548
  328    HE2  LYS  38           2HE      LYS  38  -0.876  -4.580 -11.099
  329    HE3  LYS  38           3HE      LYS  38  -1.000  -2.822 -11.234
  330    HZ1  LYS  38           3HZ      LYS  38   0.627  -2.923 -13.051
  331    HZ2  LYS  38           1HZ      LYS  38  -0.787  -3.784 -13.400
  332    HZ3  LYS  38           2HZ      LYS  38   0.621  -4.612 -12.965
  333    H    LYS  39           H        LYS  39   0.417  -6.797  -6.287
  334    HA   LYS  39           HA       LYS  39  -1.907  -8.420  -6.330
  335    HB2  LYS  39           2HB      LYS  39   0.880  -8.839  -5.189
  336    HB3  LYS  39           3HB      LYS  39  -0.374 -10.056  -4.977
  337    HG2  LYS  39           2HG      LYS  39   0.682  -9.044  -7.637
  338    HG3  LYS  39           3HG      LYS  39   1.101 -10.578  -6.879
  339    HD2  LYS  39           2HD      LYS  39  -1.657  -9.773  -7.890
  340    HD3  LYS  39           3HD      LYS  39  -0.550 -10.905  -8.665
  341    HE2  LYS  39           2HE      LYS  39  -0.740 -12.442  -6.765
  342    HE3  LYS  39           3HE      LYS  39  -1.787 -11.298  -5.920
  343    HZ1  LYS  39           3HZ      LYS  39  -3.109 -12.992  -6.961
  344    HZ2  LYS  39           1HZ      LYS  39  -2.405 -12.695  -8.471
  345    HZ3  LYS  39           2HZ      LYS  39  -3.389 -11.529  -7.751
  346    H    VAL  40           H        VAL  40  -0.051  -7.133  -3.534
  347    HA   VAL  40           HA       VAL  40  -1.589  -8.084  -1.449
  348    HB   VAL  40           HB       VAL  40   0.178  -5.619  -1.698
  349   HG11  VAL  40          1HG1      VAL  40  -1.245  -6.474   0.850
  350   HG12  VAL  40          2HG1      VAL  40  -1.481  -4.958  -0.021
  351   HG13  VAL  40          3HG1      VAL  40   0.062  -5.289   0.764
  352   HG21  VAL  40          3HG2      VAL  40   1.679  -6.917  -0.215
  353   HG22  VAL  40          1HG2      VAL  40   1.266  -7.833  -1.667
  354   HG23  VAL  40          2HG2      VAL  40   0.481  -8.212  -0.133
  355    H    LEU  41           H        LEU  41  -2.042  -5.060  -3.261
  356    HA   LEU  41           HA       LEU  41  -4.232  -4.134  -1.671
  357    HB2  LEU  41           2HB      LEU  41  -3.186  -3.249  -4.382
  358    HB3  LEU  41           3HB      LEU  41  -4.510  -2.445  -3.552
  359    HG   LEU  41           HG       LEU  41  -1.676  -2.690  -2.458
  360   HD11  LEU  41          1HD1      LEU  41  -1.748  -1.235  -4.420
  361   HD12  LEU  41          2HD1      LEU  41  -1.445  -0.304  -2.956
  362   HD13  LEU  41          3HD1      LEU  41  -3.050  -0.287  -3.696
  363   HD21  LEU  41          3HD2      LEU  41  -3.322  -2.559  -0.652
  364   HD22  LEU  41          1HD2      LEU  41  -4.053  -1.125  -1.386
  365   HD23  LEU  41          2HD2      LEU  41  -2.406  -1.060  -0.757
  366    H    ASN  42           H        ASN  42  -4.049  -5.592  -4.968
  367    HA   ASN  42           HA       ASN  42  -6.830  -5.423  -5.473
  368    HB2  ASN  42           2HB      ASN  42  -4.869  -5.688  -7.168
  369    HB3  ASN  42           3HB      ASN  42  -4.978  -7.416  -6.847
  370   HD21  ASN  42          1HD2      ASN  42  -5.658  -7.993  -8.873
  371   HD22  ASN  42          2HD2      ASN  42  -7.170  -7.528  -9.564
  372    H    GLU  43           H        GLU  43  -4.826  -8.147  -4.251
  373    HA   GLU  43           HA       GLU  43  -6.870 -10.093  -4.054
  374    HB2  GLU  43           2HB      GLU  43  -4.352  -9.747  -2.367
  375    HB3  GLU  43           3HB      GLU  43  -5.426 -11.133  -2.227
  376    HG2  GLU  43           2HG      GLU  43  -3.833 -10.353  -4.682
  377    HG3  GLU  43           3HG      GLU  43  -3.449 -11.659  -3.563
  378    H    ARG  44           H        ARG  44  -5.711  -7.637  -1.767
  379    HA   ARG  44           HA       ARG  44  -7.434  -8.180   0.397
  380    HB2  ARG  44           2HB      ARG  44  -5.540  -6.764   0.811
  381    HB3  ARG  44           3HB      ARG  44  -5.916  -5.706  -0.541
  382    HG2  ARG  44           2HG      ARG  44  -6.327  -4.546   1.546
  383    HG3  ARG  44           3HG      ARG  44  -7.855  -4.807   0.708
  384    HD2  ARG  44           2HD      ARG  44  -8.604  -5.570   2.708
  385    HD3  ARG  44           3HD      ARG  44  -7.714  -7.048   2.348
  386    HE   ARG  44           HE       ARG  44  -5.994  -5.181   3.591
  387   HH11  ARG  44          1HH1      ARG  44  -8.698  -7.286   4.332
  388   HH12  ARG  44          2HH1      ARG  44  -8.273  -7.455   6.002
  389   HH21  ARG  44          1HH2      ARG  44  -5.512  -5.321   5.828
  390   HH22  ARG  44          2HH2      ARG  44  -6.475  -6.344   6.846
  391    H    MET  45           H        MET  45  -7.881  -6.196  -2.519
  392    HA   MET  45           HA       MET  45 -10.379  -5.093  -1.456
  393    HB2  MET  45           2HB      MET  45  -8.742  -4.237  -3.859
  394    HB3  MET  45           3HB      MET  45 -10.244  -3.475  -3.346
  395    HG2  MET  45           2HG      MET  45  -9.148  -2.962  -1.133
  396    HG3  MET  45           3HG      MET  45  -7.635  -3.562  -1.813
  397    HE1  MET  45           3HE      MET  45  -9.866   0.184  -3.303
  398    HE2  MET  45           1HE      MET  45 -10.349  -0.748  -1.885
  399    HE3  MET  45           2HE      MET  45 -10.519  -1.445  -3.496
  400    H    ASP  46           H        ASP  46  -9.688  -7.807  -3.113
  401    HA   ASP  46           HA       ASP  46 -11.950  -7.817  -4.885
  402    HB2  ASP  46           2HB      ASP  46 -10.070  -9.339  -5.313
  403    HB3  ASP  46           3HB      ASP  46 -10.337 -10.164  -3.783
  404    HA   PRO  47           HA       PRO  47 -14.136  -9.947  -0.871
  405    HB2  PRO  47           2HB      PRO  47 -12.500  -8.482   1.184
  406    HB3  PRO  47           3HB      PRO  47 -13.203 -10.110   1.240
  407    HG2  PRO  47           2HG      PRO  47 -10.543  -9.617   0.848
  408    HG3  PRO  47           3HG      PRO  47 -11.365 -11.079   0.292
  409    HD2  PRO  47           2HD      PRO  47 -10.342  -8.818  -1.287
  410    HD3  PRO  47           3HD      PRO  47 -10.775 -10.455  -1.818
  411    H    ILE  48           H        ILE  48 -12.580  -6.778  -1.035
  412    HA   ILE  48           HA       ILE  48 -14.479  -5.310   0.481
  413    HB   ILE  48           HB       ILE  48 -12.334  -4.375  -1.480
  414   HG12  ILE  48          2HG1      ILE  48 -11.394  -5.681   0.376
  415   HG13  ILE  48          3HG1      ILE  48 -10.931  -3.998   0.540
  416   HG21  ILE  48          1HG2      ILE  48 -13.754  -2.693   0.595
  417   HG22  ILE  48          2HG2      ILE  48 -13.949  -2.572  -1.152
  418   HG23  ILE  48          3HG2      ILE  48 -12.400  -2.181  -0.408
  419   HD11  ILE  48          3HD1      ILE  48 -12.614  -3.733   2.313
  420   HD12  ILE  48          1HD1      ILE  48 -11.428  -4.985   2.680
  421   HD13  ILE  48          2HD1      ILE  48 -13.041  -5.436   2.140
  422    H    LYS  49           H        LYS  49 -14.236  -6.077  -2.974
  423    HA   LYS  49           HA       LYS  49 -16.260  -4.324  -3.980
  424    HB2  LYS  49           2HB      LYS  49 -15.334  -7.043  -5.008
  425    HB3  LYS  49           3HB      LYS  49 -16.353  -5.925  -5.912
  426    HG2  LYS  49           2HG      LYS  49 -14.550  -4.319  -6.092
  427    HG3  LYS  49           3HG      LYS  49 -13.531  -5.275  -5.005
  428    HD2  LYS  49           2HD      LYS  49 -13.542  -7.136  -6.665
  429    HD3  LYS  49           3HD      LYS  49 -14.519  -6.146  -7.753
  430    HE2  LYS  49           2HE      LYS  49 -12.692  -4.528  -7.945
  431    HE3  LYS  49           3HE      LYS  49 -11.724  -5.461  -6.797
  432    HZ1  LYS  49           3HZ      LYS  49 -11.757  -7.318  -8.362
  433    HZ2  LYS  49           1HZ      LYS  49 -11.081  -5.938  -9.061
  434    HZ3  LYS  49           2HZ      LYS  49 -12.654  -6.399  -9.458
  435    H    LYS  50           H        LYS  50 -16.263  -7.696  -2.894
  436    HA   LYS  50           HA       LYS  50 -19.000  -8.295  -3.138
  437    HB2  LYS  50           2HB      LYS  50 -17.367 -10.051  -2.928
  438    HB3  LYS  50           3HB      LYS  50 -16.765  -9.423  -1.409
  439    HG2  LYS  50           2HG      LYS  50 -19.619 -10.369  -1.504
  440    HG3  LYS  50           3HG      LYS  50 -18.349 -11.587  -1.540
  441    HD2  LYS  50           2HD      LYS  50 -18.767  -9.496   0.628
  442    HD3  LYS  50           3HD      LYS  50 -19.161 -11.212   0.752
  443    HE2  LYS  50           2HE      LYS  50 -16.381 -10.016   0.461
  444    HE3  LYS  50           3HE      LYS  50 -17.061 -10.751   1.908
  445    HZ1  LYS  50           3HZ      LYS  50 -16.407 -12.131  -0.636
  446    HZ2  LYS  50           1HZ      LYS  50 -17.204 -12.852   0.662
  447    HZ3  LYS  50           2HZ      LYS  50 -15.624 -12.300   0.848
  448    H    LEU  51           H        LEU  51 -17.188  -6.724  -0.526
  449    HA   LEU  51           HA       LEU  51 -19.332  -6.622   1.375
  450    HB2  LEU  51           2HB      LEU  51 -16.815  -4.923   1.174
  451    HB3  LEU  51           3HB      LEU  51 -17.886  -4.976   2.569
  452    HG   LEU  51           HG       LEU  51 -16.257  -7.324   1.521
  453   HD11  LEU  51          1HD1      LEU  51 -14.835  -5.590   2.501
  454   HD12  LEU  51          2HD1      LEU  51 -14.844  -7.057   3.474
  455   HD13  LEU  51          3HD1      LEU  51 -15.775  -5.648   3.994
  456   HD21  LEU  51          3HD2      LEU  51 -18.000  -7.128   3.991
  457   HD22  LEU  51          1HD2      LEU  51 -16.907  -8.461   3.613
  458   HD23  LEU  51          2HD2      LEU  51 -18.282  -8.131   2.563
  459    H    GLY  52           H        GLY  52 -18.260  -4.579  -1.278
  460    HA2  GLY  52           2HA      GLY  52 -19.388  -3.003  -2.496
  461    HA3  GLY  52           3HA      GLY  52 -20.828  -3.378  -1.563
  462    H    CYS  53           H        CYS  53 -17.913  -1.413  -1.682
  463    HA   CYS  53           HA       CYS  53 -18.984   0.368   0.429
  464    HB2  CYS  53           2HB      CYS  53 -16.122  -0.549  -0.043
  465    HB3  CYS  53           3HB      CYS  53 -16.575   0.733   1.084
  466    H    LYS  54           H        LYS  54 -19.090   2.474  -0.058
  467    HA   LYS  54           HA       LYS  54 -18.700   3.493  -2.664
  468    HB2  LYS  54           2HB      LYS  54 -19.061   4.924   0.006
  469    HB3  LYS  54           3HB      LYS  54 -19.043   5.767  -1.538
  470    HG2  LYS  54           2HG      LYS  54 -21.055   3.630  -0.772
  471    HG3  LYS  54           3HG      LYS  54 -21.321   5.369  -0.620
  472    HD2  LYS  54           2HD      LYS  54 -20.929   5.572  -3.107
  473    HD3  LYS  54           3HD      LYS  54 -20.864   3.808  -3.188
  474    HE2  LYS  54           2HE      LYS  54 -23.169   3.648  -2.405
  475    HE3  LYS  54           3HE      LYS  54 -23.242   5.396  -2.165
  476    HZ1  LYS  54           3HZ      LYS  54 -22.885   5.665  -4.572
  477    HZ2  LYS  54           1HZ      LYS  54 -24.303   4.816  -4.216
  478    HZ3  LYS  54           2HZ      LYS  54 -22.938   3.984  -4.762
  479    H    ARG  55           H        ARG  55 -17.000   4.401   0.332
  480    HA   ARG  55           HA       ARG  55 -14.516   4.959  -1.190
  481    HB2  ARG  55           2HB      ARG  55 -15.686   7.080  -0.662
  482    HB3  ARG  55           3HB      ARG  55 -15.801   6.622   1.031
  483    HG2  ARG  55           2HG      ARG  55 -13.331   6.771   1.239
  484    HG3  ARG  55           3HG      ARG  55 -13.216   7.244  -0.459
  485    HD2  ARG  55           2HD      ARG  55 -14.603   9.259   0.032
  486    HD3  ARG  55           3HD      ARG  55 -14.668   8.785   1.730
  487    HE   ARG  55           HE       ARG  55 -12.104   8.998   1.587
  488   HH11  ARG  55          1HH1      ARG  55 -14.371  11.048  -0.171
  489   HH12  ARG  55          2HH1      ARG  55 -13.293  12.411  -0.191
  490   HH21  ARG  55          1HH2      ARG  55 -10.753  10.823   1.623
  491   HH22  ARG  55          2HH2      ARG  55 -11.250  12.280   0.820
  492    H    VAL  56           H        VAL  56 -12.813   3.910  -0.346
  493    HA   VAL  56           HA       VAL  56 -12.970   2.835   2.418
  494    HB   VAL  56           HB       VAL  56 -11.531   0.969   1.732
  495   HG11  VAL  56          1HG1      VAL  56 -13.151  -0.279   0.337
  496   HG12  VAL  56          2HG1      VAL  56 -13.995   1.228  -0.026
  497   HG13  VAL  56          3HG1      VAL  56 -13.938   0.622   1.631
  498   HG21  VAL  56          3HG2      VAL  56 -10.267   2.032  -0.100
  499   HG22  VAL  56          1HG2      VAL  56 -11.712   2.035  -1.115
  500   HG23  VAL  56          2HG2      VAL  56 -10.974   0.506  -0.627
  501    H    ARG  57           H        ARG  57 -11.236   3.153   3.738
  502    HA   ARG  57           HA       ARG  57  -9.052   4.899   2.768
  503    HB2  ARG  57           2HB      ARG  57 -10.382   5.901   4.570
  504    HB3  ARG  57           3HB      ARG  57 -10.169   4.473   5.579
  505    HG2  ARG  57           2HG      ARG  57  -7.806   4.935   5.856
  506    HG3  ARG  57           3HG      ARG  57  -7.865   6.234   4.665
  507    HD2  ARG  57           2HD      ARG  57  -9.372   6.274   7.305
  508    HD3  ARG  57           3HD      ARG  57  -7.795   7.026   7.042
  509    HE   ARG  57           HE       ARG  57  -9.923   7.848   5.227
  510   HH11  ARG  57          1HH1      ARG  57  -8.177   8.652   8.191
  511   HH12  ARG  57          2HH1      ARG  57  -8.648  10.321   8.143
  512   HH21  ARG  57          1HH2      ARG  57 -10.462  10.037   5.155
  513   HH22  ARG  57          2HH2      ARG  57  -9.938  11.106   6.425
  514    H    ILE  58           H        ILE  58  -7.408   3.661   2.192
  515    HA   ILE  58           HA       ILE  58  -6.721   1.162   3.578
  516    HB   ILE  58           HB       ILE  58  -5.453   2.373   1.057
  517   HG12  ILE  58          2HG1      ILE  58  -7.604   0.206   1.241
  518   HG13  ILE  58          3HG1      ILE  58  -7.873   1.859   0.698
  519   HG21  ILE  58          1HG2      ILE  58  -3.984   0.766   2.229
  520   HG22  ILE  58          2HG2      ILE  58  -4.534   0.097   0.694
  521   HG23  ILE  58          3HG2      ILE  58  -5.266  -0.448   2.204
  522   HD11  ILE  58          3HD1      ILE  58  -7.748   0.340  -1.161
  523   HD12  ILE  58          1HD1      ILE  58  -6.142  -0.194  -0.668
  524   HD13  ILE  58          2HD1      ILE  58  -6.396   1.469  -1.208
  525    H    SER  59           H        SER  59  -5.341   1.378   5.229
  526    HA   SER  59           HA       SER  59  -3.498   3.670   5.430
  527    HB2  SER  59           2HB      SER  59  -5.126   3.458   7.263
  528    HB3  SER  59           3HB      SER  59  -4.688   1.772   7.516
  529    HG   SER  59           HG       SER  59  -2.899   3.947   7.826
  530    H    ILE  60           H        ILE  60  -1.627   3.024   4.435
  531    HA   ILE  60           HA       ILE  60  -0.553   0.301   4.906
  532    HB   ILE  60           HB       ILE  60   0.151   2.333   2.734
  533   HG12  ILE  60          2HG1      ILE  60  -1.307  -0.342   2.503
  534   HG13  ILE  60          3HG1      ILE  60  -2.074   1.240   2.422
  535   HG21  ILE  60          1HG2      ILE  60   1.243  -0.483   3.119
  536   HG22  ILE  60          2HG2      ILE  60   2.144   1.017   3.344
  537   HG23  ILE  60          3HG2      ILE  60   1.577   0.564   1.737
  538   HD11  ILE  60          3HD1      ILE  60  -1.818   0.323   0.220
  539   HD12  ILE  60          1HD1      ILE  60  -0.081   0.119   0.454
  540   HD13  ILE  60          2HD1      ILE  60  -0.783   1.739   0.387
  541    H    ARG  61           H        ARG  61   0.882   0.254   6.551
  542    HA   ARG  61           HA       ARG  61   2.860   2.459   6.768
  543    HB2  ARG  61           2HB      ARG  61   1.539   1.991   8.858
  544    HB3  ARG  61           3HB      ARG  61   2.190   0.351   8.877
  545    HG2  ARG  61           2HG      ARG  61   4.483   1.267   9.077
  546    HG3  ARG  61           3HG      ARG  61   3.831   2.904   9.058
  547    HD2  ARG  61           2HD      ARG  61   2.699   2.513  11.192
  548    HD3  ARG  61           3HD      ARG  61   3.233   0.824  11.192
  549    HE   ARG  61           HE       ARG  61   5.465   2.562  10.954
  550   HH11  ARG  61          1HH1      ARG  61   3.176   1.456  13.384
  551   HH12  ARG  61          2HH1      ARG  61   4.271   1.718  14.708
  552   HH21  ARG  61          1HH2      ARG  61   6.879   2.942  12.693
  553   HH22  ARG  61          2HH2      ARG  61   6.368   2.557  14.317
  554    H    VAL  62           H        VAL  62   4.878   2.030   6.215
  555    HA   VAL  62           HA       VAL  62   5.691  -0.694   5.450
  556    HB   VAL  62           HB       VAL  62   6.046   1.164   3.798
  557   HG11  VAL  62          1HG1      VAL  62   8.017   2.308   5.800
  558   HG12  VAL  62          2HG1      VAL  62   6.476   3.032   5.332
  559   HG13  VAL  62          3HG1      VAL  62   7.773   2.875   4.145
  560   HG21  VAL  62          3HG2      VAL  62   7.514  -0.780   3.679
  561   HG22  VAL  62          1HG2      VAL  62   8.640  -0.043   4.817
  562   HG23  VAL  62          2HG2      VAL  62   8.399   0.671   3.217
  563    H    LYS  63           H        LYS  63   7.503  -1.691   6.435
  564    HA   LYS  63           HA       LYS  63   8.344  -0.712   9.026
  565    HB2  LYS  63           2HB      LYS  63   8.054  -3.141   8.651
  566    HB3  LYS  63           3HB      LYS  63   9.320  -3.116   7.423
  567    HG2  LYS  63           2HG      LYS  63  11.008  -2.561   9.068
  568    HG3  LYS  63           3HG      LYS  63   9.790  -2.333  10.323
  569    HD2  LYS  63           2HD      LYS  63  10.355  -4.977   8.938
  570    HD3  LYS  63           3HD      LYS  63  11.044  -4.499  10.491
  571    HE2  LYS  63           2HE      LYS  63   8.085  -4.838   9.895
  572    HE3  LYS  63           3HE      LYS  63   9.095  -5.972  10.789
  573    HZ1  LYS  63           3HZ      LYS  63   7.759  -4.531  12.231
  574    HZ2  LYS  63           1HZ      LYS  63   8.564  -3.174  11.637
  575    HZ3  LYS  63           2HZ      LYS  63   9.412  -4.346  12.504
  576    H    HIS  64           H        HIS  64  10.307   0.165   9.527
  577    HA   HIS  64           HA       HIS  64  11.637   1.622   7.381
  578    HB2  HIS  64           2HB      HIS  64  11.770   1.805  10.424
  579    HB3  HIS  64           3HB      HIS  64  12.728   2.828   9.357
  580    HD1  HIS  64           HD1      HIS  64  11.325   4.715  10.737
  581    HD2  HIS  64           HD2      HIS  64   9.208   2.516   7.920
  582    HE1  HIS  64           HE1      HIS  64   9.251   6.034  10.269
  583    HE2  HIS  64           HE2      HIS  64   7.912   4.591   8.724
  584    H    SER  65           H        SER  65  13.594   1.124   6.582
  585    HA   SER  65           HA       SER  65  14.997  -1.244   7.253
  586    HB2  SER  65           2HB      SER  65  15.917   1.127   5.571
  587    HB3  SER  65           3HB      SER  65  16.625  -0.492   5.547
  588    HG   SER  65           HG       SER  65  14.990   0.064   3.871
  589    H    ASP  66           H        ASP  66  16.207   2.119   7.441
  590    HA   ASP  66           HA       ASP  66  17.323   1.837  10.080
  591    HB2  ASP  66           2HB      ASP  66  19.077   0.618   8.839
  592    HB3  ASP  66           3HB      ASP  66  19.231   1.937   7.684
  593    H    ALA  67           H        ALA  67  18.173   3.907  10.851
  594    HA   ALA  67           HA       ALA  67  16.559   6.070  10.164
  595    HB1  ALA  67           3HB      ALA  67  17.905   7.379  11.733
  596    HB2  ALA  67           1HB      ALA  67  19.178   6.150  11.695
  597    HB3  ALA  67           2HB      ALA  67  17.593   5.768  12.371
  598    H    ALA  68           H        ALA  68  19.819   5.325   9.013
  599    HA   ALA  68           HA       ALA  68  20.372   7.766   7.661
  600    HB1  ALA  68           3HB      ALA  68  22.073   6.460   6.431
  601    HB2  ALA  68           1HB      ALA  68  21.360   4.959   7.050
  602    HB3  ALA  68           2HB      ALA  68  22.117   6.100   8.156
  603    H    GLU  69           H        GLU  69  18.787   4.759   6.703
  604    HA   GLU  69           HA       GLU  69  18.462   5.361   3.940
  605    HB2  GLU  69           2HB      GLU  69  16.949   3.345   5.662
  606    HB3  GLU  69           3HB      GLU  69  16.974   3.375   3.901
  607    HG2  GLU  69           2HG      GLU  69  19.337   2.850   5.715
  608    HG3  GLU  69           3HG      GLU  69  18.460   1.647   4.773
  609    H    GLU  70           H        GLU  70  16.308   5.613   6.766
  610    HA   GLU  70           HA       GLU  70  13.813   5.484   5.691
  611    HB2  GLU  70           2HB      GLU  70  14.757   7.111   8.072
  612    HB3  GLU  70           3HB      GLU  70  13.052   6.869   7.698
  613    HG2  GLU  70           2HG      GLU  70  13.281   4.467   7.979
  614    HG3  GLU  70           3HG      GLU  70  15.021   4.635   8.212
  615    H    LYS  71           H        LYS  71  15.799   8.367   5.693
  616    HA   LYS  71           HA       LYS  71  13.810  10.296   5.083
  617    HB2  LYS  71           2HB      LYS  71  16.799  10.366   4.482
  618    HB3  LYS  71           3HB      LYS  71  15.722  11.763   4.562
  619    HG2  LYS  71           2HG      LYS  71  15.313  11.330   6.950
  620    HG3  LYS  71           3HG      LYS  71  16.362   9.910   6.875
  621    HD2  LYS  71           2HD      LYS  71  18.300  11.330   6.375
  622    HD3  LYS  71           3HD      LYS  71  17.267  12.766   6.343
  623    HE2  LYS  71           2HE      LYS  71  17.829  11.004   8.754
  624    HE3  LYS  71           3HE      LYS  71  18.447  12.631   8.475
  625    HZ1  LYS  71           3HZ      LYS  71  15.619  11.858   8.943
  626    HZ2  LYS  71           1HZ      LYS  71  16.111  13.412   8.495
  627    HZ3  LYS  71           2HZ      LYS  71  16.612  12.759   9.970
  628    H    LYS  72           H        LYS  72  16.196   8.634   3.040
  629    HA   LYS  72           HA       LYS  72  15.004   9.509   0.554
  630    HB2  LYS  72           2HB      LYS  72  17.479   9.206   0.876
  631    HB3  LYS  72           3HB      LYS  72  17.231   7.474   1.059
  632    HG2  LYS  72           2HG      LYS  72  18.028   8.039  -1.193
  633    HG3  LYS  72           3HG      LYS  72  16.410   7.328  -1.256
  634    HD2  LYS  72           2HD      LYS  72  15.441   9.613  -1.460
  635    HD3  LYS  72           3HD      LYS  72  17.069  10.299  -1.448
  636    HE2  LYS  72           2HE      LYS  72  15.960   8.394  -3.538
  637    HE3  LYS  72           3HE      LYS  72  16.146  10.137  -3.725
  638    HZ1  LYS  72           3HZ      LYS  72  18.546   9.847  -3.449
  639    HZ2  LYS  72           1HZ      LYS  72  17.953   8.985  -4.776
  640    HZ3  LYS  72           2HZ      LYS  72  18.340   8.175  -3.347
  641    H    GLU  73           H        GLU  73  14.784   6.718   2.649
  642    HA   GLU  73           HA       GLU  73  13.991   4.726   0.774
  643    HB2  GLU  73           2HB      GLU  73  15.029   4.303   3.065
  644    HB3  GLU  73           3HB      GLU  73  13.498   4.765   3.789
  645    HG2  GLU  73           2HG      GLU  73  13.522   2.398   3.801
  646    HG3  GLU  73           3HG      GLU  73  12.434   2.841   2.491
  647    H    ALA  74           H        ALA  74  12.285   6.919   2.969
  648    HA   ALA  74           HA       ALA  74   9.645   5.978   2.563
  649    HB1  ALA  74           3HB      ALA  74  10.252   7.410   4.454
  650    HB2  ALA  74           1HB      ALA  74   8.928   8.119   3.533
  651    HB3  ALA  74           2HB      ALA  74  10.567   8.759   3.358
  652    H    LYS  75           H        LYS  75  11.393   8.738   1.081
  653    HA   LYS  75           HA       LYS  75   9.489   9.587  -0.788
  654    HB2  LYS  75           2HB      LYS  75  11.528  10.864  -0.140
  655    HB3  LYS  75           3HB      LYS  75  12.544   9.685  -0.955
  656    HG2  LYS  75           2HG      LYS  75  12.350  11.681  -2.325
  657    HG3  LYS  75           3HG      LYS  75  11.529  10.343  -3.135
  658    HD2  LYS  75           2HD      LYS  75   9.342  11.211  -2.309
  659    HD3  LYS  75           3HD      LYS  75  10.179  12.565  -1.541
  660    HE2  LYS  75           2HE      LYS  75   9.167  13.203  -3.706
  661    HE3  LYS  75           3HE      LYS  75  10.921  13.376  -3.739
  662    HZ1  LYS  75           3HZ      LYS  75  11.105  11.350  -4.972
  663    HZ2  LYS  75           1HZ      LYS  75   9.981  12.339  -5.749
  664    HZ3  LYS  75           2HZ      LYS  75   9.457  11.031  -4.824
  665    H    LYS  76           H        LYS  76  11.972   7.132  -1.019
  666    HA   LYS  76           HA       LYS  76  11.874   6.490  -3.782
  667    HB2  LYS  76           2HB      LYS  76  13.817   5.922  -2.500
  668    HB3  LYS  76           3HB      LYS  76  12.871   5.095  -1.277
  669    HG2  LYS  76           2HG      LYS  76  12.386   3.295  -2.983
  670    HG3  LYS  76           3HG      LYS  76  13.534   4.095  -4.067
  671    HD2  LYS  76           2HD      LYS  76  15.363   3.751  -2.508
  672    HD3  LYS  76           3HD      LYS  76  14.256   3.225  -1.237
  673    HE2  LYS  76           2HE      LYS  76  13.681   1.245  -2.747
  674    HE3  LYS  76           3HE      LYS  76  15.061   1.724  -3.741
  675    HZ1  LYS  76           3HZ      LYS  76  15.724   0.062  -2.152
  676    HZ2  LYS  76           1HZ      LYS  76  15.129   0.981  -0.860
  677    HZ3  LYS  76           2HZ      LYS  76  16.468   1.522  -1.744
  678    H    PHE  77           H        PHE  77  10.396   4.969  -0.901
  679    HA   PHE  77           HA       PHE  77   9.002   2.945  -2.409
  680    HB2  PHE  77           2HB      PHE  77   9.855   2.607  -0.065
  681    HB3  PHE  77           3HB      PHE  77   8.648   3.748   0.521
  682    HD1  PHE  77           HD1      PHE  77   8.791   0.655  -1.643
  683    HD2  PHE  77           HD2      PHE  77   6.708   2.755   1.451
  684    HE1  PHE  77           HE1      PHE  77   7.196  -1.201  -1.446
  685    HE2  PHE  77           HE2      PHE  77   5.116   0.881   1.641
  686    HZ   PHE  77           HZ       PHE  77   5.359  -1.096   0.191
  687    H    ALA  78           H        ALA  78   8.341   6.161  -1.301
  688    HA   ALA  78           HA       ALA  78   5.493   6.184  -1.580
  689    HB1  ALA  78           3HB      ALA  78   5.707   8.634  -1.566
  690    HB2  ALA  78           1HB      ALA  78   7.460   8.497  -1.772
  691    HB3  ALA  78           2HB      ALA  78   6.691   7.906  -0.299
  692    H    ALA  79           H        ALA  79   8.202   6.748  -3.796
  693    HA   ALA  79           HA       ALA  79   6.717   7.554  -6.083
  694    HB1  ALA  79           3HB      ALA  79   9.412   6.152  -5.925
  695    HB2  ALA  79           1HB      ALA  79   9.151   7.893  -5.856
  696    HB3  ALA  79           2HB      ALA  79   8.770   7.007  -7.333
  697    H    ILE  80           H        ILE  80   7.787   4.416  -4.853
  698    HA   ILE  80           HA       ILE  80   6.882   2.782  -6.998
  699    HB   ILE  80           HB       ILE  80   7.519   2.113  -4.086
  700   HG12  ILE  80          2HG1      ILE  80   9.437   2.993  -5.334
  701   HG13  ILE  80          3HG1      ILE  80   9.674   1.276  -5.033
  702   HG21  ILE  80          1HG2      ILE  80   7.129   0.151  -6.376
  703   HG22  ILE  80          2HG2      ILE  80   6.065   0.344  -4.985
  704   HG23  ILE  80          3HG2      ILE  80   7.707  -0.254  -4.758
  705   HD11  ILE  80          3HD1      ILE  80   8.815   2.539  -7.641
  706   HD12  ILE  80          1HD1      ILE  80   8.967   0.801  -7.361
  707   HD13  ILE  80          2HD1      ILE  80  10.386   1.841  -7.261
  708    H    LEU  81           H        LEU  81   5.420   3.785  -3.911
  709    HA   LEU  81           HA       LEU  81   3.032   2.262  -4.063
  710    HB2  LEU  81           2HB      LEU  81   3.820   4.781  -2.551
  711    HB3  LEU  81           3HB      LEU  81   2.180   4.170  -2.469
  712    HG   LEU  81           HG       LEU  81   4.648   2.626  -1.567
  713   HD11  LEU  81          1HD1      LEU  81   2.535   4.023   0.113
  714   HD12  LEU  81          2HD1      LEU  81   4.205   4.550  -0.113
  715   HD13  LEU  81          3HD1      LEU  81   3.870   3.036   0.722
  716   HD21  LEU  81          3HD2      LEU  81   1.703   1.928  -1.249
  717   HD22  LEU  81          1HD2      LEU  81   3.063   1.033  -0.567
  718   HD23  LEU  81          2HD2      LEU  81   2.857   1.118  -2.313
  719    H    ASN  82           H        ASN  82   3.905   5.565  -5.017
  720    HA   ASN  82           HA       ASN  82   1.425   6.597  -5.801
  721    HB2  ASN  82           2HB      ASN  82   3.350   8.054  -5.472
  722    HB3  ASN  82           3HB      ASN  82   4.253   7.257  -6.751
  723   HD21  ASN  82          1HD2      ASN  82   1.599   9.440  -6.071
  724   HD22  ASN  82          2HD2      ASN  82   1.536  10.146  -7.640
  725    H    LYS  83           H        LYS  83   3.867   4.825  -7.676
  726    HA   LYS  83           HA       LYS  83   2.552   4.996 -10.195
  727    HB2  LYS  83           2HB      LYS  83   4.729   3.157  -9.146
  728    HB3  LYS  83           3HB      LYS  83   4.100   3.009 -10.783
  729    HG2  LYS  83           2HG      LYS  83   5.529   5.421  -9.610
  730    HG3  LYS  83           3HG      LYS  83   6.158   4.285 -10.807
  731    HD2  LYS  83           2HD      LYS  83   4.314   5.013 -12.376
  732    HD3  LYS  83           3HD      LYS  83   3.867   6.251 -11.197
  733    HE2  LYS  83           2HE      LYS  83   6.527   6.022 -12.644
  734    HE3  LYS  83           3HE      LYS  83   5.263   7.205 -12.964
  735    HZ1  LYS  83           3HZ      LYS  83   6.760   6.976 -10.413
  736    HZ2  LYS  83           1HZ      LYS  83   5.617   8.155 -10.803
  737    HZ3  LYS  83           2HZ      LYS  83   7.085   8.099 -11.632
  738    H    VAL  84           H        VAL  84   2.438   2.586  -7.575
  739    HA   VAL  84           HA       VAL  84   0.989   0.566  -8.984
  740    HB   VAL  84           HB       VAL  84   1.400   1.095  -5.999
  741   HG11  VAL  84          1HG1      VAL  84   0.006  -1.309  -7.246
  742   HG12  VAL  84          2HG1      VAL  84  -0.722  -0.107  -6.178
  743   HG13  VAL  84          3HG1      VAL  84   0.521  -1.194  -5.561
  744   HG21  VAL  84          3HG2      VAL  84   3.404   0.430  -7.271
  745   HG22  VAL  84          1HG2      VAL  84   2.573  -1.011  -7.857
  746   HG23  VAL  84          2HG2      VAL  84   2.934  -0.835  -6.138
  747    H    PHE  85           H        PHE  85   0.071   3.242  -6.880
  748    HA   PHE  85           HA       PHE  85  -2.721   2.798  -6.815
  749    HB2  PHE  85           2HB      PHE  85  -1.222   5.434  -6.494
  750    HB3  PHE  85           3HB      PHE  85  -2.898   5.147  -6.030
  751    HD1  PHE  85           HD1      PHE  85  -2.376   2.277  -4.851
  752    HD2  PHE  85           HD2      PHE  85  -0.464   6.066  -4.285
  753    HE1  PHE  85           HE1      PHE  85  -1.616   1.574  -2.619
  754    HE2  PHE  85           HE2      PHE  85   0.287   5.342  -2.061
  755    HZ   PHE  85           HZ       PHE  85  -0.286   3.098  -1.229
  756    H    ALA  86           H        ALA  86  -0.663   4.670  -9.030
  757    HA   ALA  86           HA       ALA  86  -2.748   5.754 -10.653
  758    HB1  ALA  86           3HB      ALA  86  -0.947   6.270 -12.258
  759    HB2  ALA  86           1HB      ALA  86   0.168   5.242 -11.340
  760    HB3  ALA  86           2HB      ALA  86  -0.490   6.706 -10.614
  761    H    GLU  87           H        GLU  87  -1.213   2.621 -10.559
  762    HA   GLU  87           HA       GLU  87  -2.045   1.738 -13.202
  763    HB2  GLU  87           2HB      GLU  87  -0.859   0.237 -10.818
  764    HB3  GLU  87           3HB      GLU  87  -1.240  -0.524 -12.362
  765    HG2  GLU  87           2HG      GLU  87   0.390   0.916 -13.505
  766    HG3  GLU  87           3HG      GLU  87   0.736   1.744 -11.989
  767    H    LEU  88           H        LEU  88  -3.549   2.008 -10.123
  768    HA   LEU  88           HA       LEU  88  -5.460  -0.192 -10.674
  769    HB2  LEU  88           2HB      LEU  88  -4.686   1.043  -7.993
  770    HB3  LEU  88           3HB      LEU  88  -5.933  -0.173  -8.214
  771    HG   LEU  88           HG       LEU  88  -2.956  -0.581  -8.724
  772   HD11  LEU  88          1HD1      LEU  88  -3.451  -0.445  -6.341
  773   HD12  LEU  88          2HD1      LEU  88  -3.007  -2.090  -6.785
  774   HD13  LEU  88          3HD1      LEU  88  -4.703  -1.681  -6.500
  775   HD21  LEU  88          3HD2      LEU  88  -3.481  -2.968  -9.062
  776   HD22  LEU  88          1HD2      LEU  88  -4.241  -1.948 -10.285
  777   HD23  LEU  88          2HD2      LEU  88  -5.207  -2.604  -8.963
  778    H    GLY  89           H        GLY  89  -5.092   3.234 -10.188
  779    HA2  GLY  89           2HA      GLY  89  -6.665   4.761 -11.114
  780    HA3  GLY  89           3HA      GLY  89  -7.969   3.648 -10.744
  781    H    TYR  90           H        TYR  90  -5.413   4.692  -8.514
  782    HA   TYR  90           HA       TYR  90  -7.338   6.360  -6.997
  783    HB2  TYR  90           2HB      TYR  90  -4.678   5.377  -5.886
  784    HB3  TYR  90           3HB      TYR  90  -6.084   5.947  -4.998
  785    HD1  TYR  90           HD2      TYR  90  -8.312   4.337  -5.684
  786    HD2  TYR  90           HD1      TYR  90  -4.214   3.127  -5.529
  787    HE1  TYR  90           HE2      TYR  90  -8.999   1.998  -5.359
  788    HE2  TYR  90           HE1      TYR  90  -4.909   0.800  -5.204
  789    HH   TYR  90           HH       TYR  90  -6.920  -0.418  -4.337
  790    H    ASN  91           H        ASN  91  -6.811   8.502  -6.734
  791    HA   ASN  91           HA       ASN  91  -4.819   9.599  -8.566
  792    HB2  ASN  91           2HB      ASN  91  -7.211  10.464  -8.366
  793    HB3  ASN  91           3HB      ASN  91  -6.803  11.083  -6.774
  794   HD21  ASN  91          1HD2      ASN  91  -6.506  11.565 -10.183
  795   HD22  ASN  91          2HD2      ASN  91  -5.745  13.112 -10.116
  796    H    ASP  92           H        ASP  92  -3.276  11.261  -7.881
  797    HA   ASP  92           HA       ASP  92  -1.631  10.679  -5.696
  798    HB2  ASP  92           2HB      ASP  92  -1.881  13.332  -7.201
  799    HB3  ASP  92           3HB      ASP  92  -0.542  12.895  -6.145
  800    H    SER  93           H        SER  93  -4.176  13.087  -6.034
  801    HA   SER  93           HA       SER  93  -3.942  14.483  -3.625
  802    HB2  SER  93           2HB      SER  93  -5.321  15.210  -5.569
  803    HB3  SER  93           3HB      SER  93  -6.490  13.936  -5.222
  804    HG   SER  93           HG       SER  93  -5.799  16.176  -3.619
  805    H    ASN  94           H        ASN  94  -5.605  11.446  -4.356
  806    HA   ASN  94           HA       ASN  94  -7.069  11.071  -1.955
  807    HB2  ASN  94           2HB      ASN  94  -5.937   8.958  -3.851
  808    HB3  ASN  94           3HB      ASN  94  -7.173   8.676  -2.627
  809   HD21  ASN  94          1HD2      ASN  94  -8.499   7.879  -4.336
  810   HD22  ASN  94          2HD2      ASN  94  -9.339   8.961  -5.389
  811    H    VAL  95           H        VAL  95  -3.736  10.618  -2.729
  812    HA   VAL  95           HA       VAL  95  -3.125   8.861  -0.462
  813    HB   VAL  95           HB       VAL  95  -1.283  10.045  -2.607
  814   HG11  VAL  95          1HG1      VAL  95   0.318   8.294  -1.970
  815   HG12  VAL  95          2HG1      VAL  95  -0.779   7.720  -0.712
  816   HG13  VAL  95          3HG1      VAL  95  -0.060   9.326  -0.585
  817   HG21  VAL  95          3HG2      VAL  95  -1.450   7.875  -3.763
  818   HG22  VAL  95          1HG2      VAL  95  -3.031   8.648  -3.632
  819   HG23  VAL  95          2HG2      VAL  95  -2.613   7.309  -2.560
  820    H    THR  96           H        THR  96  -2.731   9.820   1.479
  821    HA   THR  96           HA       THR  96  -1.272  12.389   1.630
  822    HB   THR  96           HB       THR  96  -3.653  11.658   3.417
  823    HG1  THR  96           HG1      THR  96  -4.553  12.106   1.479
  824   HG21  THR  96          3HG2      THR  96  -2.037  13.212   4.476
  825   HG22  THR  96          1HG2      THR  96  -3.562  14.024   4.109
  826   HG23  THR  96          2HG2      THR  96  -2.152  14.290   3.082
  827    H    TRP  97           H        TRP  97   0.649  11.718   2.477
  828    HA   TRP  97           HA       TRP  97   0.979   9.589   4.357
  829    HB2  TRP  97           2HB      TRP  97   2.831  11.831   3.431
  830    HB3  TRP  97           3HB      TRP  97   3.323  10.621   4.613
  831    HD1  TRP  97           HD1      TRP  97   2.250  10.815   0.868
  832    HE1  TRP  97           HE1      TRP  97   3.242   8.767  -0.345
  833    HE3  TRP  97           HE3      TRP  97   4.239   8.343   4.896
  834    HZ2  TRP  97           HZ2      TRP  97   4.687   6.432   0.319
  835    HZ3  TRP  97           HZ3      TRP  97   5.407   6.205   4.524
  836    HH2  TRP  97           HH2      TRP  97   5.622   5.271   2.273
  837    H    ASP  98           H        ASP  98   0.165   9.709   6.355
  838    HA   ASP  98           HA       ASP  98   0.293  12.238   7.917
  839    HB2  ASP  98           2HB      ASP  98  -2.002  11.270   7.610
  840    HB3  ASP  98           3HB      ASP  98  -1.469   9.762   8.345
  841    H    GLY  99           H        GLY  99   2.345  12.082   8.748
  842    HA2  GLY  99           2HA      GLY  99   4.011  11.496  10.194
  843    HA3  GLY  99           3HA      GLY  99   2.900  10.368  10.955
  844    H    ASP 100           H        ASP 100   3.534   8.338  10.867
  845    HA   ASP 100           HA       ASP 100   5.748   7.418   9.229
  846    HB2  ASP 100           2HB      ASP 100   5.246   6.828  11.710
  847    HB3  ASP 100           3HB      ASP 100   4.002   5.746  11.107
  848    H    THR 101           H        THR 101   2.284   7.205   9.205
  849    HA   THR 101           HA       THR 101   2.223   4.890   7.350
  850    HB   THR 101           HB       THR 101  -0.026   5.975   9.118
  851    HG1  THR 101           HG1      THR 101   2.145   4.750   9.911
  852   HG21  THR 101          3HG2      THR 101  -1.062   3.768   8.738
  853   HG22  THR 101          1HG2      THR 101   0.277   3.301   7.690
  854   HG23  THR 101          2HG2      THR 101  -0.812   4.604   7.205
  855    H    VAL 102           H        VAL 102   0.871   5.041   5.468
  856    HA   VAL 102           HA       VAL 102   0.169   7.797   4.651
  857    HB   VAL 102           HB       VAL 102   1.826   6.683   3.187
  858   HG11  VAL 102          1HG1      VAL 102   1.185   4.338   3.418
  859   HG12  VAL 102          2HG1      VAL 102   1.250   4.800   1.716
  860   HG13  VAL 102          3HG1      VAL 102  -0.310   4.637   2.531
  861   HG21  VAL 102          3HG2      VAL 102   0.753   7.185   1.034
  862   HG22  VAL 102          1HG2      VAL 102   0.321   8.384   2.257
  863   HG23  VAL 102          2HG2      VAL 102  -0.837   7.133   1.802
  864    H    THR 103           H        THR 103  -1.843   8.287   4.084
  865    HA   THR 103           HA       THR 103  -4.054   6.389   4.520
  866    HB   THR 103           HB       THR 103  -4.060   9.457   4.464
  867    HG1  THR 103           HG1      THR 103  -3.128   7.831   6.355
  868   HG21  THR 103          3HG2      THR 103  -6.163   7.506   5.475
  869   HG22  THR 103          1HG2      THR 103  -6.283   8.496   4.016
  870   HG23  THR 103          2HG2      THR 103  -6.240   9.263   5.604
  871    H    VAL 104           H        VAL 104  -4.363   5.484   2.482
  872    HA   VAL 104           HA       VAL 104  -4.605   7.255   0.104
  873    HB   VAL 104           HB       VAL 104  -4.220   4.207   0.174
  874   HG11  VAL 104          1HG1      VAL 104  -4.019   6.167  -2.152
  875   HG12  VAL 104          2HG1      VAL 104  -5.308   4.990  -1.891
  876   HG13  VAL 104          3HG1      VAL 104  -3.667   4.438  -2.234
  877   HG21  VAL 104          3HG2      VAL 104  -1.873   4.596  -0.398
  878   HG22  VAL 104          1HG2      VAL 104  -2.260   5.376   1.135
  879   HG23  VAL 104          2HG2      VAL 104  -2.114   6.342  -0.336
  880    H    GLU 105           H        GLU 105  -6.730   7.776  -0.187
  881    HA   GLU 105           HA       GLU 105  -8.817   5.806   0.585
  882    HB2  GLU 105           2HB      GLU 105  -9.045   8.826   0.219
  883    HB3  GLU 105           3HB      GLU 105 -10.357   7.748   0.697
  884    HG2  GLU 105           2HG      GLU 105  -9.077   7.153   2.754
  885    HG3  GLU 105           3HG      GLU 105  -7.831   8.307   2.278
  886    H    GLY 106           H        GLY 106  -9.436   4.658  -1.112
  887    HA2  GLY 106           2HA      GLY 106  -9.797   5.974  -3.761
  888    HA3  GLY 106           3HA      GLY 106  -9.373   4.279  -3.530
  889    H    GLN 107           H        GLN 107 -11.791   5.920  -4.629
  890    HA   GLN 107           HA       GLN 107 -13.970   4.552  -3.231
  891    HB2  GLN 107           2HB      GLN 107 -15.436   5.713  -4.909
  892    HB3  GLN 107           3HB      GLN 107 -14.466   6.808  -3.937
  893    HG2  GLN 107           2HG      GLN 107 -12.884   7.061  -5.858
  894    HG3  GLN 107           3HG      GLN 107 -13.942   6.019  -6.816
  895   HE21  GLN 107          1HE2      GLN 107 -14.340   7.659  -8.337
  896   HE22  GLN 107          2HE2      GLN 107 -15.339   9.025  -7.992
  897    H    LEU 108           H        LEU 108 -15.107   2.808  -4.066
  898    HA   LEU 108           HA       LEU 108 -13.627   1.078  -5.814
  899    HB2  LEU 108           2HB      LEU 108 -16.322   0.784  -4.445
  900    HB3  LEU 108           3HB      LEU 108 -15.712  -0.442  -5.545
  901    HG   LEU 108           HG       LEU 108 -14.470   0.380  -2.888
  902   HD11  LEU 108          1HD1      LEU 108 -14.996  -1.930  -2.218
  903   HD12  LEU 108          2HD1      LEU 108 -15.770  -2.224  -3.776
  904   HD13  LEU 108          3HD1      LEU 108 -16.452  -1.040  -2.657
  905   HD21  LEU 108          3HD2      LEU 108 -13.443  -1.636  -4.917
  906   HD22  LEU 108          1HD2      LEU 108 -12.803  -1.398  -3.288
  907   HD23  LEU 108          2HD2      LEU 108 -12.677  -0.106  -4.478
  908    H    GLU 109           H        GLU 109 -14.294   0.162  -7.754
  909    HA   GLU 109           HA       GLU 109 -15.858   1.521  -9.657
  910    HB2  GLU 109           2HB      GLU 109 -15.779  -0.649 -10.913
  911    HB3  GLU 109           3HB      GLU 109 -14.202  -0.125 -10.342
  912    HG2  GLU 109           2HG      GLU 109 -14.446  -1.713  -8.401
  913    HG3  GLU 109           3HG      GLU 109 -15.931  -2.312  -9.139
  914    H    GLY 110           H        GLY 110 -16.618  -0.897  -7.226
  915    HA2  GLY 110           2HA      GLY 110 -18.539  -1.607  -6.241
  916    HA3  GLY 110           3HA      GLY 110 -19.384  -0.286  -7.046
  917    H    VAL 111           H        VAL 111 -20.983  -2.139  -7.007
  918    HA   VAL 111           HA       VAL 111 -22.479  -3.298  -8.210
  919    HB   VAL 111           HB       VAL 111 -20.634  -3.030 -10.625
  920   HG11  VAL 111          1HG1      VAL 111 -22.247  -4.859 -10.951
  921   HG12  VAL 111          2HG1      VAL 111 -22.644  -3.495 -11.994
  922   HG13  VAL 111          3HG1      VAL 111 -23.587  -3.787 -10.530
  923   HG21  VAL 111          3HG2      VAL 111 -21.290  -0.825  -9.758
  924   HG22  VAL 111          1HG2      VAL 111 -22.994  -1.288  -9.788
  925   HG23  VAL 111          2HG2      VAL 111 -22.090  -1.135 -11.299
  926    H    ASP 112           H        ASP 112 -19.290  -4.362  -9.292
  927    HA   ASP 112           HA       ASP 112 -19.639  -7.056  -9.725
  928    HB2  ASP 112           2HB      ASP 112 -17.659  -5.709 -10.431
  929    HB3  ASP 112           3HB      ASP 112 -17.126  -5.593  -8.759
  930    H    LEU 113           H        LEU 113 -20.677  -8.285  -8.252
  931    HA   LEU 113           HA       LEU 113 -19.514  -8.704  -5.555
  932    HB2  LEU 113           2HB      LEU 113 -22.281  -9.446  -6.610
  933    HB3  LEU 113           3HB      LEU 113 -21.705  -9.744  -4.977
  934    HG   LEU 113           HG       LEU 113 -22.133  -6.978  -6.182
  935   HD11  LEU 113          1HD1      LEU 113 -24.274  -8.153  -5.899
  936   HD12  LEU 113          2HD1      LEU 113 -24.121  -6.815  -4.765
  937   HD13  LEU 113          3HD1      LEU 113 -23.890  -8.474  -4.204
  938   HD21  LEU 113          3HD2      LEU 113 -21.869  -6.153  -3.873
  939   HD22  LEU 113          1HD2      LEU 113 -20.408  -6.952  -4.454
  940   HD23  LEU 113          2HD2      LEU 113 -21.481  -7.786  -3.328
  941    H    GLU 114           H        GLU 114 -19.147 -10.942  -4.928
  942    HA   GLU 114           HA       GLU 114 -17.979 -12.465  -7.040
  943    HB2  GLU 114           2HB      GLU 114 -17.241 -14.025  -5.324
  944    HB3  GLU 114           3HB      GLU 114 -16.985 -12.376  -4.769
  945    HG2  GLU 114           2HG      GLU 114 -18.940 -12.528  -3.307
  946    HG3  GLU 114           3HG      GLU 114 -19.306 -14.136  -3.924
  947    H    HIS 115           H        HIS 115 -18.547 -14.458  -7.917
  948    HA   HIS 115           HA       HIS 115 -21.159 -15.656  -7.153
  949    HB2  HIS 115           2HB      HIS 115 -20.749 -15.099  -9.599
  950    HB3  HIS 115           3HB      HIS 115 -19.432 -16.264  -9.604
  951    HD1  HIS 115           HD1      HIS 115 -20.393 -17.968 -11.188
  952    HD2  HIS 115           HD2      HIS 115 -23.065 -16.953  -8.171
  953    HE1  HIS 115           HE1      HIS 115 -22.295 -19.588 -11.399
  954    HE2  HIS 115           HE2      HIS 115 -23.792 -19.072  -9.450
  955    H    HIS 116           H        HIS 116 -18.387 -15.765  -5.809
  956    HA   HIS 116           HA       HIS 116 -17.756 -18.610  -5.779
  957    HB2  HIS 116           2HB      HIS 116 -16.649 -16.319  -4.081
  958    HB3  HIS 116           3HB      HIS 116 -16.051 -17.975  -4.063
  959    HD1  HIS 116           HD1      HIS 116 -14.810 -18.798  -6.285
  960    HD2  HIS 116           HD2      HIS 116 -15.572 -14.717  -6.058
  961    HE1  HIS 116           HE1      HIS 116 -13.360 -17.735  -8.039
  962    HE2  HIS 116           HE2      HIS 116 -13.740 -15.267  -7.787
  963    H    HIS 117           H        HIS 117 -17.992 -19.934  -3.977
  964    HA   HIS 117           HA       HIS 117 -19.412 -19.045  -1.579
  965    HB2  HIS 117           2HB      HIS 117 -21.213 -19.746  -3.231
  966    HB3  HIS 117           3HB      HIS 117 -20.511 -21.356  -3.262
  967    HD1  HIS 117           HD1      HIS 117 -21.891 -18.980  -0.593
  968    HD2  HIS 117           HD2      HIS 117 -21.779 -23.027  -1.531
  969    HE1  HIS 117           HE1      HIS 117 -23.212 -20.126   1.200
  970    HE2  HIS 117           HE2      HIS 117 -22.905 -22.574   0.743
  971    H    HIS 118           H        HIS 118 -16.755 -19.804  -2.184
  972    HA   HIS 118           HA       HIS 118 -16.173 -22.500  -1.440
  973    HB2  HIS 118           2HB      HIS 118 -14.660 -20.828  -2.730
  974    HB3  HIS 118           3HB      HIS 118 -14.249 -20.149  -1.159
  975    HD1  HIS 118           HD1      HIS 118 -13.793 -23.204  -3.284
  976    HD2  HIS 118           HD2      HIS 118 -12.425 -21.701   0.346
  977    HE1  HIS 118           HE1      HIS 118 -11.906 -24.707  -2.603
  978    HE2  HIS 118           HE2      HIS 118 -11.101 -23.794  -0.408
  979    H    HIS 119           H        HIS 119 -16.932 -19.617   0.311
  980    HA   HIS 119           HA       HIS 119 -15.947 -20.199   2.882
  981    HB2  HIS 119           2HB      HIS 119 -16.913 -17.986   2.181
  982    HB3  HIS 119           3HB      HIS 119 -18.517 -18.709   2.154
  983    HD1  HIS 119           HD1      HIS 119 -19.543 -19.379   4.520
  984    HD2  HIS 119           HD2      HIS 119 -16.007 -17.209   4.689
  985    HE1  HIS 119           HE1      HIS 119 -19.307 -18.657   6.910
  986    HE2  HIS 119           HE2      HIS 119 -17.257 -17.206   6.940
  987    H    HIS 120           H        HIS 120 -16.372 -21.962   4.023
  988    HA   HIS 120           HA       HIS 120 -18.930 -23.400   3.890
  989    HB2  HIS 120           2HB      HIS 120 -16.153 -24.110   4.908
  990    HB3  HIS 120           3HB      HIS 120 -17.548 -24.998   5.518
  991    HD1  HIS 120           HD1      HIS 120 -17.214 -27.199   4.403
  992    HD2  HIS 120           HD2      HIS 120 -17.028 -24.054   1.689
  993    HE1  HIS 120           HE1      HIS 120 -17.142 -28.266   2.138
  994    HE2  HIS 120           HE2      HIS 120 -17.355 -26.344   0.539
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1  21.513  -2.028   0.165
    2    H2   MET   1           2H       MET   1  21.953  -2.667   1.668
    3    H3   MET   1           3H       MET   1  20.324  -2.380   1.312
    4    HA   MET   1           HA       MET   1  22.058  -4.311  -0.093
    5    HB2  MET   1           2HB      MET   1  21.635  -5.004   2.237
    6    HB3  MET   1           3HB      MET   1  19.905  -4.778   2.017
    7    HG2  MET   1           2HG      MET   1  20.521  -7.153   1.952
    8    HG3  MET   1           3HG      MET   1  19.855  -6.630   0.404
    9    HE1  MET   1           3HE      MET   1  23.208  -7.592   2.347
   10    HE2  MET   1           1HE      MET   1  23.513  -5.939   1.806
   11    HE3  MET   1           2HE      MET   1  24.404  -7.280   1.090
   12    H    SER   2           H        SER   2  21.333  -4.482  -2.130
   13    HA   SER   2           HA       SER   2  18.630  -4.072  -2.983
   14    HB2  SER   2           2HB      SER   2  20.958  -5.455  -4.393
   15    HB3  SER   2           3HB      SER   2  19.436  -4.978  -5.153
   16    HG   SER   2           HG       SER   2  21.052  -3.108  -3.794
   17    H    GLY   3           H        GLY   3  17.445  -5.355  -1.578
   18    HA2  GLY   3           2HA      GLY   3  16.496  -7.823  -2.112
   19    HA3  GLY   3           3HA      GLY   3  17.955  -8.189  -1.179
   20    H    LYS   4           H        LYS   4  15.247  -5.898  -1.119
   21    HA   LYS   4           HA       LYS   4  15.391  -5.675   1.786
   22    HB2  LYS   4           2HB      LYS   4  13.608  -4.242  -0.237
   23    HB3  LYS   4           3HB      LYS   4  13.667  -3.885   1.484
   24    HG2  LYS   4           2HG      LYS   4  15.923  -3.505  -0.506
   25    HG3  LYS   4           3HG      LYS   4  14.931  -2.234   0.205
   26    HD2  LYS   4           2HD      LYS   4  16.895  -4.030   1.674
   27    HD3  LYS   4           3HD      LYS   4  17.115  -2.321   1.303
   28    HE2  LYS   4           2HE      LYS   4  15.200  -1.766   2.790
   29    HE3  LYS   4           3HE      LYS   4  15.015  -3.482   3.174
   30    HZ1  LYS   4           3HZ      LYS   4  16.277  -2.552   4.906
   31    HZ2  LYS   4           1HZ      LYS   4  17.286  -1.706   3.846
   32    HZ3  LYS   4           2HZ      LYS   4  17.392  -3.387   3.954
   33    H    LYS   5           H        LYS   5  14.220  -7.028   3.053
   34    HA   LYS   5           HA       LYS   5  11.618  -8.039   2.186
   35    HB2  LYS   5           2HB      LYS   5  13.203  -9.389   3.699
   36    HB3  LYS   5           3HB      LYS   5  12.803  -8.258   4.988
   37    HG2  LYS   5           2HG      LYS   5  10.291  -8.900   4.389
   38    HG3  LYS   5           3HG      LYS   5  11.037 -10.306   3.630
   39    HD2  LYS   5           2HD      LYS   5  10.377 -10.930   5.864
   40    HD3  LYS   5           3HD      LYS   5  12.140 -10.834   5.842
   41    HE2  LYS   5           2HE      LYS   5  11.975  -8.542   6.834
   42    HE3  LYS   5           3HE      LYS   5  10.224  -8.741   6.922
   43    HZ1  LYS   5           3HZ      LYS   5  12.250 -10.380   8.347
   44    HZ2  LYS   5           1HZ      LYS   5  10.581 -10.658   8.378
   45    HZ3  LYS   5           2HZ      LYS   5  11.211  -9.232   9.027
   46    H    VAL   6           H        VAL   6  10.286  -6.371   2.007
   47    HA   VAL   6           HA       VAL   6  10.064  -4.288   4.079
   48    HB   VAL   6           HB       VAL   6  10.223  -3.114   2.047
   49   HG11  VAL   6          1HG1      VAL   6  10.282  -5.079   0.554
   50   HG12  VAL   6          2HG1      VAL   6   9.241  -3.819  -0.114
   51   HG13  VAL   6          3HG1      VAL   6   8.529  -5.238   0.665
   52   HG21  VAL   6          3HG2      VAL   6   8.134  -2.433   3.156
   53   HG22  VAL   6          1HG2      VAL   6   7.228  -3.608   2.205
   54   HG23  VAL   6          2HG2      VAL   6   8.021  -2.247   1.406
   55    H    GLU   7           H        GLU   7   8.357  -4.348   5.429
   56    HA   GLU   7           HA       GLU   7   6.254  -6.369   4.946
   57    HB2  GLU   7           2HB      GLU   7   7.209  -5.145   7.571
   58    HB3  GLU   7           3HB      GLU   7   5.833  -6.241   7.420
   59    HG2  GLU   7           2HG      GLU   7   7.403  -7.970   6.446
   60    HG3  GLU   7           3HG      GLU   7   8.736  -6.874   6.793
   61    H    VAL   8           H        VAL   8   4.471  -5.601   4.225
   62    HA   VAL   8           HA       VAL   8   3.840  -2.725   4.317
   63    HB   VAL   8           HB       VAL   8   2.835  -4.927   2.434
   64   HG11  VAL   8          1HG1      VAL   8   2.431  -1.919   2.230
   65   HG12  VAL   8          2HG1      VAL   8   1.190  -3.094   2.667
   66   HG13  VAL   8          3HG1      VAL   8   1.900  -3.124   1.052
   67   HG21  VAL   8          3HG2      VAL   8   4.299  -3.912   0.734
   68   HG22  VAL   8          1HG2      VAL   8   5.238  -4.447   2.130
   69   HG23  VAL   8          2HG2      VAL   8   4.877  -2.732   1.914
   70    H    GLN   9           H        GLN   9   2.435  -2.232   5.880
   71    HA   GLN   9           HA       GLN   9   0.545  -4.246   6.928
   72    HB2  GLN   9           2HB      GLN   9   1.402  -1.538   8.068
   73    HB3  GLN   9           3HB      GLN   9   0.424  -2.749   8.898
   74    HG2  GLN   9           2HG      GLN   9   2.298  -4.283   9.014
   75    HG3  GLN   9           3HG      GLN   9   3.272  -3.238   7.979
   76   HE21  GLN   9          1HE2      GLN   9   4.221  -1.387   8.858
   77   HE22  GLN   9          2HE2      GLN   9   4.340  -1.131  10.566
   78    H    VAL  10           H        VAL  10  -1.190  -4.167   5.563
   79    HA   VAL  10           HA       VAL  10  -2.227  -1.614   4.547
   80    HB   VAL  10           HB       VAL  10  -3.080  -4.470   3.819
   81   HG11  VAL  10          1HG1      VAL  10  -3.701  -1.827   2.436
   82   HG12  VAL  10          2HG1      VAL  10  -4.840  -2.807   3.362
   83   HG13  VAL  10          3HG1      VAL  10  -4.168  -3.430   1.855
   84   HG21  VAL  10          3HG2      VAL  10  -1.184  -2.613   2.324
   85   HG22  VAL  10          1HG2      VAL  10  -1.743  -4.192   1.756
   86   HG23  VAL  10          2HG2      VAL  10  -0.726  -4.078   3.194
   87    H    LYS  11           H        LYS  11  -3.539  -0.657   5.985
   88    HA   LYS  11           HA       LYS  11  -5.466  -2.254   7.586
   89    HB2  LYS  11           2HB      LYS  11  -3.632  -1.078   8.823
   90    HB3  LYS  11           3HB      LYS  11  -4.141   0.448   8.158
   91    HG2  LYS  11           2HG      LYS  11  -6.113  -1.124   9.765
   92    HG3  LYS  11           3HG      LYS  11  -4.765  -0.366  10.614
   93    HD2  LYS  11           2HD      LYS  11  -5.454   1.817   9.414
   94    HD3  LYS  11           3HD      LYS  11  -6.950   0.970   8.991
   95    HE2  LYS  11           2HE      LYS  11  -7.338   2.225  11.000
   96    HE3  LYS  11           3HE      LYS  11  -7.288   0.516  11.420
   97    HZ1  LYS  11           3HZ      LYS  11  -5.011   0.814  12.178
   98    HZ2  LYS  11           1HZ      LYS  11  -6.074   1.829  13.013
   99    HZ3  LYS  11           2HZ      LYS  11  -5.082   2.460  11.798
  100    H    ILE  12           H        ILE  12  -7.362  -2.149   6.443
  101    HA   ILE  12           HA       ILE  12  -8.138   0.407   5.163
  102    HB   ILE  12           HB       ILE  12  -7.526  -1.110   3.395
  103   HG12  ILE  12          2HG1      ILE  12 -10.568  -0.957   3.607
  104   HG13  ILE  12          3HG1      ILE  12  -9.510   0.284   2.945
  105   HG21  ILE  12          1HG2      ILE  12  -7.648  -3.263   4.568
  106   HG22  ILE  12          2HG2      ILE  12  -8.505  -3.335   3.028
  107   HG23  ILE  12          3HG2      ILE  12  -9.412  -3.197   4.536
  108   HD11  ILE  12          3HD1      ILE  12 -10.623  -0.907   1.182
  109   HD12  ILE  12          1HD1      ILE  12 -10.010  -2.450   1.774
  110   HD13  ILE  12          2HD1      ILE  12  -8.894  -1.247   1.120
  111    H    THR  13           H        THR  13  -9.968   1.261   5.876
  112    HA   THR  13           HA       THR  13 -11.783  -0.276   7.595
  113    HB   THR  13           HB       THR  13 -11.759   2.718   6.962
  114    HG1  THR  13           HG1      THR  13 -10.501   1.129   8.941
  115   HG21  THR  13          3HG2      THR  13 -13.202   1.173   9.163
  116   HG22  THR  13          1HG2      THR  13 -13.975   1.951   7.787
  117   HG23  THR  13          2HG2      THR  13 -13.155   2.932   9.008
  118    H    CYS  14           H        CYS  14 -13.569  -1.144   6.806
  119    HA   CYS  14           HA       CYS  14 -15.220  -0.006   4.732
  120    HB2  CYS  14           2HB      CYS  14 -13.824  -1.046   3.149
  121    HB3  CYS  14           3HB      CYS  14 -13.463  -2.407   4.200
  122    H    ASN  15           H        ASN  15 -17.316  -0.747   4.864
  123    HA   ASN  15           HA       ASN  15 -19.197  -1.814   5.552
  124    HB2  ASN  15           2HB      ASN  15 -18.000  -3.743   4.447
  125    HB3  ASN  15           3HB      ASN  15 -17.332  -4.193   6.010
  126   HD21  ASN  15          1HD2      ASN  15 -18.294  -6.248   5.844
  127   HD22  ASN  15          2HD2      ASN  15 -19.991  -6.481   6.062
  128    H    GLY  16           H        GLY  16 -17.474  -0.380   7.508
  129    HA2  GLY  16           2HA      GLY  16 -17.934   0.321   9.671
  130    HA3  GLY  16           3HA      GLY  16 -18.921  -1.109   9.930
  131    H    LYS  17           H        LYS  17 -16.190  -2.376   8.694
  132    HA   LYS  17           HA       LYS  17 -14.948  -2.800  11.351
  133    HB2  LYS  17           2HB      LYS  17 -15.001  -4.620   8.897
  134    HB3  LYS  17           3HB      LYS  17 -14.024  -4.924  10.331
  135    HG2  LYS  17           2HG      LYS  17 -16.160  -5.014  11.681
  136    HG3  LYS  17           3HG      LYS  17 -17.049  -4.898  10.159
  137    HD2  LYS  17           2HD      LYS  17 -16.885  -7.251  10.873
  138    HD3  LYS  17           3HD      LYS  17 -15.993  -7.003   9.370
  139    HE2  LYS  17           2HE      LYS  17 -13.873  -6.894  10.667
  140    HE3  LYS  17           3HE      LYS  17 -14.778  -7.173  12.155
  141    HZ1  LYS  17           3HZ      LYS  17 -14.591  -9.063   9.868
  142    HZ2  LYS  17           1HZ      LYS  17 -15.446  -9.330  11.301
  143    HZ3  LYS  17           2HZ      LYS  17 -13.763  -9.201  11.334
  144    H    THR  18           H        THR  18 -12.623  -3.316  11.269
  145    HA   THR  18           HA       THR  18 -11.124  -1.897   9.145
  146    HB   THR  18           HB       THR  18 -10.326  -2.485  12.045
  147    HG1  THR  18           HG1      THR  18 -11.878  -0.810  11.841
  148   HG21  THR  18          3HG2      THR  18  -8.372  -1.055  11.613
  149   HG22  THR  18          1HG2      THR  18  -8.852  -0.881   9.922
  150   HG23  THR  18          2HG2      THR  18  -8.358  -2.457  10.545
  151    H    TYR  19           H        TYR  19 -10.002  -3.228   7.836
  152    HA   TYR  19           HA       TYR  19  -9.320  -5.984   8.682
  153    HB2  TYR  19           2HB      TYR  19  -9.460  -4.948   5.807
  154    HB3  TYR  19           3HB      TYR  19  -9.383  -6.623   6.343
  155    HD1  TYR  19           HD2      TYR  19 -11.557  -3.667   5.972
  156    HD2  TYR  19           HD1      TYR  19 -11.437  -7.791   7.089
  157    HE1  TYR  19           HE2      TYR  19 -13.994  -3.753   5.915
  158    HE2  TYR  19           HE1      TYR  19 -13.899  -7.871   7.033
  159    HH   TYR  19           HH       TYR  19 -15.784  -5.321   5.692
  160    H    GLU  20           H        GLU  20  -7.291  -5.695   9.563
  161    HA   GLU  20           HA       GLU  20  -5.257  -4.284   7.941
  162    HB2  GLU  20           2HB      GLU  20  -3.926  -4.045   9.965
  163    HB3  GLU  20           3HB      GLU  20  -5.537  -3.402  10.228
  164    HG2  GLU  20           2HG      GLU  20  -5.086  -4.479  12.235
  165    HG3  GLU  20           3HG      GLU  20  -6.046  -5.673  11.369
  166    H    ARG  21           H        ARG  21  -3.362  -5.335   7.364
  167    HA   ARG  21           HA       ARG  21  -2.747  -7.966   8.381
  168    HB2  ARG  21           2HB      ARG  21  -4.418  -8.412   6.505
  169    HB3  ARG  21           3HB      ARG  21  -3.257  -7.719   5.379
  170    HG2  ARG  21           2HG      ARG  21  -3.101 -10.151   5.319
  171    HG3  ARG  21           3HG      ARG  21  -1.615  -9.491   6.009
  172    HD2  ARG  21           2HD      ARG  21  -2.585  -9.922   8.284
  173    HD3  ARG  21           3HD      ARG  21  -3.925 -10.760   7.507
  174    HE   ARG  21           HE       ARG  21  -2.099 -12.270   6.559
  175   HH11  ARG  21          1HH1      ARG  21  -1.852 -10.723   9.714
  176   HH12  ARG  21          2HH1      ARG  21  -0.833 -11.957  10.376
  177   HH21  ARG  21          1HH2      ARG  21  -0.771 -13.900   7.464
  178   HH22  ARG  21          2HH2      ARG  21  -0.218 -13.756   9.100
  179    H    THR  22           H        THR  22  -0.626  -8.003   8.655
  180    HA   THR  22           HA       THR  22   1.179  -6.258   7.159
  181    HB   THR  22           HB       THR  22   1.782  -8.235   9.417
  182    HG1  THR  22           HG1      THR  22   0.351  -6.343   9.864
  183   HG21  THR  22          3HG2      THR  22   3.882  -6.941   9.695
  184   HG22  THR  22          1HG2      THR  22   3.466  -5.960   8.281
  185   HG23  THR  22          2HG2      THR  22   3.803  -7.681   8.098
  186    H    TYR  23           H        TYR  23   1.718  -7.005   5.202
  187    HA   TYR  23           HA       TYR  23   2.112  -9.874   4.654
  188    HB2  TYR  23           2HB      TYR  23   2.095  -7.488   2.733
  189    HB3  TYR  23           3HB      TYR  23   2.148  -9.186   2.274
  190    HD1  TYR  23           HD1      TYR  23  -0.015  -6.458   3.504
  191    HD2  TYR  23           HD2      TYR  23   0.099 -10.580   2.372
  192    HE1  TYR  23           HE1      TYR  23  -2.466  -6.500   3.390
  193    HE2  TYR  23           HE2      TYR  23  -2.358 -10.608   2.260
  194    HH   TYR  23           HH       TYR  23  -4.264  -9.379   3.118
  195    H    GLN  24           H        GLN  24   4.110 -10.676   4.231
  196    HA   GLN  24           HA       GLN  24   6.454  -8.872   4.440
  197    HB2  GLN  24           2HB      GLN  24   6.329 -11.925   4.643
  198    HB3  GLN  24           3HB      GLN  24   7.796 -10.953   4.774
  199    HG2  GLN  24           2HG      GLN  24   6.832  -9.826   6.784
  200    HG3  GLN  24           3HG      GLN  24   5.428 -10.886   6.663
  201   HE21  GLN  24          1HE2      GLN  24   5.786 -11.776   8.703
  202   HE22  GLN  24          2HE2      GLN  24   7.086 -12.867   9.032
  203    H    LEU  25           H        LEU  25   7.046  -8.134   2.534
  204    HA   LEU  25           HA       LEU  25   6.919  -9.849   0.110
  205    HB2  LEU  25           2HB      LEU  25   6.625  -6.814   0.350
  206    HB3  LEU  25           3HB      LEU  25   6.723  -7.686  -1.172
  207    HG   LEU  25           HG       LEU  25   4.479  -7.951   0.871
  208   HD11  LEU  25          1HD1      LEU  25   3.066  -6.843  -0.807
  209   HD12  LEU  25          2HD1      LEU  25   4.467  -6.628  -1.862
  210   HD13  LEU  25          3HD1      LEU  25   4.399  -5.805  -0.300
  211   HD21  LEU  25          3HD2      LEU  25   4.756  -9.277  -1.850
  212   HD22  LEU  25          1HD2      LEU  25   3.318  -9.322  -0.824
  213   HD23  LEU  25          2HD2      LEU  25   4.811 -10.081  -0.279
  214    H    TYR  26           H        TYR  26   8.788  -9.987  -1.100
  215    HA   TYR  26           HA       TYR  26  11.198  -8.540  -0.149
  216    HB2  TYR  26           2HB      TYR  26  10.999 -10.889   0.831
  217    HB3  TYR  26           3HB      TYR  26  11.102 -11.529  -0.799
  218    HD1  TYR  26           HD2      TYR  26  13.299 -11.021  -2.141
  219    HD2  TYR  26           HD1      TYR  26  12.991 -10.450   2.080
  220    HE1  TYR  26           HE2      TYR  26  15.744 -11.067  -1.956
  221    HE2  TYR  26           HE1      TYR  26  15.438 -10.493   2.261
  222    HH   TYR  26           HH       TYR  26  17.504 -10.322  -0.456
  223    H    ALA  27           H        ALA  27  12.370  -7.702  -1.785
  224    HA   ALA  27           HA       ALA  27  12.635  -9.036  -4.348
  225    HB1  ALA  27           3HB      ALA  27  10.592  -7.703  -4.749
  226    HB2  ALA  27           1HB      ALA  27  11.937  -7.082  -5.708
  227    HB3  ALA  27           2HB      ALA  27  11.428  -6.237  -4.241
  228    H    VAL  28           H        VAL  28  14.428  -8.380  -5.460
  229    HA   VAL  28           HA       VAL  28  16.631  -7.262  -4.097
  230    HB   VAL  28           HB       VAL  28  16.240  -7.615  -7.110
  231   HG11  VAL  28          1HG1      VAL  28  18.686  -7.744  -7.281
  232   HG12  VAL  28          2HG1      VAL  28  18.841  -7.440  -5.549
  233   HG13  VAL  28          3HG1      VAL  28  18.184  -6.190  -6.608
  234   HG21  VAL  28          3HG2      VAL  28  17.319  -9.817  -6.860
  235   HG22  VAL  28          1HG2      VAL  28  15.831  -9.723  -5.915
  236   HG23  VAL  28          2HG2      VAL  28  17.396  -9.590  -5.111
  237    H    ARG  29           H        ARG  29  14.269  -5.912  -6.391
  238    HA   ARG  29           HA       ARG  29  15.089  -3.178  -5.604
  239    HB2  ARG  29           2HB      ARG  29  14.387  -4.096  -8.429
  240    HB3  ARG  29           3HB      ARG  29  14.432  -2.401  -7.947
  241    HG2  ARG  29           2HG      ARG  29  16.867  -2.831  -7.233
  242    HG3  ARG  29           3HG      ARG  29  16.737  -4.357  -8.102
  243    HD2  ARG  29           2HD      ARG  29  16.272  -3.142 -10.196
  244    HD3  ARG  29           3HD      ARG  29  16.334  -1.601  -9.328
  245    HE   ARG  29           HE       ARG  29  18.670  -3.394  -9.356
  246   HH11  ARG  29          1HH1      ARG  29  17.318  -0.257 -10.245
  247   HH12  ARG  29          2HH1      ARG  29  18.868   0.406 -10.660
  248   HH21  ARG  29          1HH2      ARG  29  20.666  -2.470  -9.828
  249   HH22  ARG  29          2HH2      ARG  29  20.752  -0.845 -10.425
  250    H    ASP  30           H        ASP  30  13.463  -1.683  -5.350
  251    HA   ASP  30           HA       ASP  30  10.898  -2.652  -4.550
  252    HB2  ASP  30           2HB      ASP  30  10.405  -0.290  -3.993
  253    HB3  ASP  30           3HB      ASP  30  11.976  -0.788  -3.379
  254    H    GLU  31           H        GLU  31  12.131  -1.255  -7.497
  255    HA   GLU  31           HA       GLU  31   9.764  -0.653  -8.872
  256    HB2  GLU  31           2HB      GLU  31  12.332  -1.872  -9.972
  257    HB3  GLU  31           3HB      GLU  31  11.063  -1.152 -10.957
  258    HG2  GLU  31           2HG      GLU  31  12.737   0.302  -8.898
  259    HG3  GLU  31           3HG      GLU  31  12.987   0.356 -10.639
  260    H    GLU  32           H        GLU  32  11.356  -3.756  -8.282
  261    HA   GLU  32           HA       GLU  32   9.504  -5.314  -9.891
  262    HB2  GLU  32           2HB      GLU  32  11.589  -6.270  -7.887
  263    HB3  GLU  32           3HB      GLU  32  10.805  -7.246  -9.123
  264    HG2  GLU  32           2HG      GLU  32  12.744  -4.963  -9.595
  265    HG3  GLU  32           3HG      GLU  32  13.090  -6.680  -9.770
  266    H    LEU  33           H        LEU  33   9.726  -4.226  -6.621
  267    HA   LEU  33           HA       LEU  33   8.030  -6.122  -5.321
  268    HB2  LEU  33           2HB      LEU  33   9.779  -4.330  -4.402
  269    HB3  LEU  33           3HB      LEU  33   8.401  -3.259  -4.372
  270    HG   LEU  33           HG       LEU  33   8.973  -4.266  -2.158
  271   HD11  LEU  33          1HD1      LEU  33   6.216  -5.086  -3.076
  272   HD12  LEU  33          2HD1      LEU  33   6.690  -3.483  -2.514
  273   HD13  LEU  33          3HD1      LEU  33   6.751  -4.851  -1.408
  274   HD21  LEU  33          3HD2      LEU  33   8.131  -6.914  -3.371
  275   HD22  LEU  33          1HD2      LEU  33   8.494  -6.618  -1.667
  276   HD23  LEU  33          2HD2      LEU  33   9.761  -6.455  -2.876
  277    H    LYS  34           H        LYS  34   7.442  -3.381  -7.376
  278    HA   LYS  34           HA       LYS  34   4.990  -2.370  -6.602
  279    HB2  LYS  34           2HB      LYS  34   6.053  -2.761  -9.421
  280    HB3  LYS  34           3HB      LYS  34   4.613  -1.821  -9.043
  281    HG2  LYS  34           2HG      LYS  34   6.013  -0.282  -7.676
  282    HG3  LYS  34           3HG      LYS  34   7.445  -1.205  -8.152
  283    HD2  LYS  34           2HD      LYS  34   7.186   0.798  -9.569
  284    HD3  LYS  34           3HD      LYS  34   7.010  -0.673 -10.528
  285    HE2  LYS  34           2HE      LYS  34   4.501  -0.414 -10.312
  286    HE3  LYS  34           3HE      LYS  34   4.785   1.146  -9.540
  287    HZ1  LYS  34           3HZ      LYS  34   5.886   1.892 -11.566
  288    HZ2  LYS  34           1HZ      LYS  34   4.298   1.392 -11.875
  289    HZ3  LYS  34           2HZ      LYS  34   5.593   0.397 -12.299
  290    H    GLU  35           H        GLU  35   5.489  -5.038  -8.958
  291    HA   GLU  35           HA       GLU  35   2.774  -5.478  -9.494
  292    HB2  GLU  35           2HB      GLU  35   3.512  -7.636 -10.517
  293    HB3  GLU  35           3HB      GLU  35   4.419  -6.237 -11.057
  294    HG2  GLU  35           2HG      GLU  35   6.099  -7.795 -10.828
  295    HG3  GLU  35           3HG      GLU  35   6.177  -6.988  -9.265
  296    H    LYS  36           H        LYS  36   4.807  -6.703  -6.920
  297    HA   LYS  36           HA       LYS  36   3.035  -8.683  -5.911
  298    HB2  LYS  36           2HB      LYS  36   5.114  -7.071  -4.356
  299    HB3  LYS  36           3HB      LYS  36   4.379  -8.594  -3.851
  300    HG2  LYS  36           2HG      LYS  36   5.399  -9.679  -5.881
  301    HG3  LYS  36           3HG      LYS  36   6.243  -8.164  -6.202
  302    HD2  LYS  36           2HD      LYS  36   7.383  -8.371  -3.985
  303    HD3  LYS  36           3HD      LYS  36   6.577  -9.926  -3.740
  304    HE2  LYS  36           2HE      LYS  36   8.610  -9.221  -5.882
  305    HE3  LYS  36           3HE      LYS  36   8.801 -10.370  -4.560
  306    HZ1  LYS  36           3HZ      LYS  36   6.996 -11.698  -5.589
  307    HZ2  LYS  36           1HZ      LYS  36   8.373 -11.564  -6.562
  308    HZ3  LYS  36           2HZ      LYS  36   7.004 -10.640  -6.910
  309    H    LEU  37           H        LEU  37   3.544  -5.245  -5.125
  310    HA   LEU  37           HA       LEU  37   1.643  -4.918  -3.089
  311    HB2  LEU  37           2HB      LEU  37   2.647  -2.956  -5.184
  312    HB3  LEU  37           3HB      LEU  37   1.615  -2.476  -3.845
  313    HG   LEU  37           HG       LEU  37   4.379  -3.704  -3.515
  314   HD11  LEU  37          1HD1      LEU  37   3.527  -0.803  -3.308
  315   HD12  LEU  37          2HD1      LEU  37   4.518  -1.510  -4.586
  316   HD13  LEU  37          3HD1      LEU  37   5.129  -1.448  -2.936
  317   HD21  LEU  37          3HD2      LEU  37   2.520  -2.412  -1.485
  318   HD22  LEU  37          1HD2      LEU  37   4.170  -2.961  -1.172
  319   HD23  LEU  37          2HD2      LEU  37   2.921  -4.128  -1.591
  320    H    LYS  38           H        LYS  38   1.292  -4.605  -6.638
  321    HA   LYS  38           HA       LYS  38  -1.347  -3.651  -6.704
  322    HB2  LYS  38           2HB      LYS  38   0.184  -5.298  -8.763
  323    HB3  LYS  38           3HB      LYS  38  -1.337  -4.469  -9.077
  324    HG2  LYS  38           2HG      LYS  38  -0.231  -2.291  -8.589
  325    HG3  LYS  38           3HG      LYS  38   1.293  -3.148  -8.339
  326    HD2  LYS  38           2HD      LYS  38   1.236  -2.193 -10.596
  327    HD3  LYS  38           3HD      LYS  38   1.213  -3.955 -10.693
  328    HE2  LYS  38           2HE      LYS  38  -1.294  -3.831 -10.967
  329    HE3  LYS  38           3HE      LYS  38  -1.147  -2.075 -11.043
  330    HZ1  LYS  38           3HZ      LYS  38  -1.252  -3.033 -13.240
  331    HZ2  LYS  38           1HZ      LYS  38   0.092  -4.010 -12.924
  332    HZ3  LYS  38           2HZ      LYS  38   0.266  -2.333 -12.993
  333    H    LYS  39           H        LYS  39  -0.060  -6.985  -6.935
  334    HA   LYS  39           HA       LYS  39  -2.543  -8.323  -7.203
  335    HB2  LYS  39           2HB      LYS  39   0.114  -9.308  -6.078
  336    HB3  LYS  39           3HB      LYS  39  -1.258 -10.360  -6.397
  337    HG2  LYS  39           2HG      LYS  39   0.273  -8.756  -8.466
  338    HG3  LYS  39           3HG      LYS  39   0.406 -10.495  -8.187
  339    HD2  LYS  39           2HD      LYS  39  -1.981 -10.768  -8.857
  340    HD3  LYS  39           3HD      LYS  39  -2.084  -9.031  -9.161
  341    HE2  LYS  39           2HE      LYS  39  -0.346  -9.247 -10.911
  342    HE3  LYS  39           3HE      LYS  39  -0.273 -10.987 -10.620
  343    HZ1  LYS  39           3HZ      LYS  39  -2.659  -9.490 -11.560
  344    HZ2  LYS  39           1HZ      LYS  39  -2.585 -11.156 -11.294
  345    HZ3  LYS  39           2HZ      LYS  39  -1.662 -10.453 -12.521
  346    H    VAL  40           H        VAL  40  -0.516  -7.772  -4.324
  347    HA   VAL  40           HA       VAL  40  -2.085  -8.990  -2.373
  348    HB   VAL  40           HB       VAL  40   0.043  -6.815  -2.273
  349   HG11  VAL  40          1HG1      VAL  40   0.157  -7.022   0.185
  350   HG12  VAL  40          2HG1      VAL  40  -1.305  -8.011   0.165
  351   HG13  VAL  40          3HG1      VAL  40  -1.374  -6.325  -0.350
  352   HG21  VAL  40          3HG2      VAL  40   0.791  -9.098  -2.823
  353   HG22  VAL  40          1HG2      VAL  40   0.057  -9.715  -1.340
  354   HG23  VAL  40          2HG2      VAL  40   1.423  -8.601  -1.253
  355    H    LEU  41           H        LEU  41  -2.161  -5.628  -3.521
  356    HA   LEU  41           HA       LEU  41  -4.070  -4.686  -1.609
  357    HB2  LEU  41           2HB      LEU  41  -2.948  -3.562  -4.192
  358    HB3  LEU  41           3HB      LEU  41  -4.262  -2.736  -3.368
  359    HG   LEU  41           HG       LEU  41  -1.608  -3.362  -1.998
  360   HD11  LEU  41          1HD1      LEU  41  -0.948  -1.032  -2.396
  361   HD12  LEU  41          2HD1      LEU  41  -2.394  -0.773  -3.376
  362   HD13  LEU  41          3HD1      LEU  41  -1.152  -1.906  -3.913
  363   HD21  LEU  41          3HD2      LEU  41  -2.325  -1.646  -0.388
  364   HD22  LEU  41          1HD2      LEU  41  -3.494  -2.965  -0.474
  365   HD23  LEU  41          2HD2      LEU  41  -3.838  -1.425  -1.275
  366    H    ASN  42           H        ASN  42  -4.314  -5.954  -4.928
  367    HA   ASN  42           HA       ASN  42  -7.122  -5.528  -5.199
  368    HB2  ASN  42           2HB      ASN  42  -5.067  -7.095  -6.744
  369    HB3  ASN  42           3HB      ASN  42  -6.738  -7.596  -6.950
  370   HD21  ASN  42          1HD2      ASN  42  -4.433  -5.055  -7.570
  371   HD22  ASN  42          2HD2      ASN  42  -5.437  -4.146  -8.636
  372    H    GLU  43           H        GLU  43  -5.215  -8.181  -3.837
  373    HA   GLU  43           HA       GLU  43  -7.394 -10.040  -3.572
  374    HB2  GLU  43           2HB      GLU  43  -4.628  -9.964  -2.280
  375    HB3  GLU  43           3HB      GLU  43  -5.776 -11.281  -2.041
  376    HG2  GLU  43           2HG      GLU  43  -5.724 -11.808  -4.433
  377    HG3  GLU  43           3HG      GLU  43  -4.653 -10.441  -4.730
  378    H    ARG  44           H        ARG  44  -5.718  -7.849  -1.321
  379    HA   ARG  44           HA       ARG  44  -7.208  -8.316   1.009
  380    HB2  ARG  44           2HB      ARG  44  -5.090  -7.054   1.048
  381    HB3  ARG  44           3HB      ARG  44  -5.786  -5.793   0.043
  382    HG2  ARG  44           2HG      ARG  44  -5.678  -4.928   2.266
  383    HG3  ARG  44           3HG      ARG  44  -7.375  -5.249   1.933
  384    HD2  ARG  44           2HD      ARG  44  -5.567  -7.107   3.521
  385    HD3  ARG  44           3HD      ARG  44  -6.609  -5.877   4.241
  386    HE   ARG  44           HE       ARG  44  -8.377  -7.293   2.805
  387   HH11  ARG  44          1HH1      ARG  44  -5.913  -8.367   5.074
  388   HH12  ARG  44          2HH1      ARG  44  -6.803  -9.770   5.565
  389   HH21  ARG  44          1HH2      ARG  44  -9.523  -9.154   3.466
  390   HH22  ARG  44          2HH2      ARG  44  -8.840 -10.213   4.656
  391    H    MET  45           H        MET  45  -7.719  -6.110  -1.703
  392    HA   MET  45           HA       MET  45 -10.203  -5.077  -0.558
  393    HB2  MET  45           2HB      MET  45  -8.719  -4.263  -3.080
  394    HB3  MET  45           3HB      MET  45 -10.196  -3.509  -2.491
  395    HG2  MET  45           2HG      MET  45  -8.924  -2.970  -0.349
  396    HG3  MET  45           3HG      MET  45  -7.464  -3.471  -1.206
  397    HE1  MET  45           3HE      MET  45 -10.115   0.066  -2.547
  398    HE2  MET  45           1HE      MET  45 -10.469  -0.919  -1.128
  399    HE3  MET  45           2HE      MET  45 -10.609  -1.614  -2.744
  400    H    ASP  46           H        ASP  46  -9.543  -7.804  -2.256
  401    HA   ASP  46           HA       ASP  46 -11.504  -7.741  -4.296
  402    HB2  ASP  46           2HB      ASP  46  -9.652  -9.432  -4.196
  403    HB3  ASP  46           3HB      ASP  46 -10.481 -10.248  -2.877
  404    HA   PRO  47           HA       PRO  47 -14.644  -9.647  -1.028
  405    HB2  PRO  47           2HB      PRO  47 -14.090  -9.119   1.639
  406    HB3  PRO  47           3HB      PRO  47 -13.664 -10.643   0.834
  407    HG2  PRO  47           2HG      PRO  47 -11.921  -8.241   1.336
  408    HG3  PRO  47           3HG      PRO  47 -11.559  -9.963   1.601
  409    HD2  PRO  47           2HD      PRO  47 -10.654  -8.693  -0.576
  410    HD3  PRO  47           3HD      PRO  47 -11.233 -10.379  -0.689
  411    H    ILE  48           H        ILE  48 -12.806  -6.700  -0.674
  412    HA   ILE  48           HA       ILE  48 -14.784  -5.144   0.737
  413    HB   ILE  48           HB       ILE  48 -12.257  -4.266  -0.739
  414   HG12  ILE  48          2HG1      ILE  48 -11.645  -5.863   0.996
  415   HG13  ILE  48          3HG1      ILE  48 -11.162  -4.259   1.522
  416   HG21  ILE  48          1HG2      ILE  48 -12.313  -2.234   0.642
  417   HG22  ILE  48          2HG2      ILE  48 -13.850  -2.743   1.341
  418   HG23  ILE  48          3HG2      ILE  48 -13.748  -2.366  -0.377
  419   HD11  ILE  48          3HD1      ILE  48 -12.042  -5.532   3.358
  420   HD12  ILE  48          1HD1      ILE  48 -13.550  -5.823   2.493
  421   HD13  ILE  48          2HD1      ILE  48 -13.126  -4.189   3.008
  422    H    LYS  49           H        LYS  49 -13.804  -5.614  -2.632
  423    HA   LYS  49           HA       LYS  49 -15.434  -3.527  -3.755
  424    HB2  LYS  49           2HB      LYS  49 -14.116  -5.926  -5.090
  425    HB3  LYS  49           3HB      LYS  49 -14.897  -4.599  -5.950
  426    HG2  LYS  49           2HG      LYS  49 -13.246  -3.019  -5.149
  427    HG3  LYS  49           3HG      LYS  49 -12.516  -4.241  -4.110
  428    HD2  LYS  49           2HD      LYS  49 -11.930  -5.549  -6.207
  429    HD3  LYS  49           3HD      LYS  49 -12.496  -4.167  -7.152
  430    HE2  LYS  49           2HE      LYS  49 -10.804  -2.733  -6.004
  431    HE3  LYS  49           3HE      LYS  49 -10.211  -4.156  -5.145
  432    HZ1  LYS  49           3HZ      LYS  49  -9.679  -5.140  -7.335
  433    HZ2  LYS  49           1HZ      LYS  49  -8.823  -3.713  -7.029
  434    HZ3  LYS  49           2HZ      LYS  49 -10.144  -3.695  -8.080
  435    H    LYS  50           H        LYS  50 -15.790  -6.912  -3.008
  436    HA   LYS  50           HA       LYS  50 -18.349  -7.291  -4.251
  437    HB2  LYS  50           2HB      LYS  50 -16.549  -9.041  -3.729
  438    HB3  LYS  50           3HB      LYS  50 -17.049  -8.952  -2.053
  439    HG2  LYS  50           2HG      LYS  50 -18.983  -9.700  -4.268
  440    HG3  LYS  50           3HG      LYS  50 -17.940 -10.892  -3.506
  441    HD2  LYS  50           2HD      LYS  50 -20.116  -9.254  -2.158
  442    HD3  LYS  50           3HD      LYS  50 -20.149 -10.983  -2.501
  443    HE2  LYS  50           2HE      LYS  50 -18.323  -9.563  -0.534
  444    HE3  LYS  50           3HE      LYS  50 -19.659 -10.647  -0.145
  445    HZ1  LYS  50           3HZ      LYS  50 -17.527 -11.731   0.021
  446    HZ2  LYS  50           1HZ      LYS  50 -17.198 -11.424  -1.601
  447    HZ3  LYS  50           2HZ      LYS  50 -18.469 -12.452  -1.172
  448    H    LEU  51           H        LEU  51 -17.178  -6.171  -1.143
  449    HA   LEU  51           HA       LEU  51 -19.719  -6.201   0.238
  450    HB2  LEU  51           2HB      LEU  51 -17.120  -4.714   0.818
  451    HB3  LEU  51           3HB      LEU  51 -18.540  -4.579   1.842
  452    HG   LEU  51           HG       LEU  51 -17.029  -7.172   1.324
  453   HD11  LEU  51          1HD1      LEU  51 -15.647  -5.621   2.615
  454   HD12  LEU  51          2HD1      LEU  51 -16.157  -6.990   3.596
  455   HD13  LEU  51          3HD1      LEU  51 -16.943  -5.422   3.798
  456   HD21  LEU  51          3HD2      LEU  51 -19.380  -7.585   1.816
  457   HD22  LEU  51          1HD2      LEU  51 -19.276  -6.597   3.277
  458   HD23  LEU  51          2HD2      LEU  51 -18.367  -8.107   3.157
  459    H    GLY  52           H        GLY  52 -17.961  -4.012  -1.863
  460    HA2  GLY  52           2HA      GLY  52 -18.689  -2.225  -3.114
  461    HA3  GLY  52           3HA      GLY  52 -20.310  -2.464  -2.477
  462    H    CYS  53           H        CYS  53 -17.330  -1.918  -0.645
  463    HA   CYS  53           HA       CYS  53 -18.420   0.282   0.824
  464    HB2  CYS  53           2HB      CYS  53 -15.649  -0.940   0.685
  465    HB3  CYS  53           3HB      CYS  53 -16.007   0.467   1.689
  466    H    LYS  54           H        LYS  54 -18.934   2.013  -0.320
  467    HA   LYS  54           HA       LYS  54 -18.127   2.775  -2.845
  468    HB2  LYS  54           2HB      LYS  54 -19.220   4.641  -0.700
  469    HB3  LYS  54           3HB      LYS  54 -19.335   4.880  -2.442
  470    HG2  LYS  54           2HG      LYS  54 -20.845   2.944  -2.626
  471    HG3  LYS  54           3HG      LYS  54 -20.674   2.634  -0.894
  472    HD2  LYS  54           2HD      LYS  54 -21.638   4.949  -0.471
  473    HD3  LYS  54           3HD      LYS  54 -21.978   5.061  -2.201
  474    HE2  LYS  54           2HE      LYS  54 -23.099   2.975  -0.300
  475    HE3  LYS  54           3HE      LYS  54 -23.966   4.379  -0.915
  476    HZ1  LYS  54           3HZ      LYS  54 -22.930   2.133  -2.551
  477    HZ2  LYS  54           1HZ      LYS  54 -23.753   3.483  -3.146
  478    HZ3  LYS  54           2HZ      LYS  54 -24.544   2.391  -2.128
  479    H    ARG  55           H        ARG  55 -16.896   3.899   0.246
  480    HA   ARG  55           HA       ARG  55 -14.549   5.130  -1.063
  481    HB2  ARG  55           2HB      ARG  55 -16.196   6.926  -0.366
  482    HB3  ARG  55           3HB      ARG  55 -16.085   6.345   1.292
  483    HG2  ARG  55           2HG      ARG  55 -13.549   6.837   1.110
  484    HG3  ARG  55           3HG      ARG  55 -13.953   7.734  -0.357
  485    HD2  ARG  55           2HD      ARG  55 -13.846   9.293   1.493
  486    HD3  ARG  55           3HD      ARG  55 -15.540   9.133   1.018
  487    HE   ARG  55           HE       ARG  55 -15.748   7.525   2.925
  488   HH11  ARG  55          1HH1      ARG  55 -13.258  10.020   3.065
  489   HH12  ARG  55          2HH1      ARG  55 -13.210  10.028   4.800
  490   HH21  ARG  55          1HH2      ARG  55 -15.640   7.525   5.160
  491   HH22  ARG  55          2HH2      ARG  55 -14.566   8.605   5.991
  492    H    VAL  56           H        VAL  56 -12.678   4.427  -0.113
  493    HA   VAL  56           HA       VAL  56 -12.829   3.053   2.522
  494    HB   VAL  56           HB       VAL  56 -11.071   1.459   1.707
  495   HG11  VAL  56          1HG1      VAL  56 -13.640   1.389   0.076
  496   HG12  VAL  56          2HG1      VAL  56 -13.431   0.768   1.714
  497   HG13  VAL  56          3HG1      VAL  56 -12.562   0.021   0.375
  498   HG21  VAL  56          3HG2      VAL  56 -10.610   1.230  -0.707
  499   HG22  VAL  56          1HG2      VAL  56 -10.118   2.819  -0.121
  500   HG23  VAL  56          2HG2      VAL  56 -11.610   2.644  -1.048
  501    H    ARG  57           H        ARG  57 -11.160   3.409   3.941
  502    HA   ARG  57           HA       ARG  57  -8.996   5.281   3.176
  503    HB2  ARG  57           2HB      ARG  57 -10.225   6.042   5.145
  504    HB3  ARG  57           3HB      ARG  57 -10.092   4.461   5.910
  505    HG2  ARG  57           2HG      ARG  57  -7.644   4.751   6.093
  506    HG3  ARG  57           3HG      ARG  57  -7.768   6.331   5.325
  507    HD2  ARG  57           2HD      ARG  57  -9.043   7.192   7.232
  508    HD3  ARG  57           3HD      ARG  57  -9.048   5.584   7.976
  509    HE   ARG  57           HE       ARG  57  -6.541   5.790   7.985
  510   HH11  ARG  57          1HH1      ARG  57  -8.550   8.678   8.244
  511   HH12  ARG  57          2HH1      ARG  57  -7.328   9.580   9.081
  512   HH21  ARG  57          1HH2      ARG  57  -4.952   7.014   9.017
  513   HH22  ARG  57          2HH2      ARG  57  -5.294   8.638   9.516
  514    H    ILE  58           H        ILE  58  -7.311   4.109   2.402
  515    HA   ILE  58           HA       ILE  58  -6.496   1.585   3.717
  516    HB   ILE  58           HB       ILE  58  -5.394   2.801   1.128
  517   HG12  ILE  58          2HG1      ILE  58  -7.512   0.605   1.345
  518   HG13  ILE  58          3HG1      ILE  58  -7.864   2.281   0.946
  519   HG21  ILE  58          1HG2      ILE  58  -4.516   0.525   0.697
  520   HG22  ILE  58          2HG2      ILE  58  -5.176  -0.030   2.236
  521   HG23  ILE  58          3HG2      ILE  58  -3.887   1.173   2.214
  522   HD11  ILE  58          3HD1      ILE  58  -6.497   2.079  -1.081
  523   HD12  ILE  58          1HD1      ILE  58  -7.828   0.924  -1.037
  524   HD13  ILE  58          2HD1      ILE  58  -6.187   0.384  -0.688
  525    H    SER  59           H        SER  59  -5.231   2.141   5.478
  526    HA   SER  59           HA       SER  59  -3.169   4.225   5.226
  527    HB2  SER  59           2HB      SER  59  -4.369   2.889   7.701
  528    HB3  SER  59           3HB      SER  59  -3.084   4.101   7.729
  529    HG   SER  59           HG       SER  59  -4.583   5.528   6.651
  530    H    ILE  60           H        ILE  60  -1.446   3.258   4.311
  531    HA   ILE  60           HA       ILE  60  -0.582   0.577   5.167
  532    HB   ILE  60           HB       ILE  60   0.283   2.292   2.796
  533   HG12  ILE  60          2HG1      ILE  60  -1.302  -0.317   2.954
  534   HG13  ILE  60          3HG1      ILE  60  -1.947   1.264   2.530
  535   HG21  ILE  60          1HG2      ILE  60   1.296  -0.479   3.550
  536   HG22  ILE  60          2HG2      ILE  60   2.232   1.014   3.605
  537   HG23  ILE  60          3HG2      ILE  60   1.679   0.382   2.056
  538   HD11  ILE  60          3HD1      ILE  60  -1.715  -0.038   0.558
  539   HD12  ILE  60          1HD1      ILE  60  -0.027  -0.405   0.918
  540   HD13  ILE  60          2HD1      ILE  60  -0.508   1.245   0.508
  541    H    ARG  61           H        ARG  61   1.097   0.321   6.485
  542    HA   ARG  61           HA       ARG  61   3.022   2.538   6.905
  543    HB2  ARG  61           2HB      ARG  61   1.580   1.873   8.899
  544    HB3  ARG  61           3HB      ARG  61   2.346   0.287   8.851
  545    HG2  ARG  61           2HG      ARG  61   4.557   1.375   9.218
  546    HG3  ARG  61           3HG      ARG  61   3.746   2.940   9.321
  547    HD2  ARG  61           2HD      ARG  61   3.441   0.594  11.214
  548    HD3  ARG  61           3HD      ARG  61   4.208   2.143  11.555
  549    HE   ARG  61           HE       ARG  61   1.307   1.698  11.173
  550   HH11  ARG  61          1HH1      ARG  61   3.900   3.731  12.450
  551   HH12  ARG  61          2HH1      ARG  61   2.805   4.763  13.313
  552   HH21  ARG  61          1HH2      ARG  61  -0.074   3.016  12.378
  553   HH22  ARG  61          2HH2      ARG  61   0.569   4.359  13.270
  554    H    VAL  62           H        VAL  62   4.967   2.103   6.067
  555    HA   VAL  62           HA       VAL  62   5.662  -0.640   5.238
  556    HB   VAL  62           HB       VAL  62   5.842   1.072   3.476
  557   HG11  VAL  62          1HG1      VAL  62   6.272   3.075   4.844
  558   HG12  VAL  62          2HG1      VAL  62   7.466   2.909   3.554
  559   HG13  VAL  62          3HG1      VAL  62   7.895   2.478   5.213
  560   HG21  VAL  62          3HG2      VAL  62   7.419  -0.781   3.383
  561   HG22  VAL  62          1HG2      VAL  62   8.576   0.102   4.378
  562   HG23  VAL  62          2HG2      VAL  62   8.178   0.679   2.755
  563    H    LYS  63           H        LYS  63   7.492  -1.697   6.057
  564    HA   LYS  63           HA       LYS  63   8.376  -0.768   8.657
  565    HB2  LYS  63           2HB      LYS  63   7.779  -3.184   8.133
  566    HB3  LYS  63           3HB      LYS  63   9.256  -3.283   7.182
  567    HG2  LYS  63           2HG      LYS  63  10.611  -2.812   9.187
  568    HG3  LYS  63           3HG      LYS  63   9.143  -2.618  10.149
  569    HD2  LYS  63           2HD      LYS  63   8.571  -5.028   9.621
  570    HD3  LYS  63           3HD      LYS  63  10.146  -5.175   8.841
  571    HE2  LYS  63           2HE      LYS  63  11.264  -4.681  10.983
  572    HE3  LYS  63           3HE      LYS  63   9.693  -4.480  11.764
  573    HZ1  LYS  63           3HZ      LYS  63  10.681  -6.995  10.521
  574    HZ2  LYS  63           1HZ      LYS  63   9.196  -6.794  11.300
  575    HZ3  LYS  63           2HZ      LYS  63  10.633  -6.673  12.179
  576    H    HIS  64           H        HIS  64  10.175   0.370   8.986
  577    HA   HIS  64           HA       HIS  64  12.013   0.901   6.748
  578    HB2  HIS  64           2HB      HIS  64  11.550   2.372   9.378
  579    HB3  HIS  64           3HB      HIS  64  12.768   2.839   8.191
  580    HD1  HIS  64           HD1      HIS  64   9.987   4.330   9.218
  581    HD2  HIS  64           HD2      HIS  64  10.879   2.723   5.487
  582    HE1  HIS  64           HE1      HIS  64   8.508   5.541   7.595
  583    HE2  HIS  64           HE2      HIS  64   9.076   4.575   5.347
  584    H    SER  65           H        SER  65  14.219   0.833   7.016
  585    HA   SER  65           HA       SER  65  15.234  -1.354   8.580
  586    HB2  SER  65           2HB      SER  65  16.677   0.625   6.761
  587    HB3  SER  65           3HB      SER  65  17.310  -0.928   7.332
  588    HG   SER  65           HG       SER  65  14.970  -0.572   5.758
  589    H    ASP  66           H        ASP  66  15.671   2.179   8.575
  590    HA   ASP  66           HA       ASP  66  16.669   2.207  11.307
  591    HB2  ASP  66           2HB      ASP  66  18.756   1.658  10.214
  592    HB3  ASP  66           3HB      ASP  66  18.485   2.833   8.943
  593    H    ALA  67           H        ALA  67  16.954   4.423  12.132
  594    HA   ALA  67           HA       ALA  67  14.765   6.065  11.565
  595    HB1  ALA  67           3HB      ALA  67  15.884   5.971  13.753
  596    HB2  ALA  67           1HB      ALA  67  15.729   7.632  13.183
  597    HB3  ALA  67           2HB      ALA  67  17.288   6.804  13.082
  598    H    ALA  68           H        ALA  68  18.184   6.521  10.625
  599    HA   ALA  68           HA       ALA  68  17.741   9.023   9.236
  600    HB1  ALA  68           3HB      ALA  68  19.926   8.492  10.237
  601    HB2  ALA  68           1HB      ALA  68  20.080   8.791   8.505
  602    HB3  ALA  68           2HB      ALA  68  20.119   7.136   9.127
  603    H    GLU  69           H        GLU  69  17.496   5.665   8.437
  604    HA   GLU  69           HA       GLU  69  17.556   6.064   5.560
  605    HB2  GLU  69           2HB      GLU  69  16.854   3.584   7.182
  606    HB3  GLU  69           3HB      GLU  69  17.066   3.637   5.435
  607    HG2  GLU  69           2HG      GLU  69  19.188   4.140   7.533
  608    HG3  GLU  69           3HG      GLU  69  19.058   2.734   6.480
  609    H    GLU  70           H        GLU  70  15.156   6.261   8.041
  610    HA   GLU  70           HA       GLU  70  12.833   5.393   6.745
  611    HB2  GLU  70           2HB      GLU  70  13.087   7.702   8.720
  612    HB3  GLU  70           3HB      GLU  70  11.566   6.959   8.235
  613    HG2  GLU  70           2HG      GLU  70  12.433   4.787   9.171
  614    HG3  GLU  70           3HG      GLU  70  13.809   5.677   9.812
  615    H    LYS  71           H        LYS  71  14.374   8.586   6.670
  616    HA   LYS  71           HA       LYS  71  12.429   9.951   5.138
  617    HB2  LYS  71           2HB      LYS  71  14.215  11.642   4.744
  618    HB3  LYS  71           3HB      LYS  71  14.112  11.161   6.434
  619    HG2  LYS  71           2HG      LYS  71  16.051   9.606   6.039
  620    HG3  LYS  71           3HG      LYS  71  16.212  10.289   4.425
  621    HD2  LYS  71           2HD      LYS  71  16.430  11.903   6.998
  622    HD3  LYS  71           3HD      LYS  71  17.806  11.214   6.143
  623    HE2  LYS  71           2HE      LYS  71  17.727  13.491   5.506
  624    HE3  LYS  71           3HE      LYS  71  17.091  12.605   4.126
  625    HZ1  LYS  71           3HZ      LYS  71  15.407  13.947   6.177
  626    HZ2  LYS  71           1HZ      LYS  71  14.873  13.255   4.733
  627    HZ3  LYS  71           2HZ      LYS  71  15.836  14.641   4.703
  628    H    LYS  72           H        LYS  72  15.165   7.931   4.192
  629    HA   LYS  72           HA       LYS  72  15.085   8.488   1.385
  630    HB2  LYS  72           2HB      LYS  72  16.198   6.069   2.872
  631    HB3  LYS  72           3HB      LYS  72  16.467   6.415   1.164
  632    HG2  LYS  72           2HG      LYS  72  17.665   8.480   1.755
  633    HG3  LYS  72           3HG      LYS  72  17.386   8.157   3.472
  634    HD2  LYS  72           2HD      LYS  72  18.673   6.027   3.256
  635    HD3  LYS  72           3HD      LYS  72  18.983   6.403   1.558
  636    HE2  LYS  72           2HE      LYS  72  20.281   8.359   2.185
  637    HE3  LYS  72           3HE      LYS  72  19.866   8.131   3.885
  638    HZ1  LYS  72           3HZ      LYS  72  22.060   7.300   3.469
  639    HZ2  LYS  72           1HZ      LYS  72  21.511   6.303   2.220
  640    HZ3  LYS  72           2HZ      LYS  72  21.047   5.991   3.815
  641    H    GLU  73           H        GLU  73  14.035   5.702   3.331
  642    HA   GLU  73           HA       GLU  73  12.864   4.187   1.270
  643    HB2  GLU  73           2HB      GLU  73  12.404   4.089   4.281
  644    HB3  GLU  73           3HB      GLU  73  11.894   2.838   3.149
  645    HG2  GLU  73           2HG      GLU  73  14.193   2.296   2.614
  646    HG3  GLU  73           3HG      GLU  73  14.780   3.662   3.563
  647    H    ALA  74           H        ALA  74  11.517   6.679   3.363
  648    HA   ALA  74           HA       ALA  74   8.765   6.084   2.977
  649    HB1  ALA  74           3HB      ALA  74   8.345   8.344   3.832
  650    HB2  ALA  74           1HB      ALA  74  10.059   8.749   3.663
  651    HB3  ALA  74           2HB      ALA  74   9.549   7.517   4.818
  652    H    LYS  75           H        LYS  75  10.891   8.563   1.552
  653    HA   LYS  75           HA       LYS  75   9.192   9.558  -0.468
  654    HB2  LYS  75           2HB      LYS  75  11.354  10.534   0.549
  655    HB3  LYS  75           3HB      LYS  75  12.254   9.463  -0.502
  656    HG2  LYS  75           2HG      LYS  75  10.358  11.602  -1.539
  657    HG3  LYS  75           3HG      LYS  75  12.064  11.894  -1.221
  658    HD2  LYS  75           2HD      LYS  75  12.600  10.053  -2.881
  659    HD3  LYS  75           3HD      LYS  75  10.884  10.005  -3.290
  660    HE2  LYS  75           2HE      LYS  75  12.778  12.352  -3.641
  661    HE3  LYS  75           3HE      LYS  75  12.058  11.374  -4.918
  662    HZ1  LYS  75           3HZ      LYS  75   9.878  12.211  -4.235
  663    HZ2  LYS  75           1HZ      LYS  75  10.916  13.459  -4.690
  664    HZ3  LYS  75           2HZ      LYS  75  10.605  13.174  -3.060
  665    H    LYS  76           H        LYS  76  11.644   7.035  -0.508
  666    HA   LYS  76           HA       LYS  76  11.815   6.465  -3.244
  667    HB2  LYS  76           2HB      LYS  76  13.459   5.931  -1.399
  668    HB3  LYS  76           3HB      LYS  76  12.399   4.626  -0.886
  669    HG2  LYS  76           2HG      LYS  76  12.775   3.491  -3.053
  670    HG3  LYS  76           3HG      LYS  76  13.835   4.818  -3.554
  671    HD2  LYS  76           2HD      LYS  76  15.331   4.336  -1.610
  672    HD3  LYS  76           3HD      LYS  76  14.292   2.980  -1.160
  673    HE2  LYS  76           2HE      LYS  76  15.877   3.237  -3.732
  674    HE3  LYS  76           3HE      LYS  76  16.287   2.219  -2.352
  675    HZ1  LYS  76           3HZ      LYS  76  15.229   0.947  -4.092
  676    HZ2  LYS  76           1HZ      LYS  76  13.873   1.952  -4.051
  677    HZ3  LYS  76           2HZ      LYS  76  14.243   0.981  -2.722
  678    H    PHE  77           H        PHE  77  10.172   4.652  -0.661
  679    HA   PHE  77           HA       PHE  77   8.801   2.860  -2.441
  680    HB2  PHE  77           2HB      PHE  77   9.591   2.282  -0.102
  681    HB3  PHE  77           3HB      PHE  77   8.308   3.299   0.535
  682    HD1  PHE  77           HD1      PHE  77   8.780   0.392  -1.827
  683    HD2  PHE  77           HD2      PHE  77   6.298   2.222   1.140
  684    HE1  PHE  77           HE1      PHE  77   7.287  -1.563  -1.859
  685    HE2  PHE  77           HE2      PHE  77   4.814   0.263   1.099
  686    HZ   PHE  77           HZ       PHE  77   5.304  -1.630  -0.397
  687    H    ALA  78           H        ALA  78   8.143   6.001  -1.135
  688    HA   ALA  78           HA       ALA  78   5.325   6.131  -1.425
  689    HB1  ALA  78           3HB      ALA  78   5.606   8.570  -1.615
  690    HB2  ALA  78           1HB      ALA  78   7.352   8.356  -1.809
  691    HB3  ALA  78           2HB      ALA  78   6.567   7.903  -0.298
  692    H    ALA  79           H        ALA  79   7.990   6.771  -3.702
  693    HA   ALA  79           HA       ALA  79   6.477   7.516  -5.952
  694    HB1  ALA  79           3HB      ALA  79   9.159   6.078  -5.862
  695    HB2  ALA  79           1HB      ALA  79   8.916   7.824  -5.796
  696    HB3  ALA  79           2HB      ALA  79   8.492   6.933  -7.258
  697    H    ILE  80           H        ILE  80   7.531   4.369  -4.766
  698    HA   ILE  80           HA       ILE  80   6.624   2.707  -6.855
  699    HB   ILE  80           HB       ILE  80   7.134   2.175  -3.900
  700   HG12  ILE  80          2HG1      ILE  80   9.105   2.910  -5.145
  701   HG13  ILE  80          3HG1      ILE  80   9.272   1.212  -4.718
  702   HG21  ILE  80          1HG2      ILE  80   7.243  -0.222  -4.388
  703   HG22  ILE  80          2HG2      ILE  80   6.751   0.078  -6.054
  704   HG23  ILE  80          3HG2      ILE  80   5.633   0.417  -4.736
  705   HD11  ILE  80          3HD1      ILE  80  10.078   1.607  -6.949
  706   HD12  ILE  80          1HD1      ILE  80   8.536   2.308  -7.434
  707   HD13  ILE  80          2HD1      ILE  80   8.639   0.593  -7.023
  708    H    LEU  81           H        LEU  81   5.060   3.608  -3.747
  709    HA   LEU  81           HA       LEU  81   2.705   2.069  -4.111
  710    HB2  LEU  81           2HB      LEU  81   3.428   4.387  -2.289
  711    HB3  LEU  81           3HB      LEU  81   1.793   3.755  -2.315
  712    HG   LEU  81           HG       LEU  81   4.284   2.180  -1.534
  713   HD11  LEU  81          1HD1      LEU  81   3.646   3.830   0.165
  714   HD12  LEU  81          2HD1      LEU  81   3.352   2.192   0.737
  715   HD13  LEU  81          3HD1      LEU  81   1.999   3.192   0.197
  716   HD21  LEU  81          3HD2      LEU  81   1.374   1.288  -1.537
  717   HD22  LEU  81          1HD2      LEU  81   2.734   0.375  -0.874
  718   HD23  LEU  81          2HD2      LEU  81   2.652   0.696  -2.602
  719    H    ASN  82           H        ASN  82   3.559   5.416  -4.802
  720    HA   ASN  82           HA       ASN  82   1.040   6.491  -5.454
  721    HB2  ASN  82           2HB      ASN  82   3.121   7.808  -4.979
  722    HB3  ASN  82           3HB      ASN  82   3.795   7.287  -6.518
  723   HD21  ASN  82          1HD2      ASN  82   3.961   9.271  -7.437
  724   HD22  ASN  82          2HD2      ASN  82   2.630  10.307  -7.792
  725    H    LYS  83           H        LYS  83   3.511   4.897  -7.445
  726    HA   LYS  83           HA       LYS  83   2.173   5.135  -9.953
  727    HB2  LYS  83           2HB      LYS  83   4.334   3.186  -9.038
  728    HB3  LYS  83           3HB      LYS  83   3.770   3.319 -10.699
  729    HG2  LYS  83           2HG      LYS  83   5.200   5.465  -9.108
  730    HG3  LYS  83           3HG      LYS  83   5.866   4.512 -10.436
  731    HD2  LYS  83           2HD      LYS  83   4.194   5.535 -11.973
  732    HD3  LYS  83           3HD      LYS  83   3.587   6.516 -10.637
  733    HE2  LYS  83           2HE      LYS  83   5.823   7.587 -10.445
  734    HE3  LYS  83           3HE      LYS  83   6.378   6.637 -11.827
  735    HZ1  LYS  83           3HZ      LYS  83   5.700   8.843 -12.513
  736    HZ2  LYS  83           1HZ      LYS  83   4.159   8.614 -11.856
  737    HZ3  LYS  83           2HZ      LYS  83   4.658   7.694 -13.180
  738    H    VAL  84           H        VAL  84   2.200   2.635  -7.428
  739    HA   VAL  84           HA       VAL  84   0.835   0.590  -8.848
  740    HB   VAL  84           HB       VAL  84   1.248   1.121  -5.867
  741   HG11  VAL  84          1HG1      VAL  84  -0.168  -1.289  -7.064
  742   HG12  VAL  84          2HG1      VAL  84  -0.878  -0.075  -6.002
  743   HG13  VAL  84          3HG1      VAL  84   0.372  -1.157  -5.389
  744   HG21  VAL  84          3HG2      VAL  84   2.763  -0.827  -5.996
  745   HG22  VAL  84          1HG2      VAL  84   3.237   0.422  -7.150
  746   HG23  VAL  84          2HG2      VAL  84   2.388  -1.020  -7.710
  747    H    PHE  85           H        PHE  85  -0.294   3.016  -6.510
  748    HA   PHE  85           HA       PHE  85  -3.044   2.451  -6.584
  749    HB2  PHE  85           2HB      PHE  85  -1.627   5.063  -5.896
  750    HB3  PHE  85           3HB      PHE  85  -3.338   4.762  -5.610
  751    HD1  PHE  85           HD1      PHE  85  -3.461   2.071  -4.500
  752    HD2  PHE  85           HD2      PHE  85  -0.551   5.120  -3.787
  753    HE1  PHE  85           HE1      PHE  85  -2.957   1.089  -2.304
  754    HE2  PHE  85           HE2      PHE  85  -0.053   4.125  -1.600
  755    HZ   PHE  85           HZ       PHE  85  -1.256   2.118  -0.858
  756    H    ALA  86           H        ALA  86  -1.056   4.585  -8.589
  757    HA   ALA  86           HA       ALA  86  -3.091   5.840 -10.107
  758    HB1  ALA  86           3HB      ALA  86  -1.317   6.336 -11.733
  759    HB2  ALA  86           1HB      ALA  86  -0.254   5.152 -10.956
  760    HB3  ALA  86           2HB      ALA  86  -0.748   6.604 -10.087
  761    H    GLU  87           H        GLU  87  -1.592   2.689 -10.327
  762    HA   GLU  87           HA       GLU  87  -2.744   1.980 -12.918
  763    HB2  GLU  87           2HB      GLU  87  -1.077   0.394 -10.909
  764    HB3  GLU  87           3HB      GLU  87  -1.595  -0.225 -12.476
  765    HG2  GLU  87           2HG      GLU  87  -0.253   1.419 -13.646
  766    HG3  GLU  87           3HG      GLU  87   0.131   2.244 -12.140
  767    H    LEU  88           H        LEU  88  -3.828   2.028  -9.695
  768    HA   LEU  88           HA       LEU  88  -5.604  -0.329  -9.993
  769    HB2  LEU  88           2HB      LEU  88  -5.052   1.311  -7.483
  770    HB3  LEU  88           3HB      LEU  88  -6.049  -0.130  -7.576
  771    HG   LEU  88           HG       LEU  88  -3.031   0.038  -7.810
  772   HD11  LEU  88          1HD1      LEU  88  -3.006  -1.397  -5.837
  773   HD12  LEU  88          2HD1      LEU  88  -4.771  -1.394  -5.797
  774   HD13  LEU  88          3HD1      LEU  88  -3.878   0.105  -5.529
  775   HD21  LEU  88          3HD2      LEU  88  -4.721  -2.434  -8.255
  776   HD22  LEU  88          1HD2      LEU  88  -2.958  -2.392  -8.135
  777   HD23  LEU  88          2HD2      LEU  88  -3.769  -1.586  -9.476
  778    H    GLY  89           H        GLY  89  -5.588   2.889 -10.657
  779    HA2  GLY  89           2HA      GLY  89  -7.405   4.017 -11.633
  780    HA3  GLY  89           3HA      GLY  89  -8.527   3.060 -10.681
  781    H    TYR  90           H        TYR  90  -6.178   4.007  -8.556
  782    HA   TYR  90           HA       TYR  90  -7.829   6.102  -7.403
  783    HB2  TYR  90           2HB      TYR  90  -5.097   5.148  -6.431
  784    HB3  TYR  90           3HB      TYR  90  -6.302   6.037  -5.504
  785    HD1  TYR  90           HD2      TYR  90  -8.788   4.462  -6.086
  786    HD2  TYR  90           HD1      TYR  90  -4.818   3.126  -5.260
  787    HE1  TYR  90           HE2      TYR  90  -9.672   2.335  -5.237
  788    HE2  TYR  90           HE1      TYR  90  -5.699   1.000  -4.407
  789    HH   TYR  90           HH       TYR  90  -7.796   0.126  -3.492
  790    H    ASN  91           H        ASN  91  -7.322   8.274  -7.296
  791    HA   ASN  91           HA       ASN  91  -5.581   9.400  -9.276
  792    HB2  ASN  91           2HB      ASN  91  -7.687  10.514  -8.579
  793    HB3  ASN  91           3HB      ASN  91  -7.047  10.732  -6.955
  794   HD21  ASN  91          1HD2      ASN  91  -7.330  12.982  -7.093
  795   HD22  ASN  91          2HD2      ASN  91  -6.320  13.991  -8.070
  796    H    ASP  92           H        ASP  92  -3.655  10.569  -8.983
  797    HA   ASP  92           HA       ASP  92  -1.649   9.675  -7.328
  798    HB2  ASP  92           2HB      ASP  92  -1.333  10.972  -9.416
  799    HB3  ASP  92           3HB      ASP  92  -2.016  12.403  -8.665
  800    H    SER  93           H        SER  93  -3.473  12.710  -6.987
  801    HA   SER  93           HA       SER  93  -2.237  13.718  -4.723
  802    HB2  SER  93           2HB      SER  93  -3.661  14.986  -6.363
  803    HB3  SER  93           3HB      SER  93  -5.094  14.298  -5.604
  804    HG   SER  93           HG       SER  93  -4.367  15.294  -3.630
  805    H    ASN  94           H        ASN  94  -4.588  11.167  -4.831
  806    HA   ASN  94           HA       ASN  94  -5.730  11.541  -2.205
  807    HB2  ASN  94           2HB      ASN  94  -5.766   9.121  -4.058
  808    HB3  ASN  94           3HB      ASN  94  -6.684   9.237  -2.556
  809   HD21  ASN  94          1HD2      ASN  94  -7.721   8.835  -5.182
  810   HD22  ASN  94          2HD2      ASN  94  -8.782  10.158  -5.516
  811    H    VAL  95           H        VAL  95  -2.806  10.155  -3.361
  812    HA   VAL  95           HA       VAL  95  -2.277   8.386  -1.132
  813    HB   VAL  95           HB       VAL  95  -0.318   9.604  -3.160
  814   HG11  VAL  95          1HG1      VAL  95   0.036   7.144  -1.405
  815   HG12  VAL  95          2HG1      VAL  95   0.836   8.700  -1.180
  816   HG13  VAL  95          3HG1      VAL  95   1.186   7.732  -2.612
  817   HG21  VAL  95          3HG2      VAL  95  -0.533   7.506  -4.450
  818   HG22  VAL  95          1HG2      VAL  95  -2.080   8.348  -4.329
  819   HG23  VAL  95          2HG2      VAL  95  -1.766   6.932  -3.323
  820    H    THR  96           H        THR  96  -2.264   9.420   0.856
  821    HA   THR  96           HA       THR  96  -1.025  12.119   1.077
  822    HB   THR  96           HB       THR  96  -3.106  10.935   2.977
  823    HG1  THR  96           HG1      THR  96  -4.052  11.114   0.928
  824   HG21  THR  96          3HG2      THR  96  -1.785  12.835   3.882
  825   HG22  THR  96          1HG2      THR  96  -3.477  13.276   3.644
  826   HG23  THR  96          2HG2      THR  96  -2.255  13.819   2.494
  827    H    TRP  97           H        TRP  97   1.089  11.402   1.555
  828    HA   TRP  97           HA       TRP  97   1.644   9.565   3.688
  829    HB2  TRP  97           2HB      TRP  97   3.353  11.470   2.046
  830    HB3  TRP  97           3HB      TRP  97   4.029  10.653   3.455
  831    HD1  TRP  97           HD1      TRP  97   2.714   9.872  -0.097
  832    HE1  TRP  97           HE1      TRP  97   3.438   7.485  -0.726
  833    HE3  TRP  97           HE3      TRP  97   4.704   8.395   4.396
  834    HZ2  TRP  97           HZ2      TRP  97   4.699   5.278   0.504
  835    HZ3  TRP  97           HZ3      TRP  97   5.648   6.126   4.581
  836    HH2  TRP  97           HH2      TRP  97   5.643   4.598   2.670
  837    H    ASP  98           H        ASP  98   1.008  10.022   5.634
  838    HA   ASP  98           HA       ASP  98   1.132  12.743   6.769
  839    HB2  ASP  98           2HB      ASP  98  -1.077  11.661   6.863
  840    HB3  ASP  98           3HB      ASP  98  -0.388  10.231   7.618
  841    H    GLY  99           H        GLY  99   3.468  12.477   6.850
  842    HA2  GLY  99           2HA      GLY  99   5.420  12.250   8.007
  843    HA3  GLY  99           3HA      GLY  99   4.466  11.811   9.415
  844    H    ASP 100           H        ASP 100   3.948   9.631   9.767
  845    HA   ASP 100           HA       ASP 100   5.995   7.732   8.968
  846    HB2  ASP 100           2HB      ASP 100   5.107   8.034  11.342
  847    HB3  ASP 100           3HB      ASP 100   3.574   7.366  10.803
  848    H    THR 101           H        THR 101   2.427   7.837   8.938
  849    HA   THR 101           HA       THR 101   2.331   5.389   7.268
  850    HB   THR 101           HB       THR 101   0.104   6.587   8.990
  851    HG1  THR 101           HG1      THR 101   2.362   5.182   9.721
  852   HG21  THR 101          3HG2      THR 101  -0.661   4.940   7.275
  853   HG22  THR 101          1HG2      THR 101  -0.860   4.324   8.918
  854   HG23  THR 101          2HG2      THR 101   0.482   3.757   7.923
  855    H    VAL 102           H        VAL 102   0.987   5.340   5.396
  856    HA   VAL 102           HA       VAL 102   0.242   7.995   4.317
  857    HB   VAL 102           HB       VAL 102   1.933   6.898   2.965
  858   HG11  VAL 102          1HG1      VAL 102   0.068   4.534   2.635
  859   HG12  VAL 102          2HG1      VAL 102   1.585   4.554   3.532
  860   HG13  VAL 102          3HG1      VAL 102   1.598   4.766   1.781
  861   HG21  VAL 102          3HG2      VAL 102   0.822   6.912   0.756
  862   HG22  VAL 102          1HG2      VAL 102   0.288   8.254   1.770
  863   HG23  VAL 102          2HG2      VAL 102  -0.752   6.847   1.550
  864    H    THR 103           H        THR 103  -1.853   8.446   4.251
  865    HA   THR 103           HA       THR 103  -3.915   6.352   4.362
  866    HB   THR 103           HB       THR 103  -3.988   9.350   4.970
  867    HG1  THR 103           HG1      THR 103  -3.611   8.681   6.936
  868   HG21  THR 103          3HG2      THR 103  -6.171   8.692   4.016
  869   HG22  THR 103          1HG2      THR 103  -6.311   9.003   5.748
  870   HG23  THR 103          2HG2      THR 103  -6.273   7.343   5.151
  871    H    VAL 104           H        VAL 104  -4.600   5.773   2.422
  872    HA   VAL 104           HA       VAL 104  -4.714   7.673   0.152
  873    HB   VAL 104           HB       VAL 104  -4.478   4.618   0.057
  874   HG11  VAL 104          1HG1      VAL 104  -3.949   4.920  -2.344
  875   HG12  VAL 104          2HG1      VAL 104  -4.244   6.656  -2.197
  876   HG13  VAL 104          3HG1      VAL 104  -5.568   5.513  -1.957
  877   HG21  VAL 104          3HG2      VAL 104  -2.134   4.943  -0.589
  878   HG22  VAL 104          1HG2      VAL 104  -2.444   5.624   1.008
  879   HG23  VAL 104          2HG2      VAL 104  -2.299   6.688  -0.394
  880    H    GLU 105           H        GLU 105  -6.779   8.314  -0.167
  881    HA   GLU 105           HA       GLU 105  -9.023   6.622   0.671
  882    HB2  GLU 105           2HB      GLU 105  -8.995   8.992   1.373
  883    HB3  GLU 105           3HB      GLU 105  -8.958   9.503  -0.313
  884    HG2  GLU 105           2HG      GLU 105 -11.182   8.466  -0.670
  885    HG3  GLU 105           3HG      GLU 105 -11.229   7.980   1.024
  886    H    GLY 106           H        GLY 106  -9.850   5.274  -0.778
  887    HA2  GLY 106           2HA      GLY 106  -9.470   5.764  -3.676
  888    HA3  GLY 106           3HA      GLY 106  -9.639   4.194  -2.909
  889    H    GLN 107           H        GLN 107 -11.179   5.936  -5.011
  890    HA   GLN 107           HA       GLN 107 -13.915   5.620  -4.055
  891    HB2  GLN 107           2HB      GLN 107 -13.283   7.512  -5.559
  892    HB3  GLN 107           3HB      GLN 107 -12.871   6.381  -6.832
  893    HG2  GLN 107           2HG      GLN 107 -15.666   6.506  -5.675
  894    HG3  GLN 107           3HG      GLN 107 -15.157   7.614  -6.941
  895   HE21  GLN 107          1HE2      GLN 107 -17.259   5.587  -7.007
  896   HE22  GLN 107          2HE2      GLN 107 -16.861   4.537  -8.319
  897    H    LEU 108           H        LEU 108 -14.827   3.719  -4.057
  898    HA   LEU 108           HA       LEU 108 -14.062   1.584  -5.965
  899    HB2  LEU 108           2HB      LEU 108 -13.311   1.203  -3.641
  900    HB3  LEU 108           3HB      LEU 108 -14.939   1.411  -3.043
  901    HG   LEU 108           HG       LEU 108 -14.242  -0.879  -4.927
  902   HD11  LEU 108          1HD1      LEU 108 -14.019  -0.890  -1.893
  903   HD12  LEU 108          2HD1      LEU 108 -12.679  -0.994  -3.037
  904   HD13  LEU 108          3HD1      LEU 108 -13.858  -2.297  -2.950
  905   HD21  LEU 108          3HD2      LEU 108 -16.414  -0.609  -2.807
  906   HD22  LEU 108          1HD2      LEU 108 -16.174  -1.983  -3.886
  907   HD23  LEU 108          2HD2      LEU 108 -16.658  -0.429  -4.545
  908    H    GLU 109           H        GLU 109 -15.767   0.549  -6.995
  909    HA   GLU 109           HA       GLU 109 -18.526   1.197  -6.242
  910    HB2  GLU 109           2HB      GLU 109 -19.072   1.701  -8.675
  911    HB3  GLU 109           3HB      GLU 109 -18.163   2.933  -7.813
  912    HG2  GLU 109           2HG      GLU 109 -16.101   2.269  -8.925
  913    HG3  GLU 109           3HG      GLU 109 -16.914   0.915  -9.707
  914    H    GLY 110           H        GLY 110 -19.623  -0.604  -6.101
  915    HA2  GLY 110           2HA      GLY 110 -19.055  -2.903  -7.912
  916    HA3  GLY 110           3HA      GLY 110 -19.751  -3.026  -6.300
  917    H    VAL 111           H        VAL 111 -20.317  -1.810  -9.551
  918    HA   VAL 111           HA       VAL 111 -22.914  -0.814  -9.356
  919    HB   VAL 111           HB       VAL 111 -21.589  -2.177 -11.749
  920   HG11  VAL 111          1HG1      VAL 111 -23.092  -0.858 -13.190
  921   HG12  VAL 111          2HG1      VAL 111 -23.924  -0.227 -11.767
  922   HG13  VAL 111          3HG1      VAL 111 -24.010  -1.947 -12.148
  923   HG21  VAL 111          3HG2      VAL 111 -20.249  -0.337 -10.819
  924   HG22  VAL 111          1HG2      VAL 111 -21.628   0.758 -10.966
  925   HG23  VAL 111          2HG2      VAL 111 -20.879   0.078 -12.414
  926    H    ASP 112           H        ASP 112 -21.820  -4.101  -9.869
  927    HA   ASP 112           HA       ASP 112 -24.526  -5.150  -9.284
  928    HB2  ASP 112           2HB      ASP 112 -23.883  -5.523 -11.684
  929    HB3  ASP 112           3HB      ASP 112 -22.436  -6.376 -11.161
  930    H    LEU 113           H        LEU 113 -24.211  -5.534  -7.137
  931    HA   LEU 113           HA       LEU 113 -21.782  -6.729  -6.103
  932    HB2  LEU 113           2HB      LEU 113 -24.393  -5.921  -4.771
  933    HB3  LEU 113           3HB      LEU 113 -23.062  -6.664  -3.901
  934    HG   LEU 113           HG       LEU 113 -22.959  -3.968  -5.317
  935   HD11  LEU 113          1HD1      LEU 113 -22.765  -2.993  -3.071
  936   HD12  LEU 113          2HD1      LEU 113 -22.942  -4.592  -2.344
  937   HD13  LEU 113          3HD1      LEU 113 -24.279  -3.881  -3.248
  938   HD21  LEU 113          3HD2      LEU 113 -20.803  -5.380  -3.711
  939   HD22  LEU 113          1HD2      LEU 113 -20.717  -3.724  -4.321
  940   HD23  LEU 113          2HD2      LEU 113 -20.786  -5.073  -5.449
  941    H    GLU 114           H        GLU 114 -21.466  -8.773  -6.557
  942    HA   GLU 114           HA       GLU 114 -23.531 -10.770  -6.874
  943    HB2  GLU 114           2HB      GLU 114 -21.683 -12.288  -7.381
  944    HB3  GLU 114           3HB      GLU 114 -21.457 -10.768  -8.230
  945    HG2  GLU 114           2HG      GLU 114 -19.333 -10.810  -7.460
  946    HG3  GLU 114           3HG      GLU 114 -20.003 -10.332  -5.907
  947    H    HIS 115           H        HIS 115 -23.366 -12.896  -5.661
  948    HA   HIS 115           HA       HIS 115 -22.166 -12.941  -3.059
  949    HB2  HIS 115           2HB      HIS 115 -24.307 -13.232  -1.756
  950    HB3  HIS 115           3HB      HIS 115 -24.079 -11.606  -2.384
  951    HD1  HIS 115           HD1      HIS 115 -25.657 -10.893  -4.391
  952    HD2  HIS 115           HD2      HIS 115 -26.656 -14.503  -2.589
  953    HE1  HIS 115           HE1      HIS 115 -27.968 -11.448  -5.206
  954    HE2  HIS 115           HE2      HIS 115 -28.584 -13.573  -4.026
  955    H    HIS 116           H        HIS 116 -21.283 -14.652  -4.563
  956    HA   HIS 116           HA       HIS 116 -22.774 -17.090  -4.836
  957    HB2  HIS 116           2HB      HIS 116 -20.655 -18.205  -5.345
  958    HB3  HIS 116           3HB      HIS 116 -20.752 -16.689  -6.220
  959    HD1  HIS 116           HD1      HIS 116 -19.198 -14.729  -5.263
  960    HD2  HIS 116           HD2      HIS 116 -18.394 -18.527  -3.817
  961    HE1  HIS 116           HE1      HIS 116 -16.931 -14.577  -4.206
  962    HE2  HIS 116           HE2      HIS 116 -16.569 -16.829  -3.156
  963    H    HIS 117           H        HIS 117 -23.191 -18.638  -3.335
  964    HA   HIS 117           HA       HIS 117 -23.751 -17.657  -0.857
  965    HB2  HIS 117           2HB      HIS 117 -24.975 -19.493  -1.970
  966    HB3  HIS 117           3HB      HIS 117 -23.646 -20.596  -1.635
  967    HD1  HIS 117           HD1      HIS 117 -23.501 -21.576   0.730
  968    HD2  HIS 117           HD2      HIS 117 -26.573 -18.816   0.288
  969    HE1  HIS 117           HE1      HIS 117 -24.896 -21.783   2.806
  970    HE2  HIS 117           HE2      HIS 117 -26.605 -19.949   2.610
  971    H    HIS 118           H        HIS 118 -21.864 -16.820   0.034
  972    HA   HIS 118           HA       HIS 118 -20.539 -18.547   1.992
  973    HB2  HIS 118           2HB      HIS 118 -19.053 -16.715   0.037
  974    HB3  HIS 118           3HB      HIS 118 -18.331 -17.286   1.533
  975    HD1  HIS 118           HD1      HIS 118 -17.279 -19.580   1.511
  976    HD2  HIS 118           HD2      HIS 118 -19.417 -18.777  -1.955
  977    HE1  HIS 118           HE1      HIS 118 -16.635 -21.381  -0.114
  978    HE2  HIS 118           HE2      HIS 118 -17.889 -20.835  -2.224
  979    H    HIS 119           H        HIS 119 -18.910 -16.510   3.109
  980    HA   HIS 119           HA       HIS 119 -20.374 -14.011   3.304
  981    HB2  HIS 119           2HB      HIS 119 -20.477 -14.117   5.851
  982    HB3  HIS 119           3HB      HIS 119 -21.615 -15.150   5.004
  983    HD1  HIS 119           HD1      HIS 119 -21.471 -17.653   5.413
  984    HD2  HIS 119           HD2      HIS 119 -18.399 -15.537   7.250
  985    HE1  HIS 119           HE1      HIS 119 -20.328 -19.298   6.934
  986    HE2  HIS 119           HE2      HIS 119 -18.625 -17.933   8.183
  987    H    HIS 120           H        HIS 120 -18.110 -14.154   2.092
  988    HA   HIS 120           HA       HIS 120 -16.186 -12.789   3.864
  989    HB2  HIS 120           2HB      HIS 120 -15.519 -15.126   2.016
  990    HB3  HIS 120           3HB      HIS 120 -14.291 -13.977   2.536
  991    HD1  HIS 120           HD1      HIS 120 -13.484 -14.127   4.953
  992    HD2  HIS 120           HD2      HIS 120 -16.413 -16.906   4.029
  993    HE1  HIS 120           HE1      HIS 120 -13.528 -15.715   6.885
  994    HE2  HIS 120           HE2      HIS 120 -15.085 -17.545   6.149
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1  20.860  -4.879   0.272
    2    H2   MET   1           2H       MET   1  22.136  -4.101  -0.511
    3    H3   MET   1           3H       MET   1  22.167  -5.776  -0.314
    4    HA   MET   1           HA       MET   1  21.622  -5.212  -2.564
    5    HB2  MET   1           2HB      MET   1  19.259  -6.339  -0.986
    6    HB3  MET   1           3HB      MET   1  19.443  -6.468  -2.732
    7    HG2  MET   1           2HG      MET   1  21.299  -7.685  -0.674
    8    HG3  MET   1           3HG      MET   1  20.071  -8.546  -1.608
    9    HE1  MET   1           3HE      MET   1  23.495  -9.794  -3.144
   10    HE2  MET   1           1HE      MET   1  22.009 -10.284  -2.334
   11    HE3  MET   1           2HE      MET   1  23.226  -9.356  -1.457
   12    H    SER   2           H        SER   2  19.992  -4.376  -4.062
   13    HA   SER   2           HA       SER   2  19.025  -1.752  -3.439
   14    HB2  SER   2           2HB      SER   2  18.471  -3.532  -5.854
   15    HB3  SER   2           3HB      SER   2  18.141  -1.800  -5.761
   16    HG   SER   2           HG       SER   2  20.161  -1.429  -6.204
   17    H    GLY   3           H        GLY   3  17.657  -4.955  -3.415
   18    HA2  GLY   3           2HA      GLY   3  14.969  -3.977  -2.724
   19    HA3  GLY   3           3HA      GLY   3  15.437  -5.637  -3.058
   20    H    LYS   4           H        LYS   4  14.255  -3.965  -0.675
   21    HA   LYS   4           HA       LYS   4  15.813  -5.292   1.477
   22    HB2  LYS   4           2HB      LYS   4  16.125  -2.760   1.304
   23    HB3  LYS   4           3HB      LYS   4  14.411  -2.566   1.618
   24    HG2  LYS   4           2HG      LYS   4  16.257  -3.939   3.589
   25    HG3  LYS   4           3HG      LYS   4  16.068  -2.186   3.551
   26    HD2  LYS   4           2HD      LYS   4  13.610  -2.481   3.961
   27    HD3  LYS   4           3HD      LYS   4  13.869  -4.223   4.085
   28    HE2  LYS   4           2HE      LYS   4  15.073  -2.109   5.898
   29    HE3  LYS   4           3HE      LYS   4  13.746  -3.197   6.306
   30    HZ1  LYS   4           3HZ      LYS   4  16.497  -4.076   5.615
   31    HZ2  LYS   4           1HZ      LYS   4  15.231  -5.060   6.146
   32    HZ3  LYS   4           2HZ      LYS   4  15.904  -3.915   7.187
   33    H    LYS   5           H        LYS   5  14.550  -6.601   2.755
   34    HA   LYS   5           HA       LYS   5  11.803  -7.071   2.103
   35    HB2  LYS   5           2HB      LYS   5  13.320  -8.889   2.885
   36    HB3  LYS   5           3HB      LYS   5  13.416  -8.116   4.466
   37    HG2  LYS   5           2HG      LYS   5  10.895  -8.407   4.667
   38    HG3  LYS   5           3HG      LYS   5  10.951  -9.348   3.174
   39    HD2  LYS   5           2HD      LYS   5  10.938 -10.853   5.093
   40    HD3  LYS   5           3HD      LYS   5  12.496 -10.962   4.270
   41    HE2  LYS   5           2HE      LYS   5  13.490  -9.452   5.967
   42    HE3  LYS   5           3HE      LYS   5  11.933  -9.361   6.792
   43    HZ1  LYS   5           3HZ      LYS   5  13.450 -10.945   7.827
   44    HZ2  LYS   5           1HZ      LYS   5  13.502 -11.855   6.402
   45    HZ3  LYS   5           2HZ      LYS   5  12.051 -11.700   7.256
   46    H    VAL   6           H        VAL   6  10.457  -5.486   2.561
   47    HA   VAL   6           HA       VAL   6  10.507  -4.046   5.144
   48    HB   VAL   6           HB       VAL   6  10.534  -2.561   3.210
   49   HG11  VAL   6          1HG1      VAL   6   8.030  -3.961   2.191
   50   HG12  VAL   6          2HG1      VAL   6   9.648  -4.127   1.511
   51   HG13  VAL   6          3HG1      VAL   6   8.821  -2.568   1.440
   52   HG21  VAL   6          3HG2      VAL   6   8.514  -1.217   3.563
   53   HG22  VAL   6          1HG2      VAL   6   9.167  -1.799   5.096
   54   HG23  VAL   6          2HG2      VAL   6   7.739  -2.568   4.392
   55    H    GLU   7           H        GLU   7   8.603  -3.918   6.421
   56    HA   GLU   7           HA       GLU   7   6.502  -5.935   5.899
   57    HB2  GLU   7           2HB      GLU   7   7.169  -4.428   8.461
   58    HB3  GLU   7           3HB      GLU   7   5.840  -5.569   8.277
   59    HG2  GLU   7           2HG      GLU   7   7.457  -7.381   7.791
   60    HG3  GLU   7           3HG      GLU   7   8.782  -6.230   7.980
   61    H    VAL   8           H        VAL   8   4.848  -5.174   4.901
   62    HA   VAL   8           HA       VAL   8   4.091  -2.333   4.941
   63    HB   VAL   8           HB       VAL   8   3.447  -4.597   2.976
   64   HG11  VAL   8          1HG1      VAL   8   2.659  -1.666   2.782
   65   HG12  VAL   8          2HG1      VAL   8   1.563  -3.020   3.057
   66   HG13  VAL   8          3HG1      VAL   8   2.424  -2.884   1.525
   67   HG21  VAL   8          3HG2      VAL   8   5.237  -2.153   2.656
   68   HG22  VAL   8          1HG2      VAL   8   4.912  -3.366   1.413
   69   HG23  VAL   8          2HG2      VAL   8   5.790  -3.816   2.876
   70    H    GLN   9           H        GLN   9   2.586  -1.938   6.455
   71    HA   GLN   9           HA       GLN   9   0.658  -3.999   7.310
   72    HB2  GLN   9           2HB      GLN   9   1.328  -1.274   8.531
   73    HB3  GLN   9           3HB      GLN   9   0.275  -2.488   9.251
   74    HG2  GLN   9           2HG      GLN   9   2.172  -3.996   9.573
   75    HG3  GLN   9           3HG      GLN   9   3.245  -2.877   8.733
   76   HE21  GLN   9          1HE2      GLN   9   3.520  -3.918  11.443
   77   HE22  GLN   9          2HE2      GLN   9   3.505  -2.553  12.502
   78    H    VAL  10           H        VAL  10  -1.030  -3.955   5.879
   79    HA   VAL  10           HA       VAL  10  -2.051  -1.386   4.848
   80    HB   VAL  10           HB       VAL  10  -2.681  -4.251   3.957
   81   HG11  VAL  10          1HG1      VAL  10  -3.600  -1.616   2.733
   82   HG12  VAL  10          2HG1      VAL  10  -4.618  -2.783   3.580
   83   HG13  VAL  10          3HG1      VAL  10  -3.871  -3.221   2.044
   84   HG21  VAL  10          3HG2      VAL  10  -0.385  -3.572   3.371
   85   HG22  VAL  10          1HG2      VAL  10  -0.992  -2.106   2.595
   86   HG23  VAL  10          2HG2      VAL  10  -1.380  -3.691   1.920
   87    H    LYS  11           H        LYS  11  -3.538  -0.494   6.074
   88    HA   LYS  11           HA       LYS  11  -5.493  -2.091   7.623
   89    HB2  LYS  11           2HB      LYS  11  -3.999  -0.523   8.894
   90    HB3  LYS  11           3HB      LYS  11  -4.570   0.813   7.902
   91    HG2  LYS  11           2HG      LYS  11  -6.915   0.286   8.798
   92    HG3  LYS  11           3HG      LYS  11  -6.125  -0.765   9.972
   93    HD2  LYS  11           2HD      LYS  11  -5.782   2.243   9.664
   94    HD3  LYS  11           3HD      LYS  11  -6.557   1.393  11.002
   95    HE2  LYS  11           2HE      LYS  11  -3.604   1.328  10.295
   96    HE3  LYS  11           3HE      LYS  11  -4.340   2.165  11.658
   97    HZ1  LYS  11           3HZ      LYS  11  -4.359  -0.779  11.270
   98    HZ2  LYS  11           1HZ      LYS  11  -4.982   0.056  12.593
   99    HZ3  LYS  11           2HZ      LYS  11  -3.323   0.062  12.301
  100    H    ILE  12           H        ILE  12  -7.255  -2.335   6.211
  101    HA   ILE  12           HA       ILE  12  -8.179   0.062   4.743
  102    HB   ILE  12           HB       ILE  12  -7.525  -1.653   3.176
  103   HG12  ILE  12          2HG1      ILE  12 -10.576  -1.509   3.300
  104   HG13  ILE  12          3HG1      ILE  12  -9.532  -0.245   2.658
  105   HG21  ILE  12          1HG2      ILE  12  -9.459  -3.574   4.517
  106   HG22  ILE  12          2HG2      ILE  12  -7.699  -3.672   4.561
  107   HG23  ILE  12          3HG2      ILE  12  -8.552  -3.890   3.032
  108   HD11  ILE  12          3HD1      ILE  12 -10.512  -1.522   0.879
  109   HD12  ILE  12          1HD1      ILE  12  -9.865  -3.022   1.544
  110   HD13  ILE  12          2HD1      ILE  12  -8.770  -1.788   0.914
  111    H    THR  13           H        THR  13  -9.969   0.961   5.419
  112    HA   THR  13           HA       THR  13 -11.777  -0.399   7.280
  113    HB   THR  13           HB       THR  13 -11.671   2.558   6.497
  114    HG1  THR  13           HG1      THR  13  -9.815   1.448   7.742
  115   HG21  THR  13          3HG2      THR  13 -13.018   2.912   8.540
  116   HG22  THR  13          1HG2      THR  13 -13.062   1.169   8.828
  117   HG23  THR  13          2HG2      THR  13 -13.869   1.855   7.415
  118    H    CYS  14           H        CYS  14 -13.587  -1.249   6.525
  119    HA   CYS  14           HA       CYS  14 -15.120  -0.193   4.276
  120    HB2  CYS  14           2HB      CYS  14 -13.536  -1.606   3.122
  121    HB3  CYS  14           3HB      CYS  14 -13.736  -2.904   4.292
  122    H    ASN  15           H        ASN  15 -17.243  -0.528   4.607
  123    HA   ASN  15           HA       ASN  15 -19.245  -1.124   5.450
  124    HB2  ASN  15           2HB      ASN  15 -18.310  -3.462   4.764
  125    HB3  ASN  15           3HB      ASN  15 -18.029  -3.727   6.482
  126   HD21  ASN  15          1HD2      ASN  15 -19.858  -3.961   7.857
  127   HD22  ASN  15          2HD2      ASN  15 -21.439  -4.285   7.238
  128    H    GLY  16           H        GLY  16 -17.349   0.394   7.025
  129    HA2  GLY  16           2HA      GLY  16 -17.393   1.462   9.066
  130    HA3  GLY  16           3HA      GLY  16 -18.650   0.358   9.599
  131    H    LYS  17           H        LYS  17 -16.127  -1.503   8.452
  132    HA   LYS  17           HA       LYS  17 -15.005  -1.917  11.161
  133    HB2  LYS  17           2HB      LYS  17 -15.408  -3.932   8.899
  134    HB3  LYS  17           3HB      LYS  17 -14.579  -4.277  10.416
  135    HG2  LYS  17           2HG      LYS  17 -16.688  -3.813  11.657
  136    HG3  LYS  17           3HG      LYS  17 -17.503  -3.522  10.117
  137    HD2  LYS  17           2HD      LYS  17 -17.969  -5.796  10.939
  138    HD3  LYS  17           3HD      LYS  17 -17.067  -5.849   9.422
  139    HE2  LYS  17           2HE      LYS  17 -14.984  -6.291  10.676
  140    HE3  LYS  17           3HE      LYS  17 -15.880  -6.218  12.198
  141    HZ1  LYS  17           3HZ      LYS  17 -17.196  -8.117  11.445
  142    HZ2  LYS  17           1HZ      LYS  17 -15.551  -8.489  11.512
  143    HZ3  LYS  17           2HZ      LYS  17 -16.292  -8.202  10.023
  144    H    THR  18           H        THR  18 -12.784  -2.805  11.185
  145    HA   THR  18           HA       THR  18 -11.110  -1.796   8.955
  146    HB   THR  18           HB       THR  18 -10.485  -1.976  11.943
  147    HG1  THR  18           HG1      THR  18 -11.695  -0.113  10.571
  148   HG21  THR  18          3HG2      THR  18  -8.327  -0.889  11.398
  149   HG22  THR  18          1HG2      THR  18  -8.678  -1.042   9.676
  150   HG23  THR  18          2HG2      THR  18  -8.433  -2.488  10.662
  151    H    TYR  19           H        TYR  19 -10.206  -3.340   7.817
  152    HA   TYR  19           HA       TYR  19  -9.549  -6.003   8.940
  153    HB2  TYR  19           2HB      TYR  19  -9.764  -5.300   5.967
  154    HB3  TYR  19           3HB      TYR  19  -9.762  -6.899   6.703
  155    HD1  TYR  19           HD2      TYR  19 -11.789  -3.917   5.953
  156    HD2  TYR  19           HD1      TYR  19 -11.851  -7.826   7.686
  157    HE1  TYR  19           HE2      TYR  19 -14.233  -3.878   5.952
  158    HE2  TYR  19           HE1      TYR  19 -14.320  -7.777   7.684
  159    HH   TYR  19           HH       TYR  19 -16.103  -5.293   6.045
  160    H    GLU  20           H        GLU  20  -7.344  -6.272   9.260
  161    HA   GLU  20           HA       GLU  20  -5.462  -4.924   7.462
  162    HB2  GLU  20           2HB      GLU  20  -4.138  -3.959   9.297
  163    HB3  GLU  20           3HB      GLU  20  -5.760  -3.285   9.233
  164    HG2  GLU  20           2HG      GLU  20  -6.433  -4.704  11.144
  165    HG3  GLU  20           3HG      GLU  20  -4.805  -5.387  11.205
  166    H    ARG  21           H        ARG  21  -3.270  -5.627   7.656
  167    HA   ARG  21           HA       ARG  21  -2.534  -8.050   8.969
  168    HB2  ARG  21           2HB      ARG  21  -4.143  -8.974   7.307
  169    HB3  ARG  21           3HB      ARG  21  -3.260  -8.208   5.996
  170    HG2  ARG  21           2HG      ARG  21  -1.392  -9.699   6.277
  171    HG3  ARG  21           3HG      ARG  21  -2.049 -10.344   7.783
  172    HD2  ARG  21           2HD      ARG  21  -2.354 -11.870   5.822
  173    HD3  ARG  21           3HD      ARG  21  -3.878 -11.418   6.593
  174    HE   ARG  21           HE       ARG  21  -3.524  -9.586   4.580
  175   HH11  ARG  21          1HH1      ARG  21  -3.818 -13.111   4.645
  176   HH12  ARG  21          2HH1      ARG  21  -4.504 -13.183   3.053
  177   HH21  ARG  21          1HH2      ARG  21  -4.349  -9.730   2.495
  178   HH22  ARG  21          2HH2      ARG  21  -4.802 -11.273   1.838
  179    H    THR  22           H        THR  22  -0.340  -8.185   8.965
  180    HA   THR  22           HA       THR  22   1.213  -6.156   7.528
  181    HB   THR  22           HB       THR  22   2.084  -8.094   9.727
  182    HG1  THR  22           HG1      THR  22   0.680  -5.760   9.795
  183   HG21  THR  22          3HG2      THR  22   3.999  -7.315   8.361
  184   HG22  THR  22          1HG2      THR  22   4.043  -6.584   9.968
  185   HG23  THR  22          2HG2      THR  22   3.484  -5.642   8.583
  186    H    TYR  23           H        TYR  23   2.143  -6.672   5.664
  187    HA   TYR  23           HA       TYR  23   2.604  -9.472   4.849
  188    HB2  TYR  23           2HB      TYR  23   2.631  -6.912   3.160
  189    HB3  TYR  23           3HB      TYR  23   2.675  -8.568   2.553
  190    HD1  TYR  23           HD2      TYR  23   0.621  -9.992   2.656
  191    HD2  TYR  23           HD1      TYR  23   0.512  -5.894   3.856
  192    HE1  TYR  23           HE2      TYR  23  -1.839 -10.024   2.566
  193    HE2  TYR  23           HE1      TYR  23  -1.942  -5.928   3.776
  194    HH   TYR  23           HH       TYR  23  -3.743  -7.158   2.734
  195    H    GLN  24           H        GLN  24   4.674 -10.180   4.428
  196    HA   GLN  24           HA       GLN  24   6.934  -8.279   4.832
  197    HB2  GLN  24           2HB      GLN  24   6.872 -11.339   4.964
  198    HB3  GLN  24           3HB      GLN  24   8.362 -10.414   4.915
  199    HG2  GLN  24           2HG      GLN  24   7.921 -11.068   7.193
  200    HG3  GLN  24           3HG      GLN  24   7.740  -9.319   7.063
  201   HE21  GLN  24          1HE2      GLN  24   5.740  -8.408   7.503
  202   HE22  GLN  24          2HE2      GLN  24   4.385  -9.308   8.085
  203    H    LEU  25           H        LEU  25   7.508  -7.414   2.949
  204    HA   LEU  25           HA       LEU  25   7.284  -8.961   0.441
  205    HB2  LEU  25           2HB      LEU  25   7.116  -5.939   0.842
  206    HB3  LEU  25           3HB      LEU  25   7.019  -6.765  -0.707
  207    HG   LEU  25           HG       LEU  25   4.985  -6.875   1.560
  208   HD11  LEU  25          1HD1      LEU  25   3.440  -5.870  -0.068
  209   HD12  LEU  25          2HD1      LEU  25   4.739  -5.785  -1.262
  210   HD13  LEU  25          3HD1      LEU  25   4.843  -4.844   0.228
  211   HD21  LEU  25          3HD2      LEU  25   4.942  -8.470  -1.034
  212   HD22  LEU  25          1HD2      LEU  25   3.598  -8.339   0.106
  213   HD23  LEU  25          2HD2      LEU  25   5.098  -9.117   0.601
  214    H    TYR  26           H        TYR  26   9.290  -9.842   0.360
  215    HA   TYR  26           HA       TYR  26  11.685  -8.141   0.410
  216    HB2  TYR  26           2HB      TYR  26  11.969 -10.300   1.497
  217    HB3  TYR  26           3HB      TYR  26  11.331 -11.160   0.099
  218    HD1  TYR  26           HD1      TYR  26  14.193  -8.889   1.081
  219    HD2  TYR  26           HD2      TYR  26  12.873 -12.039  -1.503
  220    HE1  TYR  26           HE1      TYR  26  16.454  -9.068   0.133
  221    HE2  TYR  26           HE2      TYR  26  15.144 -12.218  -2.434
  222    HH   TYR  26           HH       TYR  26  17.131 -10.877  -2.684
  223    H    ALA  27           H        ALA  27  12.858  -7.643  -1.394
  224    HA   ALA  27           HA       ALA  27  12.130  -8.697  -4.040
  225    HB1  ALA  27           3HB      ALA  27  12.104  -6.373  -4.957
  226    HB2  ALA  27           1HB      ALA  27  12.217  -5.738  -3.314
  227    HB3  ALA  27           2HB      ALA  27  10.791  -6.654  -3.815
  228    H    VAL  28           H        VAL  28  13.787  -7.930  -5.673
  229    HA   VAL  28           HA       VAL  28  16.507  -7.788  -4.509
  230    HB   VAL  28           HB       VAL  28  15.704  -8.402  -7.402
  231   HG11  VAL  28          1HG1      VAL  28  18.039  -9.179  -7.687
  232   HG12  VAL  28          2HG1      VAL  28  18.413  -8.690  -6.033
  233   HG13  VAL  28          3HG1      VAL  28  17.980  -7.474  -7.235
  234   HG21  VAL  28          3HG2      VAL  28  14.900 -10.180  -5.898
  235   HG22  VAL  28          1HG2      VAL  28  16.520 -10.360  -5.213
  236   HG23  VAL  28          2HG2      VAL  28  16.222 -10.768  -6.905
  237    H    ARG  29           H        ARG  29  14.174  -6.055  -6.476
  238    HA   ARG  29           HA       ARG  29  15.883  -3.632  -6.460
  239    HB2  ARG  29           2HB      ARG  29  14.001  -4.476  -8.714
  240    HB3  ARG  29           3HB      ARG  29  14.926  -2.984  -8.654
  241    HG2  ARG  29           2HG      ARG  29  17.015  -4.231  -8.902
  242    HG3  ARG  29           3HG      ARG  29  16.133  -5.760  -8.842
  243    HD2  ARG  29           2HD      ARG  29  14.943  -5.180 -10.909
  244    HD3  ARG  29           3HD      ARG  29  15.756  -3.611 -10.955
  245    HE   ARG  29           HE       ARG  29  17.599  -5.809 -10.948
  246   HH11  ARG  29          1HH1      ARG  29  15.493  -3.901 -13.051
  247   HH12  ARG  29          2HH1      ARG  29  16.417  -4.251 -14.479
  248   HH21  ARG  29          1HH2      ARG  29  18.810  -6.210 -12.834
  249   HH22  ARG  29          2HH2      ARG  29  18.285  -5.551 -14.351
  250    H    ASP  30           H        ASP  30  14.430  -1.642  -6.886
  251    HA   ASP  30           HA       ASP  30  12.217  -1.548  -5.060
  252    HB2  ASP  30           2HB      ASP  30  12.034   0.809  -5.672
  253    HB3  ASP  30           3HB      ASP  30  13.737   0.412  -5.476
  254    H    GLU  31           H        GLU  31  12.593  -1.694  -8.578
  255    HA   GLU  31           HA       GLU  31   9.918  -1.230  -9.368
  256    HB2  GLU  31           2HB      GLU  31  10.612  -2.156 -11.563
  257    HB3  GLU  31           3HB      GLU  31  11.784  -1.004 -10.939
  258    HG2  GLU  31           2HG      GLU  31  13.226  -2.863 -10.200
  259    HG3  GLU  31           3HG      GLU  31  12.058  -4.022 -10.824
  260    H    GLU  32           H        GLU  32  11.522  -4.097  -8.186
  261    HA   GLU  32           HA       GLU  32   9.699  -6.090  -9.073
  262    HB2  GLU  32           2HB      GLU  32  11.548  -6.110  -6.646
  263    HB3  GLU  32           3HB      GLU  32  10.760  -7.528  -7.331
  264    HG2  GLU  32           2HG      GLU  32  12.890  -5.825  -8.633
  265    HG3  GLU  32           3HG      GLU  32  13.081  -7.461  -8.015
  266    H    LEU  33           H        LEU  33   9.761  -3.922  -6.330
  267    HA   LEU  33           HA       LEU  33   7.873  -5.255  -4.670
  268    HB2  LEU  33           2HB      LEU  33   9.648  -3.139  -4.336
  269    HB3  LEU  33           3HB      LEU  33   8.120  -2.293  -4.342
  270    HG   LEU  33           HG       LEU  33   8.775  -2.738  -2.047
  271   HD11  LEU  33          1HD1      LEU  33   6.370  -2.874  -2.459
  272   HD12  LEU  33          2HD1      LEU  33   6.857  -3.935  -1.140
  273   HD13  LEU  33          3HD1      LEU  33   6.496  -4.615  -2.732
  274   HD21  LEU  33          3HD2      LEU  33   9.137  -4.986  -1.123
  275   HD22  LEU  33          1HD2      LEU  33  10.290  -4.636  -2.411
  276   HD23  LEU  33          2HD2      LEU  33   8.918  -5.699  -2.724
  277    H    LYS  34           H        LYS  34   7.505  -3.282  -7.509
  278    HA   LYS  34           HA       LYS  34   5.018  -2.071  -7.155
  279    HB2  LYS  34           2HB      LYS  34   6.347  -3.116  -9.686
  280    HB3  LYS  34           3HB      LYS  34   4.779  -2.321  -9.710
  281    HG2  LYS  34           2HG      LYS  34   5.967  -0.342  -8.527
  282    HG3  LYS  34           3HG      LYS  34   7.472  -1.134  -9.012
  283    HD2  LYS  34           2HD      LYS  34   6.769   0.587 -10.660
  284    HD3  LYS  34           3HD      LYS  34   6.795  -1.026 -11.381
  285    HE2  LYS  34           2HE      LYS  34   4.328  -1.187 -11.060
  286    HE3  LYS  34           3HE      LYS  34   4.318   0.443 -10.393
  287    HZ1  LYS  34           3HZ      LYS  34   5.210   1.212 -12.556
  288    HZ2  LYS  34           1HZ      LYS  34   3.665   0.538 -12.655
  289    HZ3  LYS  34           2HZ      LYS  34   5.007  -0.349 -13.166
  290    H    GLU  35           H        GLU  35   5.624  -5.169  -8.875
  291    HA   GLU  35           HA       GLU  35   2.965  -5.870  -9.335
  292    HB2  GLU  35           2HB      GLU  35   3.759  -8.120  -9.856
  293    HB3  GLU  35           3HB      GLU  35   4.897  -6.936 -10.486
  294    HG2  GLU  35           2HG      GLU  35   6.463  -7.393  -8.686
  295    HG3  GLU  35           3HG      GLU  35   5.305  -8.458  -7.891
  296    H    LYS  36           H        LYS  36   4.953  -6.350  -6.515
  297    HA   LYS  36           HA       LYS  36   3.410  -8.307  -5.168
  298    HB2  LYS  36           2HB      LYS  36   5.314  -6.220  -3.999
  299    HB3  LYS  36           3HB      LYS  36   4.784  -7.704  -3.201
  300    HG2  LYS  36           2HG      LYS  36   5.904  -9.059  -4.924
  301    HG3  LYS  36           3HG      LYS  36   6.396  -7.590  -5.773
  302    HD2  LYS  36           2HD      LYS  36   7.749  -6.931  -3.770
  303    HD3  LYS  36           3HD      LYS  36   7.319  -8.467  -3.003
  304    HE2  LYS  36           2HE      LYS  36   8.840  -8.156  -5.620
  305    HE3  LYS  36           3HE      LYS  36   9.549  -8.557  -4.058
  306    HZ1  LYS  36           3HZ      LYS  36   8.240 -10.599  -4.041
  307    HZ2  LYS  36           1HZ      LYS  36   9.239 -10.526  -5.404
  308    HZ3  LYS  36           2HZ      LYS  36   7.586 -10.211  -5.547
  309    H    LEU  37           H        LEU  37   3.579  -4.756  -4.889
  310    HA   LEU  37           HA       LEU  37   1.537  -4.393  -2.984
  311    HB2  LEU  37           2HB      LEU  37   2.597  -2.505  -5.123
  312    HB3  LEU  37           3HB      LEU  37   1.482  -2.010  -3.856
  313    HG   LEU  37           HG       LEU  37   4.273  -3.118  -3.355
  314   HD11  LEU  37          1HD1      LEU  37   3.306  -0.248  -3.243
  315   HD12  LEU  37          2HD1      LEU  37   4.373  -0.942  -4.464
  316   HD13  LEU  37          3HD1      LEU  37   4.911  -0.824  -2.791
  317   HD21  LEU  37          3HD2      LEU  37   3.927  -2.385  -1.030
  318   HD22  LEU  37          1HD2      LEU  37   2.726  -3.587  -1.500
  319   HD23  LEU  37          2HD2      LEU  37   2.280  -1.881  -1.415
  320    H    LYS  38           H        LYS  38   1.371  -4.195  -6.592
  321    HA   LYS  38           HA       LYS  38  -1.330  -3.538  -6.837
  322    HB2  LYS  38           2HB      LYS  38   0.455  -5.107  -8.758
  323    HB3  LYS  38           3HB      LYS  38  -1.101  -4.395  -9.188
  324    HG2  LYS  38           2HG      LYS  38  -0.231  -2.145  -8.743
  325    HG3  LYS  38           3HG      LYS  38   1.304  -2.827  -8.205
  326    HD2  LYS  38           2HD      LYS  38   1.552  -1.971 -10.471
  327    HD3  LYS  38           3HD      LYS  38   1.690  -3.730 -10.493
  328    HE2  LYS  38           2HE      LYS  38  -0.642  -3.904 -11.295
  329    HE3  LYS  38           3HE      LYS  38  -0.793  -2.144 -11.252
  330    HZ1  LYS  38           3HZ      LYS  38  -0.314  -2.857 -13.474
  331    HZ2  LYS  38           1HZ      LYS  38   1.056  -3.710 -12.967
  332    HZ3  LYS  38           2HZ      LYS  38   1.030  -2.026 -12.873
  333    H    LYS  39           H        LYS  39   0.228  -6.750  -6.701
  334    HA   LYS  39           HA       LYS  39  -2.148  -8.273  -6.996
  335    HB2  LYS  39           2HB      LYS  39   0.570  -8.981  -5.822
  336    HB3  LYS  39           3HB      LYS  39  -0.744 -10.151  -5.900
  337    HG2  LYS  39           2HG      LYS  39   0.528  -8.751  -8.277
  338    HG3  LYS  39           3HG      LYS  39   0.830 -10.414  -7.783
  339    HD2  LYS  39           2HD      LYS  39  -1.845  -9.314  -8.753
  340    HD3  LYS  39           3HD      LYS  39  -0.720 -10.278  -9.712
  341    HE2  LYS  39           2HE      LYS  39  -1.035 -12.198  -8.253
  342    HE3  LYS  39           3HE      LYS  39  -2.032 -11.247  -7.152
  343    HZ1  LYS  39           3HZ      LYS  39  -2.723 -11.946  -9.957
  344    HZ2  LYS  39           1HZ      LYS  39  -3.672 -10.998  -8.922
  345    HZ3  LYS  39           2HZ      LYS  39  -3.390 -12.624  -8.563
  346    H    VAL  40           H        VAL  40  -0.343  -7.336  -4.024
  347    HA   VAL  40           HA       VAL  40  -1.997  -8.566  -2.138
  348    HB   VAL  40           HB       VAL  40  -0.129  -6.159  -1.933
  349   HG11  VAL  40          1HG1      VAL  40  -0.369  -6.183   0.535
  350   HG12  VAL  40          2HG1      VAL  40  -1.707  -7.326   0.389
  351   HG13  VAL  40          3HG1      VAL  40  -1.864  -5.697  -0.270
  352   HG21  VAL  40          3HG2      VAL  40   0.031  -8.976  -0.775
  353   HG22  VAL  40          1HG2      VAL  40   1.263  -7.719  -0.591
  354   HG23  VAL  40          2HG2      VAL  40   0.911  -8.385  -2.184
  355    H    LEU  41           H        LEU  41  -2.257  -5.312  -3.554
  356    HA   LEU  41           HA       LEU  41  -4.452  -4.466  -1.944
  357    HB2  LEU  41           2HB      LEU  41  -3.260  -3.365  -4.517
  358    HB3  LEU  41           3HB      LEU  41  -4.629  -2.605  -3.716
  359    HG   LEU  41           HG       LEU  41  -1.930  -3.041  -2.362
  360   HD11  LEU  41          1HD1      LEU  41  -2.964  -0.493  -3.642
  361   HD12  LEU  41          2HD1      LEU  41  -1.661  -1.513  -4.257
  362   HD13  LEU  41          3HD1      LEU  41  -1.463  -0.671  -2.723
  363   HD21  LEU  41          3HD2      LEU  41  -4.296  -1.320  -1.530
  364   HD22  LEU  41          1HD2      LEU  41  -2.752  -1.444  -0.684
  365   HD23  LEU  41          2HD2      LEU  41  -3.811  -2.847  -0.785
  366    H    ASN  42           H        ASN  42  -4.301  -5.591  -5.386
  367    HA   ASN  42           HA       ASN  42  -7.081  -5.408  -5.852
  368    HB2  ASN  42           2HB      ASN  42  -4.894  -6.941  -7.309
  369    HB3  ASN  42           3HB      ASN  42  -6.572  -6.972  -7.854
  370   HD21  ASN  42          1HD2      ASN  42  -4.166  -5.873  -9.157
  371   HD22  ASN  42          2HD2      ASN  42  -4.546  -4.231  -9.507
  372    H    GLU  43           H        GLU  43  -5.144  -8.223  -4.809
  373    HA   GLU  43           HA       GLU  43  -7.275 -10.100  -4.930
  374    HB2  GLU  43           2HB      GLU  43  -4.749 -10.228  -3.227
  375    HB3  GLU  43           3HB      GLU  43  -5.841 -11.566  -3.513
  376    HG2  GLU  43           2HG      GLU  43  -3.882 -10.284  -5.408
  377    HG3  GLU  43           3HG      GLU  43  -4.017 -11.975  -4.939
  378    H    ARG  44           H        ARG  44  -5.939  -8.126  -2.252
  379    HA   ARG  44           HA       ARG  44  -7.631  -9.229  -0.234
  380    HB2  ARG  44           2HB      ARG  44  -5.436  -8.103   0.262
  381    HB3  ARG  44           3HB      ARG  44  -6.155  -6.552  -0.159
  382    HG2  ARG  44           2HG      ARG  44  -6.077  -6.871   2.285
  383    HG3  ARG  44           3HG      ARG  44  -7.745  -6.757   1.716
  384    HD2  ARG  44           2HD      ARG  44  -7.764  -9.329   1.700
  385    HD3  ARG  44           3HD      ARG  44  -6.236  -9.245   2.576
  386    HE   ARG  44           HE       ARG  44  -7.355  -8.327   4.427
  387   HH11  ARG  44          1HH1      ARG  44  -9.626  -9.147   1.867
  388   HH12  ARG  44          2HH1      ARG  44 -11.000  -9.141   2.932
  389   HH21  ARG  44          1HH2      ARG  44  -9.140  -8.384   5.802
  390   HH22  ARG  44          2HH2      ARG  44 -10.719  -8.708   5.161
  391    H    MET  45           H        MET  45  -7.914  -6.467  -2.388
  392    HA   MET  45           HA       MET  45 -10.244  -5.399  -1.004
  393    HB2  MET  45           2HB      MET  45  -8.772  -4.436  -3.477
  394    HB3  MET  45           3HB      MET  45 -10.221  -3.664  -2.846
  395    HG2  MET  45           2HG      MET  45  -8.958  -3.390  -0.646
  396    HG3  MET  45           3HG      MET  45  -7.512  -3.858  -1.540
  397    HE1  MET  45           3HE      MET  45 -10.473  -1.245  -1.322
  398    HE2  MET  45           1HE      MET  45 -10.554  -1.798  -2.996
  399    HE3  MET  45           2HE      MET  45 -10.043  -0.149  -2.635
  400    H    ASP  46           H        ASP  46  -9.834  -7.779  -3.356
  401    HA   ASP  46           HA       ASP  46 -12.035  -7.309  -5.033
  402    HB2  ASP  46           2HB      ASP  46 -10.250  -8.970  -5.542
  403    HB3  ASP  46           3HB      ASP  46 -10.867 -10.024  -4.269
  404    HA   PRO  47           HA       PRO  47 -14.891  -9.663  -1.775
  405    HB2  PRO  47           2HB      PRO  47 -13.957  -9.906   0.797
  406    HB3  PRO  47           3HB      PRO  47 -13.716 -11.164  -0.435
  407    HG2  PRO  47           2HG      PRO  47 -11.811  -8.991   0.418
  408    HG3  PRO  47           3HG      PRO  47 -11.503 -10.735   0.231
  409    HD2  PRO  47           2HD      PRO  47 -10.804  -9.009  -1.697
  410    HD3  PRO  47           3HD      PRO  47 -11.476 -10.609  -2.115
  411    H    ILE  48           H        ILE  48 -12.815  -6.941  -1.030
  412    HA   ILE  48           HA       ILE  48 -14.594  -5.556   0.770
  413    HB   ILE  48           HB       ILE  48 -12.192  -4.631  -0.865
  414   HG12  ILE  48          2HG1      ILE  48 -11.609  -6.293   0.857
  415   HG13  ILE  48          3HG1      ILE  48 -10.943  -4.723   1.280
  416   HG21  ILE  48          1HG2      ILE  48 -13.598  -3.054   1.300
  417   HG22  ILE  48          2HG2      ILE  48 -13.594  -2.681  -0.422
  418   HG23  ILE  48          3HG2      ILE  48 -12.096  -2.603   0.500
  419   HD11  ILE  48          3HD1      ILE  48 -11.789  -5.865   3.231
  420   HD12  ILE  48          1HD1      ILE  48 -13.387  -6.009   2.500
  421   HD13  ILE  48          2HD1      ILE  48 -12.747  -4.418   2.924
  422    H    LYS  49           H        LYS  49 -14.032  -5.566  -2.736
  423    HA   LYS  49           HA       LYS  49 -15.880  -3.487  -3.436
  424    HB2  LYS  49           2HB      LYS  49 -14.725  -5.799  -5.059
  425    HB3  LYS  49           3HB      LYS  49 -15.589  -4.419  -5.732
  426    HG2  LYS  49           2HG      LYS  49 -13.826  -2.934  -5.342
  427    HG3  LYS  49           3HG      LYS  49 -13.127  -3.934  -4.075
  428    HD2  LYS  49           2HD      LYS  49 -11.663  -3.985  -5.993
  429    HD3  LYS  49           3HD      LYS  49 -12.389  -5.577  -5.798
  430    HE2  LYS  49           2HE      LYS  49 -13.453  -3.531  -7.747
  431    HE3  LYS  49           3HE      LYS  49 -12.187  -4.674  -8.172
  432    HZ1  LYS  49           3HZ      LYS  49 -14.270  -5.522  -8.892
  433    HZ2  LYS  49           1HZ      LYS  49 -14.972  -5.320  -7.371
  434    HZ3  LYS  49           2HZ      LYS  49 -13.759  -6.476  -7.597
  435    H    LYS  50           H        LYS  50 -15.981  -6.994  -3.035
  436    HA   LYS  50           HA       LYS  50 -18.639  -7.516  -3.794
  437    HB2  LYS  50           2HB      LYS  50 -16.809  -9.190  -3.516
  438    HB3  LYS  50           3HB      LYS  50 -16.856  -8.968  -1.780
  439    HG2  LYS  50           2HG      LYS  50 -19.322  -9.914  -3.245
  440    HG3  LYS  50           3HG      LYS  50 -18.019 -11.049  -2.919
  441    HD2  LYS  50           2HD      LYS  50 -19.591  -9.482  -0.832
  442    HD3  LYS  50           3HD      LYS  50 -19.774 -11.198  -1.204
  443    HE2  LYS  50           2HE      LYS  50 -17.388 -11.549  -0.496
  444    HE3  LYS  50           3HE      LYS  50 -17.325  -9.856  -0.003
  445    HZ1  LYS  50           3HZ      LYS  50 -19.167 -11.913   1.103
  446    HZ2  LYS  50           1HZ      LYS  50 -19.089 -10.296   1.592
  447    HZ3  LYS  50           2HZ      LYS  50 -17.778 -11.326   1.863
  448    H    LEU  51           H        LEU  51 -17.273  -6.169  -0.836
  449    HA   LEU  51           HA       LEU  51 -19.746  -6.255   0.682
  450    HB2  LEU  51           2HB      LEU  51 -17.209  -4.617   1.113
  451    HB3  LEU  51           3HB      LEU  51 -18.593  -4.579   2.196
  452    HG   LEU  51           HG       LEU  51 -16.774  -6.958   1.669
  453   HD11  LEU  51          1HD1      LEU  51 -15.763  -5.288   3.125
  454   HD12  LEU  51          2HD1      LEU  51 -16.166  -6.731   4.047
  455   HD13  LEU  51          3HD1      LEU  51 -17.182  -5.292   4.177
  456   HD21  LEU  51          3HD2      LEU  51 -19.056  -7.770   1.922
  457   HD22  LEU  51          1HD2      LEU  51 -19.259  -6.841   3.411
  458   HD23  LEU  51          2HD2      LEU  51 -18.109  -8.181   3.348
  459    H    GLY  52           H        GLY  52 -18.073  -3.998  -1.448
  460    HA2  GLY  52           2HA      GLY  52 -18.955  -2.335  -2.793
  461    HA3  GLY  52           3HA      GLY  52 -20.539  -2.609  -2.080
  462    H    CYS  53           H        CYS  53 -17.572  -1.930  -0.304
  463    HA   CYS  53           HA       CYS  53 -18.679   0.275   1.134
  464    HB2  CYS  53           2HB      CYS  53 -15.804  -0.682   0.885
  465    HB3  CYS  53           3HB      CYS  53 -16.390   0.492   2.067
  466    H    LYS  54           H        LYS  54 -19.209   2.015  -0.007
  467    HA   LYS  54           HA       LYS  54 -18.365   2.707  -2.566
  468    HB2  LYS  54           2HB      LYS  54 -19.664   4.487  -0.468
  469    HB3  LYS  54           3HB      LYS  54 -19.645   4.808  -2.203
  470    HG2  LYS  54           2HG      LYS  54 -21.048   2.877  -2.644
  471    HG3  LYS  54           3HG      LYS  54 -20.936   2.346  -0.964
  472    HD2  LYS  54           2HD      LYS  54 -22.299   4.903  -1.929
  473    HD3  LYS  54           3HD      LYS  54 -23.119   3.417  -1.437
  474    HE2  LYS  54           2HE      LYS  54 -22.197   3.660   0.843
  475    HE3  LYS  54           3HE      LYS  54 -21.376   5.145   0.356
  476    HZ1  LYS  54           3HZ      LYS  54 -24.311   4.695   0.451
  477    HZ2  LYS  54           1HZ      LYS  54 -23.576   6.104  -0.132
  478    HZ3  LYS  54           2HZ      LYS  54 -23.409   5.671   1.490
  479    H    ARG  55           H        ARG  55 -17.212   3.899   0.544
  480    HA   ARG  55           HA       ARG  55 -14.798   4.930  -0.833
  481    HB2  ARG  55           2HB      ARG  55 -16.044   6.831   0.204
  482    HB3  ARG  55           3HB      ARG  55 -16.023   6.001   1.759
  483    HG2  ARG  55           2HG      ARG  55 -13.428   6.083   1.558
  484    HG3  ARG  55           3HG      ARG  55 -13.694   7.259   0.267
  485    HD2  ARG  55           2HD      ARG  55 -13.273   8.372   2.408
  486    HD3  ARG  55           3HD      ARG  55 -14.917   8.715   1.858
  487    HE   ARG  55           HE       ARG  55 -15.552   6.795   3.415
  488   HH11  ARG  55          1HH1      ARG  55 -12.823   8.914   4.117
  489   HH12  ARG  55          2HH1      ARG  55 -12.955   8.693   5.834
  490   HH21  ARG  55          1HH2      ARG  55 -15.728   6.547   5.641
  491   HH22  ARG  55          2HH2      ARG  55 -14.606   7.349   6.694
  492    H    VAL  56           H        VAL  56 -12.924   4.023  -0.124
  493    HA   VAL  56           HA       VAL  56 -12.917   2.386   2.360
  494    HB   VAL  56           HB       VAL  56 -11.109   0.993   1.263
  495   HG11  VAL  56          1HG1      VAL  56 -12.635  -0.348  -0.139
  496   HG12  VAL  56          2HG1      VAL  56 -13.785   0.992  -0.192
  497   HG13  VAL  56          3HG1      VAL  56 -13.432   0.189   1.341
  498   HG21  VAL  56          3HG2      VAL  56 -11.898   2.502  -1.274
  499   HG22  VAL  56          1HG2      VAL  56 -10.837   1.091  -1.213
  500   HG23  VAL  56          2HG2      VAL  56 -10.342   2.598  -0.445
  501    H    ARG  57           H        ARG  57 -11.388   2.953   3.850
  502    HA   ARG  57           HA       ARG  57  -9.311   4.935   3.118
  503    HB2  ARG  57           2HB      ARG  57 -10.638   5.525   5.113
  504    HB3  ARG  57           3HB      ARG  57 -10.285   3.965   5.852
  505    HG2  ARG  57           2HG      ARG  57  -7.838   4.591   5.812
  506    HG3  ARG  57           3HG      ARG  57  -8.315   6.199   5.278
  507    HD2  ARG  57           2HD      ARG  57  -9.460   6.604   7.391
  508    HD3  ARG  57           3HD      ARG  57  -9.173   4.930   7.903
  509    HE   ARG  57           HE       ARG  57  -6.686   5.864   7.343
  510   HH11  ARG  57          1HH1      ARG  57  -9.188   7.018   9.537
  511   HH12  ARG  57          2HH1      ARG  57  -8.046   7.712  10.644
  512   HH21  ARG  57          1HH2      ARG  57  -5.227   6.753   8.780
  513   HH22  ARG  57          2HH2      ARG  57  -5.790   7.555  10.208
  514    H    ILE  58           H        ILE  58  -7.534   3.885   2.343
  515    HA   ILE  58           HA       ILE  58  -6.586   1.394   3.648
  516    HB   ILE  58           HB       ILE  58  -5.615   2.613   1.009
  517   HG12  ILE  58          2HG1      ILE  58  -7.647   0.347   1.330
  518   HG13  ILE  58          3HG1      ILE  58  -8.055   1.998   0.877
  519   HG21  ILE  58          1HG2      ILE  58  -5.238  -0.188   2.154
  520   HG22  ILE  58          2HG2      ILE  58  -4.008   1.074   2.078
  521   HG23  ILE  58          3HG2      ILE  58  -4.642   0.375   0.589
  522   HD11  ILE  58          3HD1      ILE  58  -8.008   0.573  -1.055
  523   HD12  ILE  58          1HD1      ILE  58  -6.345   0.094  -0.715
  524   HD13  ILE  58          2HD1      ILE  58  -6.713   1.764  -1.158
  525    H    SER  59           H        SER  59  -5.314   2.083   5.380
  526    HA   SER  59           HA       SER  59  -3.295   4.181   5.028
  527    HB2  SER  59           2HB      SER  59  -4.314   2.791   7.558
  528    HB3  SER  59           3HB      SER  59  -3.123   4.097   7.517
  529    HG   SER  59           HG       SER  59  -4.792   5.363   6.449
  530    H    ILE  60           H        ILE  60  -1.607   3.254   4.040
  531    HA   ILE  60           HA       ILE  60  -0.582   0.611   4.828
  532    HB   ILE  60           HB       ILE  60   0.176   2.480   2.525
  533   HG12  ILE  60          2HG1      ILE  60  -1.409  -0.135   2.474
  534   HG13  ILE  60          3HG1      ILE  60  -2.086   1.476   2.273
  535   HG21  ILE  60          1HG2      ILE  60   2.120   1.137   3.201
  536   HG22  ILE  60          2HG2      ILE  60   1.528   0.620   1.624
  537   HG23  ILE  60          3HG2      ILE  60   1.170  -0.345   3.058
  538   HD11  ILE  60          3HD1      ILE  60  -0.798   1.743   0.195
  539   HD12  ILE  60          1HD1      ILE  60  -1.899   0.366   0.152
  540   HD13  ILE  60          2HD1      ILE  60  -0.173   0.102   0.390
  541    H    ARG  61           H        ARG  61   0.721   0.798   6.627
  542    HA   ARG  61           HA       ARG  61   2.665   2.999   6.804
  543    HB2  ARG  61           2HB      ARG  61   1.452   2.233   8.902
  544    HB3  ARG  61           3HB      ARG  61   2.268   0.674   8.764
  545    HG2  ARG  61           2HG      ARG  61   4.469   1.850   8.937
  546    HG3  ARG  61           3HG      ARG  61   3.613   3.377   9.126
  547    HD2  ARG  61           2HD      ARG  61   2.591   2.478  11.238
  548    HD3  ARG  61           3HD      ARG  61   3.604   1.034  11.060
  549    HE   ARG  61           HE       ARG  61   5.044   3.545  10.961
  550   HH11  ARG  61          1HH1      ARG  61   3.918   1.029  13.155
  551   HH12  ARG  61          2HH1      ARG  61   5.087   1.424  14.379
  552   HH21  ARG  61          1HH2      ARG  61   6.544   4.061  12.554
  553   HH22  ARG  61          2HH2      ARG  61   6.575   3.146  14.036
  554    H    VAL  62           H        VAL  62   4.744   2.737   6.275
  555    HA   VAL  62           HA       VAL  62   5.702   0.148   5.252
  556    HB   VAL  62           HB       VAL  62   5.983   2.388   3.958
  557   HG11  VAL  62          1HG1      VAL  62   8.203   2.884   5.955
  558   HG12  VAL  62          2HG1      VAL  62   6.693   3.796   5.859
  559   HG13  VAL  62          3HG1      VAL  62   7.842   3.853   4.521
  560   HG21  VAL  62          3HG2      VAL  62   7.232   0.387   3.324
  561   HG22  VAL  62          1HG2      VAL  62   8.497   0.782   4.491
  562   HG23  VAL  62          2HG2      VAL  62   8.218   1.833   3.097
  563    H    LYS  63           H        LYS  63   7.564  -0.860   6.239
  564    HA   LYS  63           HA       LYS  63   7.885  -0.310   9.071
  565    HB2  LYS  63           2HB      LYS  63   7.850  -2.646   7.888
  566    HB3  LYS  63           3HB      LYS  63   9.529  -2.336   7.493
  567    HG2  LYS  63           2HG      LYS  63   8.458  -2.344  10.337
  568    HG3  LYS  63           3HG      LYS  63   9.085  -3.787   9.543
  569    HD2  LYS  63           2HD      LYS  63  11.305  -2.774   9.362
  570    HD3  LYS  63           3HD      LYS  63  10.702  -1.246  10.005
  571    HE2  LYS  63           2HE      LYS  63  10.804  -3.878  11.525
  572    HE3  LYS  63           3HE      LYS  63  11.939  -2.537  11.712
  573    HZ1  LYS  63           3HZ      LYS  63  10.034  -1.144  12.393
  574    HZ2  LYS  63           1HZ      LYS  63  10.315  -2.439  13.434
  575    HZ3  LYS  63           2HZ      LYS  63   9.039  -2.509  12.339
  576    H    HIS  64           H        HIS  64   9.412   0.883   9.929
  577    HA   HIS  64           HA       HIS  64  11.436   2.198   8.268
  578    HB2  HIS  64           2HB      HIS  64  10.295   2.816  11.035
  579    HB3  HIS  64           3HB      HIS  64  11.662   3.686  10.347
  580    HD1  HIS  64           HD1      HIS  64  10.365   5.905  10.353
  581    HD2  HIS  64           HD2      HIS  64   8.581   2.948   8.036
  582    HE1  HIS  64           HE1      HIS  64   8.690   7.095   8.907
  583    HE2  HIS  64           HE2      HIS  64   7.458   5.245   7.734
  584    H    SER  65           H        SER  65  13.220   1.006   8.142
  585    HA   SER  65           HA       SER  65  14.099  -0.978   9.940
  586    HB2  SER  65           2HB      SER  65  16.240  -0.788   8.516
  587    HB3  SER  65           3HB      SER  65  14.744  -1.121   7.639
  588    HG   SER  65           HG       SER  65  15.953   0.556   6.647
  589    H    ASP  66           H        ASP  66  15.096   2.369   9.435
  590    HA   ASP  66           HA       ASP  66  15.998   2.781  12.128
  591    HB2  ASP  66           2HB      ASP  66  18.009   1.639  11.339
  592    HB3  ASP  66           3HB      ASP  66  18.064   2.618   9.883
  593    H    ALA  67           H        ALA  67  16.623   5.106  12.439
  594    HA   ALA  67           HA       ALA  67  14.736   6.788  11.197
  595    HB1  ALA  67           3HB      ALA  67  17.114   7.605  12.903
  596    HB2  ALA  67           1HB      ALA  67  15.523   7.130  13.495
  597    HB3  ALA  67           2HB      ALA  67  15.699   8.601  12.539
  598    H    ALA  68           H        ALA  68  18.091   6.183  10.369
  599    HA   ALA  68           HA       ALA  68  18.290   8.416   8.486
  600    HB1  ALA  68           3HB      ALA  68  20.294   7.717   9.739
  601    HB2  ALA  68           1HB      ALA  68  20.545   7.516   8.006
  602    HB3  ALA  68           2HB      ALA  68  20.207   6.108   9.020
  603    H    GLU  69           H        GLU  69  18.005   4.878   8.420
  604    HA   GLU  69           HA       GLU  69  18.302   4.534   5.606
  605    HB2  GLU  69           2HB      GLU  69  17.042   2.620   7.614
  606    HB3  GLU  69           3HB      GLU  69  17.659   2.201   6.022
  607    HG2  GLU  69           2HG      GLU  69  19.314   3.178   8.366
  608    HG3  GLU  69           3HG      GLU  69  19.183   1.509   7.819
  609    H    GLU  70           H        GLU  70  15.540   5.170   7.644
  610    HA   GLU  70           HA       GLU  70  13.453   4.201   5.966
  611    HB2  GLU  70           2HB      GLU  70  11.920   5.497   7.401
  612    HB3  GLU  70           3HB      GLU  70  13.097   4.633   8.388
  613    HG2  GLU  70           2HG      GLU  70  14.346   6.649   8.819
  614    HG3  GLU  70           3HG      GLU  70  13.429   7.543   7.614
  615    H    LYS  71           H        LYS  71  15.317   7.167   6.000
  616    HA   LYS  71           HA       LYS  71  13.457   8.851   4.642
  617    HB2  LYS  71           2HB      LYS  71  16.491   9.144   4.701
  618    HB3  LYS  71           3HB      LYS  71  15.321  10.410   4.337
  619    HG2  LYS  71           2HG      LYS  71  15.779   9.052   7.008
  620    HG3  LYS  71           3HG      LYS  71  16.147  10.727   6.589
  621    HD2  LYS  71           2HD      LYS  71  13.712  11.188   6.341
  622    HD3  LYS  71           3HD      LYS  71  13.354   9.508   6.750
  623    HE2  LYS  71           2HE      LYS  71  14.479   9.899   8.984
  624    HE3  LYS  71           3HE      LYS  71  14.589  11.610   8.564
  625    HZ1  LYS  71           3HZ      LYS  71  12.645  11.094   9.934
  626    HZ2  LYS  71           1HZ      LYS  71  12.058  10.054   8.737
  627    HZ3  LYS  71           2HZ      LYS  71  12.193  11.712   8.430
  628    H    LYS  72           H        LYS  72  15.978   6.631   3.595
  629    HA   LYS  72           HA       LYS  72  15.715   7.149   0.782
  630    HB2  LYS  72           2HB      LYS  72  17.766   6.111   1.760
  631    HB3  LYS  72           3HB      LYS  72  16.840   4.686   2.212
  632    HG2  LYS  72           2HG      LYS  72  18.198   4.333   0.165
  633    HG3  LYS  72           3HG      LYS  72  16.473   4.119  -0.130
  634    HD2  LYS  72           2HD      LYS  72  17.405   5.316  -2.006
  635    HD3  LYS  72           3HD      LYS  72  16.401   6.443  -1.102
  636    HE2  LYS  72           2HE      LYS  72  19.435   6.314  -0.837
  637    HE3  LYS  72           3HE      LYS  72  18.599   7.390  -1.952
  638    HZ1  LYS  72           3HZ      LYS  72  19.128   8.611  -0.006
  639    HZ2  LYS  72           1HZ      LYS  72  18.465   7.435   1.015
  640    HZ3  LYS  72           2HZ      LYS  72  17.459   8.354   0.020
  641    H    GLU  73           H        GLU  73  14.588   4.530   2.950
  642    HA   GLU  73           HA       GLU  73  13.418   2.998   0.878
  643    HB2  GLU  73           2HB      GLU  73  13.193   2.768   3.908
  644    HB3  GLU  73           3HB      GLU  73  12.493   1.602   2.791
  645    HG2  GLU  73           2HG      GLU  73  15.435   2.253   3.098
  646    HG3  GLU  73           3HG      GLU  73  14.622   0.774   3.618
  647    H    ALA  74           H        ALA  74  12.007   5.442   2.997
  648    HA   ALA  74           HA       ALA  74   9.263   4.659   2.493
  649    HB1  ALA  74           3HB      ALA  74   9.857   5.736   4.624
  650    HB2  ALA  74           1HB      ALA  74   8.639   6.670   3.758
  651    HB3  ALA  74           2HB      ALA  74  10.322   7.209   3.770
  652    H    LYS  75           H        LYS  75  11.414   7.296   1.415
  653    HA   LYS  75           HA       LYS  75   9.597   8.555  -0.375
  654    HB2  LYS  75           2HB      LYS  75  11.690   9.610   0.570
  655    HB3  LYS  75           3HB      LYS  75  12.652   8.577  -0.479
  656    HG2  LYS  75           2HG      LYS  75  12.466  10.824  -1.425
  657    HG3  LYS  75           3HG      LYS  75  11.648   9.658  -2.471
  658    HD2  LYS  75           2HD      LYS  75   9.463  10.337  -1.504
  659    HD3  LYS  75           3HD      LYS  75  10.284  11.506  -0.467
  660    HE2  LYS  75           2HE      LYS  75  11.047  12.742  -2.464
  661    HE3  LYS  75           3HE      LYS  75  10.250  11.556  -3.505
  662    HZ1  LYS  75           3HZ      LYS  75   8.911  13.351  -1.550
  663    HZ2  LYS  75           1HZ      LYS  75   8.127  12.161  -2.458
  664    HZ3  LYS  75           2HZ      LYS  75   8.851  13.477  -3.234
  665    H    LYS  76           H        LYS  76  12.040   6.080  -0.820
  666    HA   LYS  76           HA       LYS  76  11.913   5.512  -3.565
  667    HB2  LYS  76           2HB      LYS  76  13.674   4.592  -2.239
  668    HB3  LYS  76           3HB      LYS  76  12.561   3.918  -1.065
  669    HG2  LYS  76           2HG      LYS  76  11.876   2.211  -2.777
  670    HG3  LYS  76           3HG      LYS  76  13.134   2.848  -3.850
  671    HD2  LYS  76           2HD      LYS  76  14.874   2.301  -2.221
  672    HD3  LYS  76           3HD      LYS  76  13.665   1.825  -1.027
  673    HE2  LYS  76           2HE      LYS  76  13.005  -0.070  -2.484
  674    HE3  LYS  76           3HE      LYS  76  14.263   0.401  -3.635
  675    HZ1  LYS  76           3HZ      LYS  76  14.808  -0.258  -0.792
  676    HZ2  LYS  76           1HZ      LYS  76  15.938  -0.026  -2.030
  677    HZ3  LYS  76           2HZ      LYS  76  14.924  -1.373  -2.059
  678    H    PHE  77           H        PHE  77  10.117   4.145  -0.817
  679    HA   PHE  77           HA       PHE  77   8.511   2.319  -2.313
  680    HB2  PHE  77           2HB      PHE  77   9.151   2.095   0.123
  681    HB3  PHE  77           3HB      PHE  77   8.061   3.418   0.504
  682    HD1  PHE  77           HD1      PHE  77   8.033   0.089  -1.252
  683    HD2  PHE  77           HD2      PHE  77   5.918   2.813   1.281
  684    HE1  PHE  77           HE1      PHE  77   6.242  -1.556  -0.957
  685    HE2  PHE  77           HE2      PHE  77   4.128   1.149   1.571
  686    HZ   PHE  77           HZ       PHE  77   4.294  -1.036   0.459
  687    H    ALA  78           H        ALA  78   8.199   5.657  -1.332
  688    HA   ALA  78           HA       ALA  78   5.408   6.044  -1.689
  689    HB1  ALA  78           3HB      ALA  78   6.812   7.623  -0.427
  690    HB2  ALA  78           1HB      ALA  78   5.955   8.447  -1.729
  691    HB3  ALA  78           2HB      ALA  78   7.672   8.066  -1.903
  692    H    ALA  79           H        ALA  79   8.232   6.502  -3.828
  693    HA   ALA  79           HA       ALA  79   6.901   7.407  -6.142
  694    HB1  ALA  79           3HB      ALA  79   9.508   5.851  -5.915
  695    HB2  ALA  79           1HB      ALA  79   9.338   7.603  -5.817
  696    HB3  ALA  79           2HB      ALA  79   8.975   6.767  -7.329
  697    H    ILE  80           H        ILE  80   7.781   4.133  -5.037
  698    HA   ILE  80           HA       ILE  80   6.798   2.628  -7.217
  699    HB   ILE  80           HB       ILE  80   7.055   1.808  -4.278
  700   HG12  ILE  80          2HG1      ILE  80   9.198   2.526  -5.239
  701   HG13  ILE  80          3HG1      ILE  80   9.220   0.787  -4.987
  702   HG21  ILE  80          1HG2      ILE  80   7.096  -0.540  -5.065
  703   HG22  ILE  80          2HG2      ILE  80   6.755  -0.000  -6.710
  704   HG23  ILE  80          3HG2      ILE  80   5.556   0.240  -5.440
  705   HD11  ILE  80          3HD1      ILE  80   8.807   0.454  -7.393
  706   HD12  ILE  80          1HD1      ILE  80  10.278   1.371  -7.075
  707   HD13  ILE  80          2HD1      ILE  80   8.829   2.206  -7.627
  708    H    LEU  81           H        LEU  81   5.212   3.787  -4.244
  709    HA   LEU  81           HA       LEU  81   2.735   2.439  -4.535
  710    HB2  LEU  81           2HB      LEU  81   3.607   4.880  -2.957
  711    HB3  LEU  81           3HB      LEU  81   1.930   4.374  -2.959
  712    HG   LEU  81           HG       LEU  81   4.254   2.669  -1.970
  713   HD11  LEU  81          1HD1      LEU  81   3.369   3.093   0.285
  714   HD12  LEU  81          2HD1      LEU  81   2.157   4.192  -0.382
  715   HD13  LEU  81          3HD1      LEU  81   3.874   4.585  -0.506
  716   HD21  LEU  81          3HD2      LEU  81   2.531   1.151  -1.087
  717   HD22  LEU  81          1HD2      LEU  81   2.418   1.287  -2.841
  718   HD23  LEU  81          2HD2      LEU  81   1.263   2.139  -1.816
  719    H    ASN  82           H        ASN  82   3.927   5.591  -5.651
  720    HA   ASN  82           HA       ASN  82   1.556   6.789  -6.580
  721    HB2  ASN  82           2HB      ASN  82   4.420   7.025  -7.641
  722    HB3  ASN  82           3HB      ASN  82   3.096   8.055  -8.188
  723   HD21  ASN  82          1HD2      ASN  82   5.630   8.615  -6.709
  724   HD22  ASN  82          2HD2      ASN  82   5.122   9.519  -5.327
  725    H    LYS  83           H        LYS  83   3.847   4.609  -8.173
  726    HA   LYS  83           HA       LYS  83   2.637   4.596 -10.743
  727    HB2  LYS  83           2HB      LYS  83   4.406   2.429  -9.531
  728    HB3  LYS  83           3HB      LYS  83   4.114   2.702 -11.242
  729    HG2  LYS  83           2HG      LYS  83   5.709   4.443  -9.346
  730    HG3  LYS  83           3HG      LYS  83   6.332   3.450 -10.654
  731    HD2  LYS  83           2HD      LYS  83   6.404   5.481 -11.739
  732    HD3  LYS  83           3HD      LYS  83   4.728   5.087 -12.121
  733    HE2  LYS  83           2HE      LYS  83   4.033   6.426 -10.109
  734    HE3  LYS  83           3HE      LYS  83   5.721   6.884  -9.882
  735    HZ1  LYS  83           3HZ      LYS  83   3.996   7.549 -12.209
  736    HZ2  LYS  83           1HZ      LYS  83   5.650   7.870 -12.130
  737    HZ3  LYS  83           2HZ      LYS  83   4.600   8.614 -11.042
  738    H    VAL  84           H        VAL  84   2.291   2.549  -7.879
  739    HA   VAL  84           HA       VAL  84   0.744   0.452  -9.028
  740    HB   VAL  84           HB       VAL  84   1.187   1.360  -6.139
  741   HG11  VAL  84          1HG1      VAL  84  -0.297  -1.138  -7.042
  742   HG12  VAL  84          2HG1      VAL  84  -0.987   0.236  -6.179
  743   HG13  VAL  84          3HG1      VAL  84   0.206  -0.792  -5.385
  744   HG21  VAL  84          3HG2      VAL  84   3.167   0.447  -7.306
  745   HG22  VAL  84          1HG2      VAL  84   2.281  -1.030  -7.683
  746   HG23  VAL  84          2HG2      VAL  84   2.656  -0.627  -6.005
  747    H    PHE  85           H        PHE  85  -0.179   3.181  -6.907
  748    HA   PHE  85           HA       PHE  85  -2.955   2.759  -6.864
  749    HB2  PHE  85           2HB      PHE  85  -1.461   5.394  -6.489
  750    HB3  PHE  85           3HB      PHE  85  -3.145   5.119  -6.055
  751    HD1  PHE  85           HD1      PHE  85  -2.781   2.294  -4.844
  752    HD2  PHE  85           HD2      PHE  85  -0.625   5.960  -4.321
  753    HE1  PHE  85           HE1      PHE  85  -2.098   1.584  -2.587
  754    HE2  PHE  85           HE2      PHE  85   0.048   5.230  -2.073
  755    HZ   PHE  85           HZ       PHE  85  -0.686   3.048  -1.206
  756    H    ALA  86           H        ALA  86  -0.943   4.694  -9.049
  757    HA   ALA  86           HA       ALA  86  -2.964   5.997 -10.540
  758    HB1  ALA  86           3HB      ALA  86  -1.215   6.398 -12.226
  759    HB2  ALA  86           1HB      ALA  86  -0.172   5.200 -11.442
  760    HB3  ALA  86           2HB      ALA  86  -0.596   6.690 -10.600
  761    H    GLU  87           H        GLU  87  -1.621   2.758 -10.752
  762    HA   GLU  87           HA       GLU  87  -2.956   2.129 -13.282
  763    HB2  GLU  87           2HB      GLU  87  -1.224   0.434 -11.431
  764    HB3  GLU  87           3HB      GLU  87  -1.903  -0.132 -12.959
  765    HG2  GLU  87           2HG      GLU  87  -0.639   1.668 -14.152
  766    HG3  GLU  87           3HG      GLU  87   0.084   2.137 -12.614
  767    H    LEU  88           H        LEU  88  -3.924   2.276 -10.070
  768    HA   LEU  88           HA       LEU  88  -5.834   0.013 -10.309
  769    HB2  LEU  88           2HB      LEU  88  -5.003   1.483  -7.773
  770    HB3  LEU  88           3HB      LEU  88  -6.101   0.115  -7.867
  771    HG   LEU  88           HG       LEU  88  -3.104   0.092  -8.352
  772   HD11  LEU  88          1HD1      LEU  88  -3.011  -1.411  -6.430
  773   HD12  LEU  88          2HD1      LEU  88  -4.763  -1.299  -6.237
  774   HD13  LEU  88          3HD1      LEU  88  -3.754   0.130  -5.998
  775   HD21  LEU  88          3HD2      LEU  88  -5.021  -2.225  -8.719
  776   HD22  LEU  88          1HD2      LEU  88  -3.258  -2.328  -8.756
  777   HD23  LEU  88          2HD2      LEU  88  -4.112  -1.405  -9.990
  778    H    GLY  89           H        GLY  89  -5.525   3.414 -10.344
  779    HA2  GLY  89           2HA      GLY  89  -7.190   4.877 -11.108
  780    HA3  GLY  89           3HA      GLY  89  -8.435   3.768 -10.562
  781    H    TYR  90           H        TYR  90  -5.992   4.287  -8.217
  782    HA   TYR  90           HA       TYR  90  -7.696   6.049  -6.626
  783    HB2  TYR  90           2HB      TYR  90  -4.941   4.958  -5.899
  784    HB3  TYR  90           3HB      TYR  90  -6.120   5.667  -4.800
  785    HD1  TYR  90           HD2      TYR  90  -8.627   4.229  -5.655
  786    HD2  TYR  90           HD1      TYR  90  -4.647   2.766  -5.066
  787    HE1  TYR  90           HE2      TYR  90  -9.510   1.979  -5.207
  788    HE2  TYR  90           HE1      TYR  90  -5.545   0.527  -4.619
  789    HH   TYR  90           HH       TYR  90  -7.613  -0.510  -3.900
  790    H    ASN  91           H        ASN  91  -7.399   8.196  -6.486
  791    HA   ASN  91           HA       ASN  91  -5.590   9.442  -8.404
  792    HB2  ASN  91           2HB      ASN  91  -8.089  10.006  -8.072
  793    HB3  ASN  91           3HB      ASN  91  -7.617  10.809  -6.583
  794   HD21  ASN  91          1HD2      ASN  91  -8.882  11.898  -8.963
  795   HD22  ASN  91          2HD2      ASN  91  -7.864  13.179  -9.526
  796    H    ASP  92           H        ASP  92  -3.985  10.914  -7.905
  797    HA   ASP  92           HA       ASP  92  -2.400  10.838  -5.628
  798    HB2  ASP  92           2HB      ASP  92  -1.521  11.729  -7.690
  799    HB3  ASP  92           3HB      ASP  92  -2.780  12.953  -7.791
  800    H    SER  93           H        SER  93  -5.130  12.916  -6.382
  801    HA   SER  93           HA       SER  93  -5.051  14.849  -4.388
  802    HB2  SER  93           2HB      SER  93  -7.534  13.548  -5.593
  803    HB3  SER  93           3HB      SER  93  -7.446  15.151  -4.857
  804    HG   SER  93           HG       SER  93  -7.304  15.093  -7.209
  805    H    ASN  94           H        ASN  94  -5.730  11.488  -4.025
  806    HA   ASN  94           HA       ASN  94  -7.198  11.787  -1.471
  807    HB2  ASN  94           2HB      ASN  94  -6.959   9.414  -3.380
  808    HB3  ASN  94           3HB      ASN  94  -7.851   9.396  -1.859
  809   HD21  ASN  94          1HD2      ASN  94  -9.762   8.858  -2.996
  810   HD22  ASN  94          2HD2      ASN  94 -10.632  10.028  -3.923
  811    H    VAL  95           H        VAL  95  -4.110  11.130  -2.633
  812    HA   VAL  95           HA       VAL  95  -3.377   9.051  -0.711
  813    HB   VAL  95           HB       VAL  95  -1.675  10.474  -2.824
  814   HG11  VAL  95          1HG1      VAL  95  -1.089   7.970  -1.201
  815   HG12  VAL  95          2HG1      VAL  95  -0.295   9.535  -1.029
  816   HG13  VAL  95          3HG1      VAL  95  -0.085   8.603  -2.509
  817   HG21  VAL  95          3HG2      VAL  95  -3.528   9.191  -3.836
  818   HG22  VAL  95          1HG2      VAL  95  -3.031   7.747  -2.953
  819   HG23  VAL  95          2HG2      VAL  95  -1.976   8.436  -4.191
  820    H    THR  96           H        THR  96  -3.110   9.786   1.330
  821    HA   THR  96           HA       THR  96  -1.976  12.477   1.852
  822    HB   THR  96           HB       THR  96  -3.780  10.761   3.638
  823    HG1  THR  96           HG1      THR  96  -4.810  11.551   1.707
  824   HG21  THR  96          3HG2      THR  96  -2.979  13.693   3.896
  825   HG22  THR  96          1HG2      THR  96  -2.382  12.376   4.912
  826   HG23  THR  96          2HG2      THR  96  -4.088  12.822   4.958
  827    H    TRP  97           H        TRP  97   0.143  12.371   2.536
  828    HA   TRP  97           HA       TRP  97   1.125  10.014   4.029
  829    HB2  TRP  97           2HB      TRP  97   2.506  12.251   2.508
  830    HB3  TRP  97           3HB      TRP  97   3.402  11.290   3.685
  831    HD1  TRP  97           HD1      TRP  97   1.636  10.908   0.270
  832    HE1  TRP  97           HE1      TRP  97   2.445   8.716  -0.798
  833    HE3  TRP  97           HE3      TRP  97   4.388   9.011   4.167
  834    HZ2  TRP  97           HZ2      TRP  97   4.038   6.518  -0.135
  835    HZ3  TRP  97           HZ3      TRP  97   5.532   6.842   3.854
  836    HH2  TRP  97           HH2      TRP  97   5.352   5.625   1.738
  837    H    ASP  98           H        ASP  98   1.899  10.113   6.042
  838    HA   ASP  98           HA       ASP  98   2.296  12.698   7.408
  839    HB2  ASP  98           2HB      ASP  98   0.950  10.214   8.607
  840    HB3  ASP  98           3HB      ASP  98   1.463  11.618   9.541
  841    H    GLY  99           H        GLY  99   4.378  11.972   6.320
  842    HA2  GLY  99           2HA      GLY  99   6.554  11.252   6.395
  843    HA3  GLY  99           3HA      GLY  99   6.414  11.760   8.058
  844    H    ASP 100           H        ASP 100   4.746   8.855   6.860
  845    HA   ASP 100           HA       ASP 100   6.545   6.875   7.813
  846    HB2  ASP 100           2HB      ASP 100   6.252   7.884  10.006
  847    HB3  ASP 100           3HB      ASP 100   4.508   7.935   9.823
  848    H    THR 101           H        THR 101   3.110   7.760   7.846
  849    HA   THR 101           HA       THR 101   2.342   5.152   6.645
  850    HB   THR 101           HB       THR 101   0.687   6.905   8.544
  851    HG1  THR 101           HG1      THR 101   2.624   5.220   9.130
  852   HG21  THR 101          3HG2      THR 101   0.103   4.112   7.461
  853   HG22  THR 101          1HG2      THR 101  -0.736   5.590   6.988
  854   HG23  THR 101          2HG2      THR 101  -0.877   4.991   8.640
  855    H    VAL 102           H        VAL 102   0.668   5.242   5.041
  856    HA   VAL 102           HA       VAL 102  -0.039   7.916   4.004
  857    HB   VAL 102           HB       VAL 102   1.652   7.024   2.526
  858   HG11  VAL 102          1HG1      VAL 102   1.398   4.943   1.223
  859   HG12  VAL 102          2HG1      VAL 102  -0.056   4.547   2.145
  860   HG13  VAL 102          3HG1      VAL 102   1.506   4.631   2.959
  861   HG21  VAL 102          3HG2      VAL 102   0.431   7.093   0.382
  862   HG22  VAL 102          1HG2      VAL 102  -0.143   8.327   1.506
  863   HG23  VAL 102          2HG2      VAL 102  -1.091   6.863   1.243
  864    H    THR 103           H        THR 103  -2.149   8.215   4.285
  865    HA   THR 103           HA       THR 103  -4.107   6.045   4.216
  866    HB   THR 103           HB       THR 103  -4.289   8.976   5.055
  867    HG1  THR 103           HG1      THR 103  -3.252   7.513   6.516
  868   HG21  THR 103          3HG2      THR 103  -6.471   8.301   4.097
  869   HG22  THR 103          1HG2      THR 103  -6.574   8.498   5.846
  870   HG23  THR 103          2HG2      THR 103  -6.499   6.880   5.146
  871    H    VAL 104           H        VAL 104  -4.490   5.559   2.145
  872    HA   VAL 104           HA       VAL 104  -5.104   7.612   0.127
  873    HB   VAL 104           HB       VAL 104  -4.530   4.630  -0.289
  874   HG11  VAL 104          1HG1      VAL 104  -5.962   5.546  -2.063
  875   HG12  VAL 104          2HG1      VAL 104  -4.350   5.210  -2.696
  876   HG13  VAL 104          3HG1      VAL 104  -4.825   6.873  -2.333
  877   HG21  VAL 104          3HG2      VAL 104  -2.349   5.339  -1.179
  878   HG22  VAL 104          1HG2      VAL 104  -2.529   5.780   0.517
  879   HG23  VAL 104          2HG2      VAL 104  -2.700   7.009  -0.738
  880    H    GLU 105           H        GLU 105  -7.223   8.010   0.126
  881    HA   GLU 105           HA       GLU 105  -9.190   5.879   0.604
  882    HB2  GLU 105           2HB      GLU 105  -9.508   8.904   0.367
  883    HB3  GLU 105           3HB      GLU 105 -10.834   7.774   0.650
  884    HG2  GLU 105           2HG      GLU 105  -9.921   7.129   2.803
  885    HG3  GLU 105           3HG      GLU 105  -8.444   8.036   2.488
  886    H    GLY 106           H        GLY 106 -10.898   5.540  -0.942
  887    HA2  GLY 106           2HA      GLY 106 -10.659   6.783  -3.593
  888    HA3  GLY 106           3HA      GLY 106 -10.387   5.045  -3.508
  889    H    GLN 107           H        GLN 107 -12.549   6.889  -4.685
  890    HA   GLN 107           HA       GLN 107 -15.019   5.953  -3.542
  891    HB2  GLN 107           2HB      GLN 107 -14.677   8.051  -5.024
  892    HB3  GLN 107           3HB      GLN 107 -14.555   6.960  -6.394
  893    HG2  GLN 107           2HG      GLN 107 -16.783   7.760  -6.407
  894    HG3  GLN 107           3HG      GLN 107 -16.889   6.121  -5.770
  895   HE21  GLN 107          1HE2      GLN 107 -17.587   5.835  -3.646
  896   HE22  GLN 107          2HE2      GLN 107 -18.174   7.118  -2.650
  897    H    LEU 108           H        LEU 108 -15.101   3.777  -3.435
  898    HA   LEU 108           HA       LEU 108 -14.081   2.019  -5.506
  899    HB2  LEU 108           2HB      LEU 108 -13.860   1.646  -2.974
  900    HB3  LEU 108           3HB      LEU 108 -15.577   1.296  -2.959
  901    HG   LEU 108           HG       LEU 108 -15.106  -0.595  -4.602
  902   HD11  LEU 108          1HD1      LEU 108 -12.220  -0.035  -3.864
  903   HD12  LEU 108          2HD1      LEU 108 -12.958   0.152  -5.458
  904   HD13  LEU 108          3HD1      LEU 108 -12.809  -1.449  -4.742
  905   HD21  LEU 108          3HD2      LEU 108 -15.550  -1.025  -2.244
  906   HD22  LEU 108          1HD2      LEU 108 -13.845  -0.790  -1.849
  907   HD23  LEU 108          2HD2      LEU 108 -14.342  -2.148  -2.862
  908    H    GLU 109           H        GLU 109 -15.410   0.316  -6.404
  909    HA   GLU 109           HA       GLU 109 -17.916   1.108  -7.463
  910    HB2  GLU 109           2HB      GLU 109 -17.962  -1.177  -8.443
  911    HB3  GLU 109           3HB      GLU 109 -16.423  -0.366  -8.716
  912    HG2  GLU 109           2HG      GLU 109 -15.274  -1.724  -7.162
  913    HG3  GLU 109           3HG      GLU 109 -16.759  -2.248  -6.374
  914    H    GLY 110           H        GLY 110 -19.618  -0.775  -7.486
  915    HA2  GLY 110           2HA      GLY 110 -20.515  -2.384  -5.593
  916    HA3  GLY 110           3HA      GLY 110 -20.840  -0.817  -4.840
  917    H    VAL 111           H        VAL 111 -22.604   0.300  -5.470
  918    HA   VAL 111           HA       VAL 111 -24.169  -0.573  -7.849
  919    HB   VAL 111           HB       VAL 111 -26.251  -0.088  -6.514
  920   HG11  VAL 111          1HG1      VAL 111 -24.517  -2.299  -5.348
  921   HG12  VAL 111          2HG1      VAL 111 -25.515  -2.409  -6.800
  922   HG13  VAL 111          3HG1      VAL 111 -26.278  -2.188  -5.226
  923   HG21  VAL 111          3HG2      VAL 111 -24.359   0.074  -4.123
  924   HG22  VAL 111          1HG2      VAL 111 -26.124   0.049  -4.036
  925   HG23  VAL 111          2HG2      VAL 111 -25.299   1.405  -4.800
  926    H    ASP 112           H        ASP 112 -25.765   1.121  -8.535
  927    HA   ASP 112           HA       ASP 112 -26.668   3.140  -8.902
  928    HB2  ASP 112           2HB      ASP 112 -26.529   3.656  -6.499
  929    HB3  ASP 112           3HB      ASP 112 -24.881   4.228  -6.692
  930    H    LEU 113           H        LEU 113 -23.215   2.909  -8.964
  931    HA   LEU 113           HA       LEU 113 -22.550   5.365 -10.229
  932    HB2  LEU 113           2HB      LEU 113 -21.034   2.729 -10.210
  933    HB3  LEU 113           3HB      LEU 113 -20.344   4.295 -10.600
  934    HG   LEU 113           HG       LEU 113 -21.434   3.480  -7.875
  935   HD11  LEU 113          1HD1      LEU 113 -19.367   2.287  -8.403
  936   HD12  LEU 113          2HD1      LEU 113 -19.108   3.460  -7.118
  937   HD13  LEU 113          3HD1      LEU 113 -18.550   3.813  -8.755
  938   HD21  LEU 113          3HD2      LEU 113 -20.457   5.574  -7.034
  939   HD22  LEU 113          1HD2      LEU 113 -21.707   5.883  -8.238
  940   HD23  LEU 113          2HD2      LEU 113 -20.005   6.037  -8.677
  941    H    GLU 114           H        GLU 114 -22.104   5.831 -12.399
  942    HA   GLU 114           HA       GLU 114 -24.044   4.836 -14.198
  943    HB2  GLU 114           2HB      GLU 114 -23.336   6.523 -15.729
  944    HB3  GLU 114           3HB      GLU 114 -23.163   7.198 -14.119
  945    HG2  GLU 114           2HG      GLU 114 -20.913   6.153 -15.866
  946    HG3  GLU 114           3HG      GLU 114 -21.306   7.847 -15.589
  947    H    HIS 115           H        HIS 115 -20.684   3.966 -13.851
  948    HA   HIS 115           HA       HIS 115 -20.267   2.863 -16.450
  949    HB2  HIS 115           2HB      HIS 115 -18.213   1.814 -15.440
  950    HB3  HIS 115           3HB      HIS 115 -18.339   3.542 -15.183
  951    HD1  HIS 115           HD1      HIS 115 -16.514   3.053 -13.321
  952    HD2  HIS 115           HD2      HIS 115 -20.321   1.585 -12.501
  953    HE1  HIS 115           HE1      HIS 115 -16.498   2.454 -10.877
  954    HE2  HIS 115           HE2      HIS 115 -18.813   1.605 -10.403
  955    H    HIS 116           H        HIS 116 -19.635   0.465 -16.720
  956    HA   HIS 116           HA       HIS 116 -22.093  -0.903 -16.632
  957    HB2  HIS 116           2HB      HIS 116 -20.974  -2.769 -17.769
  958    HB3  HIS 116           3HB      HIS 116 -20.491  -1.242 -18.481
  959    HD1  HIS 116           HD1      HIS 116 -18.008  -0.683 -18.456
  960    HD2  HIS 116           HD2      HIS 116 -18.910  -4.208 -16.445
  961    HE1  HIS 116           HE1      HIS 116 -15.808  -1.828 -18.074
  962    HE2  HIS 116           HE2      HIS 116 -16.366  -3.855 -16.710
  963    H    HIS 117           H        HIS 117 -22.990  -2.237 -15.216
  964    HA   HIS 117           HA       HIS 117 -21.438  -3.605 -13.138
  965    HB2  HIS 117           2HB      HIS 117 -22.861  -2.764 -11.316
  966    HB3  HIS 117           3HB      HIS 117 -22.105  -1.406 -12.143
  967    HD1  HIS 117           HD1      HIS 117 -25.352  -2.660 -11.067
  968    HD2  HIS 117           HD2      HIS 117 -23.971   0.006 -13.949
  969    HE1  HIS 117           HE1      HIS 117 -27.339  -1.271 -11.714
  970    HE2  HIS 117           HE2      HIS 117 -26.427   0.455 -13.292
  971    H    HIS 118           H        HIS 118 -22.308  -5.490 -12.522
  972    HA   HIS 118           HA       HIS 118 -24.972  -6.340 -13.522
  973    HB2  HIS 118           2HB      HIS 118 -22.620  -8.091 -12.629
  974    HB3  HIS 118           3HB      HIS 118 -24.124  -8.649 -13.361
  975    HD1  HIS 118           HD1      HIS 118 -20.932  -8.742 -14.352
  976    HD2  HIS 118           HD2      HIS 118 -24.162  -6.720 -16.012
  977    HE1  HIS 118           HE1      HIS 118 -20.323  -8.354 -16.758
  978    HE2  HIS 118           HE2      HIS 118 -22.232  -7.022 -17.697
  979    H    HIS 119           H        HIS 119 -25.884  -8.101 -11.921
  980    HA   HIS 119           HA       HIS 119 -25.836  -7.152  -9.180
  981    HB2  HIS 119           2HB      HIS 119 -27.236  -9.540 -10.486
  982    HB3  HIS 119           3HB      HIS 119 -27.301  -9.230  -8.754
  983    HD1  HIS 119           HD1      HIS 119 -28.659  -7.171  -7.955
  984    HD2  HIS 119           HD2      HIS 119 -28.876  -7.852 -12.052
  985    HE1  HIS 119           HE1      HIS 119 -30.568  -5.763  -8.775
  986    HE2  HIS 119           HE2      HIS 119 -30.788  -6.333 -11.211
  987    H    HIS 120           H        HIS 120 -23.636  -7.282  -8.816
  988    HA   HIS 120           HA       HIS 120 -21.967  -9.551  -9.071
  989    HB2  HIS 120           2HB      HIS 120 -21.148  -7.197  -8.971
  990    HB3  HIS 120           3HB      HIS 120 -21.677  -7.072  -7.300
  991    HD1  HIS 120           HD1      HIS 120 -20.386  -8.900  -5.643
  992    HD2  HIS 120           HD2      HIS 120 -18.540  -7.861  -9.211
  993    HE1  HIS 120           HE1      HIS 120 -17.986  -9.559  -5.378
  994    HE2  HIS 120           HE2      HIS 120 -16.943  -9.084  -7.601
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1  21.902  -2.576   2.984
    2    H2   MET   1           2H       MET   1  20.437  -2.411   2.168
    3    H3   MET   1           3H       MET   1  21.806  -1.627   1.585
    4    HA   MET   1           HA       MET   1  22.843  -3.699   1.069
    5    HB2  MET   1           2HB      MET   1  20.219  -4.980   1.965
    6    HB3  MET   1           3HB      MET   1  21.611  -5.827   1.295
    7    HG2  MET   1           2HG      MET   1  21.588  -6.201   3.659
    8    HG3  MET   1           3HG      MET   1  22.923  -5.098   3.316
    9    HE1  MET   1           3HE      MET   1  21.599  -5.601   6.257
   10    HE2  MET   1           1HE      MET   1  21.523  -3.955   6.882
   11    HE3  MET   1           2HE      MET   1  22.963  -4.505   6.027
   12    H    SER   2           H        SER   2  22.232  -4.942  -0.956
   13    HA   SER   2           HA       SER   2  20.744  -3.282  -2.788
   14    HB2  SER   2           2HB      SER   2  22.044  -5.998  -3.288
   15    HB3  SER   2           3HB      SER   2  21.558  -4.819  -4.509
   16    HG   SER   2           HG       SER   2  23.712  -4.752  -2.713
   17    H    GLY   3           H        GLY   3  18.736  -3.483  -1.565
   18    HA2  GLY   3           2HA      GLY   3  16.551  -4.551  -2.232
   19    HA3  GLY   3           3HA      GLY   3  17.311  -6.075  -1.792
   20    H    LYS   4           H        LYS   4  14.932  -5.158  -0.657
   21    HA   LYS   4           HA       LYS   4  15.698  -5.128   2.169
   22    HB2  LYS   4           2HB      LYS   4  14.082  -3.388   2.791
   23    HB3  LYS   4           3HB      LYS   4  15.305  -2.735   1.722
   24    HG2  LYS   4           2HG      LYS   4  12.625  -3.611   0.619
   25    HG3  LYS   4           3HG      LYS   4  12.799  -2.045   1.400
   26    HD2  LYS   4           2HD      LYS   4  14.423  -2.970  -1.006
   27    HD3  LYS   4           3HD      LYS   4  13.010  -1.912  -1.081
   28    HE2  LYS   4           2HE      LYS   4  14.186  -0.231   0.296
   29    HE3  LYS   4           3HE      LYS   4  15.594  -1.291   0.391
   30    HZ1  LYS   4           3HZ      LYS   4  14.535  -0.393  -2.219
   31    HZ2  LYS   4           1HZ      LYS   4  16.072  -0.984  -1.846
   32    HZ3  LYS   4           2HZ      LYS   4  15.610   0.562  -1.336
   33    H    LYS   5           H        LYS   5  14.254  -6.120   3.510
   34    HA   LYS   5           HA       LYS   5  11.849  -7.379   2.360
   35    HB2  LYS   5           2HB      LYS   5  13.471  -8.747   3.703
   36    HB3  LYS   5           3HB      LYS   5  13.150  -7.744   5.105
   37    HG2  LYS   5           2HG      LYS   5  10.862  -9.204   3.769
   38    HG3  LYS   5           3HG      LYS   5  11.970 -10.098   4.803
   39    HD2  LYS   5           2HD      LYS   5  10.263  -7.720   5.644
   40    HD3  LYS   5           3HD      LYS   5   9.984  -9.413   6.060
   41    HE2  LYS   5           2HE      LYS   5  12.193  -9.432   7.264
   42    HE3  LYS   5           3HE      LYS   5  12.340  -7.702   6.939
   43    HZ1  LYS   5           3HZ      LYS   5  11.465  -8.123   9.153
   44    HZ2  LYS   5           1HZ      LYS   5  10.163  -8.986   8.509
   45    HZ3  LYS   5           2HZ      LYS   5  10.312  -7.328   8.209
   46    H    VAL   6           H        VAL   6  10.302  -5.916   2.258
   47    HA   VAL   6           HA       VAL   6   9.870  -3.941   4.403
   48    HB   VAL   6           HB       VAL   6  10.007  -2.728   2.368
   49   HG11  VAL   6          1HG1      VAL   6   8.895  -3.348   0.243
   50   HG12  VAL   6          2HG1      VAL   6   8.271  -4.818   1.000
   51   HG13  VAL   6          3HG1      VAL   6  10.008  -4.606   0.789
   52   HG21  VAL   6          3HG2      VAL   6   7.748  -1.871   1.893
   53   HG22  VAL   6          1HG2      VAL   6   7.983  -2.102   3.628
   54   HG23  VAL   6          2HG2      VAL   6   7.030  -3.265   2.705
   55    H    GLU   7           H        GLU   7   8.078  -4.054   5.612
   56    HA   GLU   7           HA       GLU   7   6.056  -6.137   5.056
   57    HB2  GLU   7           2HB      GLU   7   6.741  -4.774   7.697
   58    HB3  GLU   7           3HB      GLU   7   5.499  -6.006   7.474
   59    HG2  GLU   7           2HG      GLU   7   7.143  -7.688   6.933
   60    HG3  GLU   7           3HG      GLU   7   8.429  -6.480   6.853
   61    H    VAL   8           H        VAL   8   4.343  -5.367   4.157
   62    HA   VAL   8           HA       VAL   8   3.591  -2.531   4.312
   63    HB   VAL   8           HB       VAL   8   2.680  -4.763   2.417
   64   HG11  VAL   8          1HG1      VAL   8   1.691  -2.991   1.026
   65   HG12  VAL   8          2HG1      VAL   8   2.147  -1.774   2.220
   66   HG13  VAL   8          3HG1      VAL   8   0.958  -3.012   2.631
   67   HG21  VAL   8          3HG2      VAL   8   5.070  -4.190   2.144
   68   HG22  VAL   8          1HG2      VAL   8   4.645  -2.491   1.910
   69   HG23  VAL   8          2HG2      VAL   8   4.129  -3.706   0.735
   70    H    GLN   9           H        GLN   9   2.193  -2.133   5.935
   71    HA   GLN   9           HA       GLN   9   0.336  -4.216   6.895
   72    HB2  GLN   9           2HB      GLN   9   1.116  -1.511   8.100
   73    HB3  GLN   9           3HB      GLN   9   0.080  -2.713   8.871
   74    HG2  GLN   9           2HG      GLN   9   1.942  -4.268   9.072
   75    HG3  GLN   9           3HG      GLN   9   2.984  -3.199   8.130
   76   HE21  GLN   9          1HE2      GLN   9   3.831  -1.334   9.115
   77   HE22  GLN   9          2HE2      GLN   9   3.830  -1.115  10.828
   78    H    VAL  10           H        VAL  10  -1.377  -4.173   5.530
   79    HA   VAL  10           HA       VAL  10  -2.521  -1.639   4.566
   80    HB   VAL  10           HB       VAL  10  -3.121  -4.536   3.757
   81   HG11  VAL  10          1HG1      VAL  10  -4.466  -3.601   1.905
   82   HG12  VAL  10          2HG1      VAL  10  -4.199  -1.968   2.519
   83   HG13  VAL  10          3HG1      VAL  10  -5.130  -3.126   3.470
   84   HG21  VAL  10          3HG2      VAL  10  -1.972  -3.961   1.639
   85   HG22  VAL  10          1HG2      VAL  10  -0.896  -3.782   3.027
   86   HG23  VAL  10          2HG2      VAL  10  -1.605  -2.354   2.270
   87    H    LYS  11           H        LYS  11  -3.808  -0.783   6.069
   88    HA   LYS  11           HA       LYS  11  -5.714  -2.494   7.576
   89    HB2  LYS  11           2HB      LYS  11  -3.836  -1.405   8.884
   90    HB3  LYS  11           3HB      LYS  11  -4.435   0.173   8.389
   91    HG2  LYS  11           2HG      LYS  11  -6.426  -0.062   9.692
   92    HG3  LYS  11           3HG      LYS  11  -6.154  -1.788   9.943
   93    HD2  LYS  11           2HD      LYS  11  -4.453   0.466  11.101
   94    HD3  LYS  11           3HD      LYS  11  -5.643  -0.488  11.985
   95    HE2  LYS  11           2HE      LYS  11  -4.277  -2.538  11.500
   96    HE3  LYS  11           3HE      LYS  11  -3.056  -1.504  10.761
   97    HZ1  LYS  11           3HZ      LYS  11  -2.380  -1.938  12.964
   98    HZ2  LYS  11           1HZ      LYS  11  -3.900  -1.561  13.600
   99    HZ3  LYS  11           2HZ      LYS  11  -2.928  -0.340  12.959
  100    H    ILE  12           H        ILE  12  -7.591  -2.296   6.449
  101    HA   ILE  12           HA       ILE  12  -8.327   0.324   5.250
  102    HB   ILE  12           HB       ILE  12  -7.758  -1.231   3.475
  103   HG12  ILE  12          2HG1      ILE  12 -10.805  -1.002   3.648
  104   HG13  ILE  12          3HG1      ILE  12  -9.718   0.252   3.061
  105   HG21  ILE  12          1HG2      ILE  12  -7.980  -3.372   4.650
  106   HG22  ILE  12          2HG2      ILE  12  -8.849  -3.415   3.116
  107   HG23  ILE  12          3HG2      ILE  12  -9.740  -3.224   4.629
  108   HD11  ILE  12          3HD1      ILE  12 -10.801  -0.880   1.226
  109   HD12  ILE  12          1HD1      ILE  12 -10.186  -2.439   1.773
  110   HD13  ILE  12          2HD1      ILE  12  -9.070  -1.201   1.189
  111    H    THR  13           H        THR  13 -10.186   1.201   5.973
  112    HA   THR  13           HA       THR  13 -12.006  -0.402   7.628
  113    HB   THR  13           HB       THR  13 -12.001   2.612   7.122
  114    HG1  THR  13           HG1      THR  13 -10.163   1.609   8.330
  115   HG21  THR  13          3HG2      THR  13 -13.481   2.722   9.099
  116   HG22  THR  13          1HG2      THR  13 -13.492   0.960   9.212
  117   HG23  THR  13          2HG2      THR  13 -14.231   1.764   7.825
  118    H    CYS  14           H        CYS  14 -13.755  -1.240   6.820
  119    HA   CYS  14           HA       CYS  14 -15.435  -0.063   4.763
  120    HB2  CYS  14           2HB      CYS  14 -13.869  -1.229   3.323
  121    HB3  CYS  14           3HB      CYS  14 -13.886  -2.656   4.351
  122    H    ASN  15           H        ASN  15 -17.577  -0.920   4.901
  123    HA   ASN  15           HA       ASN  15 -19.404  -2.043   5.676
  124    HB2  ASN  15           2HB      ASN  15 -18.109  -4.058   4.929
  125    HB3  ASN  15           3HB      ASN  15 -17.380  -4.176   6.519
  126   HD21  ASN  15          1HD2      ASN  15 -18.499  -5.221   8.142
  127   HD22  ASN  15          2HD2      ASN  15 -20.027  -5.995   7.910
  128    H    GLY  16           H        GLY  16 -17.681  -0.230   7.388
  129    HA2  GLY  16           2HA      GLY  16 -17.928   0.798   9.435
  130    HA3  GLY  16           3HA      GLY  16 -19.102  -0.428   9.887
  131    H    LYS  17           H        LYS  17 -16.276  -1.875   8.793
  132    HA   LYS  17           HA       LYS  17 -15.114  -2.159  11.508
  133    HB2  LYS  17           2HB      LYS  17 -15.399  -4.341   9.377
  134    HB3  LYS  17           3HB      LYS  17 -14.629  -4.532  10.953
  135    HG2  LYS  17           2HG      LYS  17 -16.854  -3.988  12.023
  136    HG3  LYS  17           3HG      LYS  17 -17.562  -3.998  10.410
  137    HD2  LYS  17           2HD      LYS  17 -18.033  -6.128  11.393
  138    HD3  LYS  17           3HD      LYS  17 -16.798  -6.399  10.166
  139    HE2  LYS  17           2HE      LYS  17 -16.169  -6.085  13.121
  140    HE3  LYS  17           3HE      LYS  17 -16.479  -7.642  12.358
  141    HZ1  LYS  17           3HZ      LYS  17 -14.147  -7.297  12.495
  142    HZ2  LYS  17           1HZ      LYS  17 -14.247  -5.780  11.763
  143    HZ3  LYS  17           2HZ      LYS  17 -14.579  -7.175  10.869
  144    H    THR  18           H        THR  18 -12.796  -3.094  11.363
  145    HA   THR  18           HA       THR  18 -11.348  -1.793   9.105
  146    HB   THR  18           HB       THR  18 -10.362  -2.016  11.996
  147    HG1  THR  18           HG1      THR  18 -11.221   0.383  10.719
  148   HG21  THR  18          3HG2      THR  18  -9.299  -0.402   9.637
  149   HG22  THR  18          1HG2      THR  18  -8.539  -1.841  10.326
  150   HG23  THR  18          2HG2      THR  18  -8.665  -0.367  11.284
  151    H    TYR  19           H        TYR  19 -10.330  -3.240   7.900
  152    HA   TYR  19           HA       TYR  19  -9.701  -5.950   8.885
  153    HB2  TYR  19           2HB      TYR  19 -10.044  -5.006   5.991
  154    HB3  TYR  19           3HB      TYR  19  -9.881  -6.669   6.542
  155    HD1  TYR  19           HD1      TYR  19 -11.799  -7.728   7.845
  156    HD2  TYR  19           HD2      TYR  19 -12.185  -3.925   5.935
  157    HE1  TYR  19           HE1      TYR  19 -14.251  -7.911   7.967
  158    HE2  TYR  19           HE2      TYR  19 -14.622  -4.113   6.059
  159    HH   TYR  19           HH       TYR  19 -16.328  -5.927   6.212
  160    H    GLU  20           H        GLU  20  -7.578  -5.848   9.560
  161    HA   GLU  20           HA       GLU  20  -5.576  -4.495   7.850
  162    HB2  GLU  20           2HB      GLU  20  -4.129  -4.467   9.871
  163    HB3  GLU  20           3HB      GLU  20  -5.631  -3.588  10.072
  164    HG2  GLU  20           2HG      GLU  20  -5.457  -4.638  12.116
  165    HG3  GLU  20           3HG      GLU  20  -6.474  -5.778  11.239
  166    H    ARG  21           H        ARG  21  -3.483  -5.495   7.573
  167    HA   ARG  21           HA       ARG  21  -2.916  -8.174   8.386
  168    HB2  ARG  21           2HB      ARG  21  -4.572  -8.600   6.524
  169    HB3  ARG  21           3HB      ARG  21  -3.489  -7.792   5.397
  170    HG2  ARG  21           2HG      ARG  21  -1.826  -9.532   5.634
  171    HG3  ARG  21           3HG      ARG  21  -2.710 -10.274   6.971
  172    HD2  ARG  21           2HD      ARG  21  -4.570 -10.829   5.424
  173    HD3  ARG  21           3HD      ARG  21  -3.676 -10.092   4.094
  174    HE   ARG  21           HE       ARG  21  -1.941 -11.849   4.503
  175   HH11  ARG  21          1HH1      ARG  21  -5.291 -12.481   5.394
  176   HH12  ARG  21          2HH1      ARG  21  -5.135 -14.200   5.226
  177   HH21  ARG  21          1HH2      ARG  21  -1.779 -14.093   4.243
  178   HH22  ARG  21          2HH2      ARG  21  -3.146 -15.109   4.573
  179    H    THR  22           H        THR  22  -0.750  -8.370   8.506
  180    HA   THR  22           HA       THR  22   1.013  -6.337   7.327
  181    HB   THR  22           HB       THR  22   1.687  -8.568   9.313
  182    HG1  THR  22           HG1      THR  22   0.462  -7.357  10.566
  183   HG21  THR  22          3HG2      THR  22   3.660  -7.218   9.879
  184   HG22  THR  22          1HG2      THR  22   3.194  -5.990   8.700
  185   HG23  THR  22          2HG2      THR  22   3.678  -7.598   8.157
  186    H    TYR  23           H        TYR  23   1.801  -6.798   5.336
  187    HA   TYR  23           HA       TYR  23   2.140  -9.579   4.413
  188    HB2  TYR  23           2HB      TYR  23   2.175  -6.940   2.866
  189    HB3  TYR  23           3HB      TYR  23   2.353  -8.536   2.144
  190    HD1  TYR  23           HD1      TYR  23  -0.028  -6.269   3.878
  191    HD2  TYR  23           HD2      TYR  23   0.404  -9.904   1.675
  192    HE1  TYR  23           HE1      TYR  23  -2.462  -6.385   3.600
  193    HE2  TYR  23           HE2      TYR  23  -2.035 -10.017   1.397
  194    HH   TYR  23           HH       TYR  23  -4.071  -7.432   2.002
  195    H    GLN  24           H        GLN  24   4.110 -10.429   4.407
  196    HA   GLN  24           HA       GLN  24   6.530  -8.753   4.579
  197    HB2  GLN  24           2HB      GLN  24   6.122 -11.772   4.832
  198    HB3  GLN  24           3HB      GLN  24   7.719 -11.039   4.714
  199    HG2  GLN  24           2HG      GLN  24   7.245 -11.465   7.033
  200    HG3  GLN  24           3HG      GLN  24   7.249  -9.722   6.776
  201   HE21  GLN  24          1HE2      GLN  24   5.979  -9.255   8.559
  202   HE22  GLN  24          2HE2      GLN  24   4.311  -9.680   8.677
  203    H    LEU  25           H        LEU  25   7.260  -8.008   2.723
  204    HA   LEU  25           HA       LEU  25   7.194  -9.646   0.251
  205    HB2  LEU  25           2HB      LEU  25   6.836  -6.612   0.462
  206    HB3  LEU  25           3HB      LEU  25   6.829  -7.548  -1.026
  207    HG   LEU  25           HG       LEU  25   4.721  -7.706   1.170
  208   HD11  LEU  25          1HD1      LEU  25   4.524  -6.466  -1.591
  209   HD12  LEU  25          2HD1      LEU  25   4.607  -5.592  -0.060
  210   HD13  LEU  25          3HD1      LEU  25   3.214  -6.609  -0.414
  211   HD21  LEU  25          3HD2      LEU  25   3.417  -9.098  -0.390
  212   HD22  LEU  25          1HD2      LEU  25   4.938  -9.870   0.059
  213   HD23  LEU  25          2HD2      LEU  25   4.773  -9.105  -1.523
  214    H    TYR  26           H        TYR  26   9.262 -10.101  -0.368
  215    HA   TYR  26           HA       TYR  26  11.453  -8.203   0.333
  216    HB2  TYR  26           2HB      TYR  26  11.694 -10.418   1.433
  217    HB3  TYR  26           3HB      TYR  26  11.607 -11.233  -0.127
  218    HD1  TYR  26           HD1      TYR  26  13.646  -8.767   1.815
  219    HD2  TYR  26           HD2      TYR  26  13.648 -11.594  -1.379
  220    HE1  TYR  26           HE1      TYR  26  16.069  -8.501   1.600
  221    HE2  TYR  26           HE2      TYR  26  16.088 -11.331  -1.599
  222    HH   TYR  26           HH       TYR  26  17.987  -9.769   0.751
  223    H    ALA  27           H        ALA  27  12.742  -7.444  -1.317
  224    HA   ALA  27           HA       ALA  27  12.944  -8.792  -3.875
  225    HB1  ALA  27           3HB      ALA  27  10.884  -7.469  -4.242
  226    HB2  ALA  27           1HB      ALA  27  12.206  -6.867  -5.243
  227    HB3  ALA  27           2HB      ALA  27  11.735  -5.996  -3.782
  228    H    VAL  28           H        VAL  28  14.700  -8.132  -5.068
  229    HA   VAL  28           HA       VAL  28  16.945  -6.965  -3.756
  230    HB   VAL  28           HB       VAL  28  16.603  -7.456  -6.759
  231   HG11  VAL  28          1HG1      VAL  28  19.054  -7.727  -6.809
  232   HG12  VAL  28          2HG1      VAL  28  19.143  -7.353  -5.085
  233   HG13  VAL  28          3HG1      VAL  28  18.596  -6.124  -6.229
  234   HG21  VAL  28          3HG2      VAL  28  16.029  -9.511  -5.547
  235   HG22  VAL  28          1HG2      VAL  28  17.555  -9.444  -4.664
  236   HG23  VAL  28          2HG2      VAL  28  17.554  -9.706  -6.408
  237    H    ARG  29           H        ARG  29  14.420  -5.734  -5.807
  238    HA   ARG  29           HA       ARG  29  15.434  -2.979  -5.550
  239    HB2  ARG  29           2HB      ARG  29  14.355  -4.264  -8.096
  240    HB3  ARG  29           3HB      ARG  29  14.505  -2.527  -7.883
  241    HG2  ARG  29           2HG      ARG  29  16.968  -2.798  -7.609
  242    HG3  ARG  29           3HG      ARG  29  16.786  -4.527  -7.920
  243    HD2  ARG  29           2HD      ARG  29  15.954  -4.081 -10.169
  244    HD3  ARG  29           3HD      ARG  29  15.956  -2.342  -9.862
  245    HE   ARG  29           HE       ARG  29  18.513  -3.752  -9.662
  246   HH11  ARG  29          1HH1      ARG  29  16.451  -1.649 -11.605
  247   HH12  ARG  29          2HH1      ARG  29  17.751  -1.133 -12.632
  248   HH21  ARG  29          1HH2      ARG  29  20.199  -3.072 -11.043
  249   HH22  ARG  29          2HH2      ARG  29  19.866  -1.938 -12.314
  250    H    ASP  30           H        ASP  30  13.872  -1.496  -4.975
  251    HA   ASP  30           HA       ASP  30  11.251  -2.382  -4.207
  252    HB2  ASP  30           2HB      ASP  30  10.860   0.090  -3.646
  253    HB3  ASP  30           3HB      ASP  30  12.146  -0.726  -2.776
  254    H    GLU  31           H        GLU  31  12.506  -1.089  -7.164
  255    HA   GLU  31           HA       GLU  31  10.012  -0.243  -8.306
  256    HB2  GLU  31           2HB      GLU  31  11.159  -0.309 -10.480
  257    HB3  GLU  31           3HB      GLU  31  12.172   0.471  -9.272
  258    HG2  GLU  31           2HG      GLU  31  13.506  -1.578  -9.039
  259    HG3  GLU  31           3HG      GLU  31  12.482  -2.399 -10.209
  260    H    GLU  32           H        GLU  32  11.548  -3.356  -7.880
  261    HA   GLU  32           HA       GLU  32   9.737  -4.807  -9.640
  262    HB2  GLU  32           2HB      GLU  32  11.711  -5.886  -7.582
  263    HB3  GLU  32           3HB      GLU  32  10.907  -6.822  -8.837
  264    HG2  GLU  32           2HG      GLU  32  12.955  -4.628  -9.291
  265    HG3  GLU  32           3HG      GLU  32  13.252  -6.360  -9.392
  266    H    LEU  33           H        LEU  33   9.887  -3.826  -6.320
  267    HA   LEU  33           HA       LEU  33   8.089  -5.674  -5.122
  268    HB2  LEU  33           2HB      LEU  33   9.787  -3.792  -4.145
  269    HB3  LEU  33           3HB      LEU  33   8.322  -2.841  -4.075
  270    HG   LEU  33           HG       LEU  33   8.850  -3.846  -1.899
  271   HD11  LEU  33          1HD1      LEU  33   6.367  -5.152  -3.016
  272   HD12  LEU  33          2HD1      LEU  33   6.487  -3.512  -2.374
  273   HD13  LEU  33          3HD1      LEU  33   6.745  -4.890  -1.309
  274   HD21  LEU  33          3HD2      LEU  33  10.081  -5.818  -2.600
  275   HD22  LEU  33          1HD2      LEU  33   8.608  -6.562  -3.224
  276   HD23  LEU  33          2HD2      LEU  33   8.791  -6.267  -1.491
  277    H    LYS  34           H        LYS  34   7.615  -2.941  -7.216
  278    HA   LYS  34           HA       LYS  34   5.136  -1.907  -6.681
  279    HB2  LYS  34           2HB      LYS  34   6.455  -2.471  -9.356
  280    HB3  LYS  34           3HB      LYS  34   4.891  -1.675  -9.260
  281    HG2  LYS  34           2HG      LYS  34   5.905   0.183  -7.985
  282    HG3  LYS  34           3HG      LYS  34   7.477  -0.624  -8.071
  283    HD2  LYS  34           2HD      LYS  34   7.322   1.119  -9.808
  284    HD3  LYS  34           3HD      LYS  34   7.429  -0.477 -10.548
  285    HE2  LYS  34           2HE      LYS  34   4.898  -0.426 -10.791
  286    HE3  LYS  34           3HE      LYS  34   4.950   1.259 -10.271
  287    HZ1  LYS  34           3HZ      LYS  34   6.314   1.786 -12.176
  288    HZ2  LYS  34           1HZ      LYS  34   4.902   1.021 -12.698
  289    HZ3  LYS  34           2HZ      LYS  34   6.363   0.168 -12.657
  290    H    GLU  35           H        GLU  35   5.701  -4.728  -8.857
  291    HA   GLU  35           HA       GLU  35   3.015  -5.255  -9.421
  292    HB2  GLU  35           2HB      GLU  35   3.789  -7.420 -10.337
  293    HB3  GLU  35           3HB      GLU  35   4.805  -6.079 -10.837
  294    HG2  GLU  35           2HG      GLU  35   6.434  -7.605 -10.383
  295    HG3  GLU  35           3HG      GLU  35   6.309  -6.875  -8.787
  296    H    LYS  36           H        LYS  36   4.977  -6.285  -6.722
  297    HA   LYS  36           HA       LYS  36   3.261  -8.347  -5.744
  298    HB2  LYS  36           2HB      LYS  36   5.387  -6.713  -4.279
  299    HB3  LYS  36           3HB      LYS  36   4.649  -8.205  -3.684
  300    HG2  LYS  36           2HG      LYS  36   5.529  -9.364  -5.746
  301    HG3  LYS  36           3HG      LYS  36   6.417  -7.884  -6.126
  302    HD2  LYS  36           2HD      LYS  36   7.800  -8.108  -4.172
  303    HD3  LYS  36           3HD      LYS  36   6.761  -9.372  -3.501
  304    HE2  LYS  36           2HE      LYS  36   7.370 -10.831  -5.451
  305    HE3  LYS  36           3HE      LYS  36   8.513  -9.587  -5.967
  306    HZ1  LYS  36           3HZ      LYS  36   9.564 -11.359  -4.692
  307    HZ2  LYS  36           1HZ      LYS  36   8.597 -11.002  -3.356
  308    HZ3  LYS  36           2HZ      LYS  36   9.719  -9.872  -3.923
  309    H    LEU  37           H        LEU  37   3.675  -4.913  -5.007
  310    HA   LEU  37           HA       LEU  37   1.713  -4.621  -3.004
  311    HB2  LEU  37           2HB      LEU  37   2.759  -2.642  -5.061
  312    HB3  LEU  37           3HB      LEU  37   1.750  -2.188  -3.695
  313    HG   LEU  37           HG       LEU  37   4.482  -3.489  -3.396
  314   HD11  LEU  37          1HD1      LEU  37   5.358  -1.270  -2.838
  315   HD12  LEU  37          2HD1      LEU  37   3.800  -0.539  -3.232
  316   HD13  LEU  37          3HD1      LEU  37   4.754  -1.323  -4.493
  317   HD21  LEU  37          3HD2      LEU  37   4.326  -2.719  -1.072
  318   HD22  LEU  37          1HD2      LEU  37   3.006  -3.814  -1.475
  319   HD23  LEU  37          2HD2      LEU  37   2.711  -2.076  -1.380
  320    H    LYS  38           H        LYS  38   1.484  -4.592  -6.573
  321    HA   LYS  38           HA       LYS  38  -1.206  -3.795  -6.829
  322    HB2  LYS  38           2HB      LYS  38   0.470  -5.592  -8.635
  323    HB3  LYS  38           3HB      LYS  38  -1.078  -4.874  -9.084
  324    HG2  LYS  38           2HG      LYS  38  -0.109  -2.621  -8.922
  325    HG3  LYS  38           3HG      LYS  38   1.428  -3.311  -8.389
  326    HD2  LYS  38           2HD      LYS  38   1.540  -2.734 -10.772
  327    HD3  LYS  38           3HD      LYS  38   1.668  -4.481 -10.559
  328    HE2  LYS  38           2HE      LYS  38  -0.727  -4.719 -11.162
  329    HE3  LYS  38           3HE      LYS  38  -0.840  -2.970 -11.384
  330    HZ1  LYS  38           3HZ      LYS  38   0.829  -3.151 -13.142
  331    HZ2  LYS  38           1HZ      LYS  38  -0.548  -4.069 -13.485
  332    HZ3  LYS  38           2HZ      LYS  38   0.864  -4.830 -12.957
  333    H    LYS  39           H        LYS  39   0.308  -7.023  -6.498
  334    HA   LYS  39           HA       LYS  39  -2.039  -8.595  -6.643
  335    HB2  LYS  39           2HB      LYS  39   0.397  -9.237  -4.913
  336    HB3  LYS  39           3HB      LYS  39  -0.788 -10.380  -5.534
  337    HG2  LYS  39           2HG      LYS  39   1.293  -8.857  -7.111
  338    HG3  LYS  39           3HG      LYS  39   1.252 -10.589  -6.795
  339    HD2  LYS  39           2HD      LYS  39  -0.809 -10.773  -8.175
  340    HD3  LYS  39           3HD      LYS  39  -0.734  -9.042  -8.512
  341    HE2  LYS  39           2HE      LYS  39   1.323 -11.125  -9.326
  342    HE3  LYS  39           3HE      LYS  39   0.189 -10.295 -10.395
  343    HZ1  LYS  39           3HZ      LYS  39   2.327  -9.266 -10.531
  344    HZ2  LYS  39           1HZ      LYS  39   2.403  -9.053  -8.861
  345    HZ3  LYS  39           2HZ      LYS  39   1.273  -8.192  -9.772
  346    H    VAL  40           H        VAL  40  -0.315  -7.254  -3.850
  347    HA   VAL  40           HA       VAL  40  -1.874  -8.149  -1.751
  348    HB   VAL  40           HB       VAL  40  -0.118  -5.676  -2.082
  349   HG11  VAL  40          1HG1      VAL  40  -1.420  -6.576   0.511
  350   HG12  VAL  40          2HG1      VAL  40  -1.737  -5.068  -0.351
  351   HG13  VAL  40          3HG1      VAL  40  -0.154  -5.353   0.372
  352   HG21  VAL  40          3HG2      VAL  40   1.458  -6.944  -0.645
  353   HG22  VAL  40          1HG2      VAL  40   1.037  -7.853  -2.098
  354   HG23  VAL  40          2HG2      VAL  40   0.302  -8.274  -0.550
  355    H    LEU  41           H        LEU  41  -2.205  -5.047  -3.532
  356    HA   LEU  41           HA       LEU  41  -4.383  -4.062  -1.993
  357    HB2  LEU  41           2HB      LEU  41  -3.286  -3.274  -4.709
  358    HB3  LEU  41           3HB      LEU  41  -4.663  -2.453  -3.995
  359    HG   LEU  41           HG       LEU  41  -1.891  -2.570  -2.735
  360   HD11  LEU  41          1HD1      LEU  41  -3.228  -0.288  -4.235
  361   HD12  LEU  41          2HD1      LEU  41  -1.874  -1.263  -4.811
  362   HD13  LEU  41          3HD1      LEU  41  -1.667  -0.220  -3.408
  363   HD21  LEU  41          3HD2      LEU  41  -3.672  -2.333  -1.059
  364   HD22  LEU  41          1HD2      LEU  41  -4.350  -0.958  -1.941
  365   HD23  LEU  41          2HD2      LEU  41  -2.749  -0.841  -1.202
  366    H    ASN  42           H        ASN  42  -4.278  -5.565  -5.261
  367    HA   ASN  42           HA       ASN  42  -7.040  -5.304  -5.772
  368    HB2  ASN  42           2HB      ASN  42  -5.359  -5.525  -7.555
  369    HB3  ASN  42           3HB      ASN  42  -4.989  -7.166  -7.047
  370   HD21  ASN  42          1HD2      ASN  42  -7.522  -5.117  -8.381
  371   HD22  ASN  42          2HD2      ASN  42  -8.395  -6.387  -9.164
  372    H    GLU  43           H        GLU  43  -5.160  -8.023  -4.430
  373    HA   GLU  43           HA       GLU  43  -7.340  -9.872  -4.269
  374    HB2  GLU  43           2HB      GLU  43  -4.690  -9.778  -2.769
  375    HB3  GLU  43           3HB      GLU  43  -5.823 -11.114  -2.659
  376    HG2  GLU  43           2HG      GLU  43  -4.343 -10.226  -5.156
  377    HG3  GLU  43           3HG      GLU  43  -3.971 -11.635  -4.168
  378    H    ARG  44           H        ARG  44  -5.886  -7.564  -1.940
  379    HA   ARG  44           HA       ARG  44  -7.495  -8.320   0.280
  380    HB2  ARG  44           2HB      ARG  44  -5.279  -7.061   0.392
  381    HB3  ARG  44           3HB      ARG  44  -6.144  -5.612  -0.101
  382    HG2  ARG  44           2HG      ARG  44  -5.769  -5.711   2.353
  383    HG3  ARG  44           3HG      ARG  44  -7.490  -5.670   1.953
  384    HD2  ARG  44           2HD      ARG  44  -7.661  -8.086   2.291
  385    HD3  ARG  44           3HD      ARG  44  -5.928  -8.202   2.583
  386    HE   ARG  44           HE       ARG  44  -6.488  -6.644   4.575
  387   HH11  ARG  44          1HH1      ARG  44  -8.584  -9.195   3.356
  388   HH12  ARG  44          2HH1      ARG  44  -9.299  -9.528   4.906
  389   HH21  ARG  44          1HH2      ARG  44  -7.310  -7.205   6.648
  390   HH22  ARG  44          2HH2      ARG  44  -8.571  -8.394   6.777
  391    H    MET  45           H        MET  45  -7.932  -5.956  -2.277
  392    HA   MET  45           HA       MET  45 -10.298  -4.803  -1.000
  393    HB2  MET  45           2HB      MET  45  -8.782  -3.994  -3.503
  394    HB3  MET  45           3HB      MET  45 -10.280  -3.231  -2.998
  395    HG2  MET  45           2HG      MET  45  -9.088  -2.748  -0.760
  396    HG3  MET  45           3HG      MET  45  -7.604  -3.179  -1.611
  397    HE1  MET  45           3HE      MET  45 -10.783  -1.283  -3.072
  398    HE2  MET  45           1HE      MET  45 -10.298   0.389  -2.792
  399    HE3  MET  45           2HE      MET  45 -10.632  -0.671  -1.424
  400    H    ASP  46           H        ASP  46  -9.701  -7.363  -3.139
  401    HA   ASP  46           HA       ASP  46 -11.953  -7.293  -4.804
  402    HB2  ASP  46           2HB      ASP  46 -10.082  -8.897  -5.097
  403    HB3  ASP  46           3HB      ASP  46 -10.590  -9.774  -3.661
  404    HA   PRO  47           HA       PRO  47 -14.601  -9.476  -1.257
  405    HB2  PRO  47           2HB      PRO  47 -13.700  -9.222   1.335
  406    HB3  PRO  47           3HB      PRO  47 -13.289 -10.609   0.305
  407    HG2  PRO  47           2HG      PRO  47 -11.665  -8.138   0.850
  408    HG3  PRO  47           3HG      PRO  47 -11.156  -9.843   0.895
  409    HD2  PRO  47           2HD      PRO  47 -10.631  -8.318  -1.240
  410    HD3  PRO  47           3HD      PRO  47 -11.093 -10.025  -1.436
  411    H    ILE  48           H        ILE  48 -12.809  -6.493  -0.789
  412    HA   ILE  48           HA       ILE  48 -14.689  -5.105   0.884
  413    HB   ILE  48           HB       ILE  48 -12.399  -4.070  -0.852
  414   HG12  ILE  48          2HG1      ILE  48 -11.593  -5.646   0.850
  415   HG13  ILE  48          3HG1      ILE  48 -11.060  -4.019   1.236
  416   HG21  ILE  48          1HG2      ILE  48 -12.417  -2.033   0.525
  417   HG22  ILE  48          2HG2      ILE  48 -13.859  -2.601   1.364
  418   HG23  ILE  48          3HG2      ILE  48 -13.929  -2.233  -0.360
  419   HD11  ILE  48          3HD1      ILE  48 -13.305  -5.526   2.579
  420   HD12  ILE  48          1HD1      ILE  48 -12.800  -3.879   2.969
  421   HD13  ILE  48          2HD1      ILE  48 -11.693  -5.225   3.226
  422    H    LYS  49           H        LYS  49 -14.127  -5.362  -2.591
  423    HA   LYS  49           HA       LYS  49 -15.972  -3.342  -3.471
  424    HB2  LYS  49           2HB      LYS  49 -14.719  -5.744  -4.875
  425    HB3  LYS  49           3HB      LYS  49 -15.683  -4.522  -5.706
  426    HG2  LYS  49           2HG      LYS  49 -14.040  -2.826  -5.351
  427    HG3  LYS  49           3HG      LYS  49 -13.199  -3.784  -4.133
  428    HD2  LYS  49           2HD      LYS  49 -11.922  -3.735  -6.230
  429    HD3  LYS  49           3HD      LYS  49 -12.457  -5.374  -5.862
  430    HE2  LYS  49           2HE      LYS  49 -14.327  -5.086  -7.481
  431    HE3  LYS  49           3HE      LYS  49 -13.701  -3.482  -7.880
  432    HZ1  LYS  49           3HZ      LYS  49 -12.984  -5.170  -9.466
  433    HZ2  LYS  49           1HZ      LYS  49 -12.218  -6.040  -8.233
  434    HZ3  LYS  49           2HZ      LYS  49 -11.664  -4.501  -8.654
  435    H    LYS  50           H        LYS  50 -16.135  -6.799  -2.774
  436    HA   LYS  50           HA       LYS  50 -18.848  -7.228  -3.530
  437    HB2  LYS  50           2HB      LYS  50 -17.185  -9.033  -3.352
  438    HB3  LYS  50           3HB      LYS  50 -17.010  -8.758  -1.632
  439    HG2  LYS  50           2HG      LYS  50 -19.695  -9.577  -2.767
  440    HG3  LYS  50           3HG      LYS  50 -18.442 -10.787  -2.530
  441    HD2  LYS  50           2HD      LYS  50 -19.696  -9.043  -0.370
  442    HD3  LYS  50           3HD      LYS  50 -19.974 -10.766  -0.622
  443    HE2  LYS  50           2HE      LYS  50 -17.331  -9.498   0.185
  444    HE3  LYS  50           3HE      LYS  50 -18.423 -10.385   1.246
  445    HZ1  LYS  50           3HZ      LYS  50 -18.062 -12.359  -0.087
  446    HZ2  LYS  50           1HZ      LYS  50 -16.599 -11.765   0.511
  447    HZ3  LYS  50           2HZ      LYS  50 -17.010 -11.514  -1.108
  448    H    LEU  51           H        LEU  51 -17.291  -6.066  -0.582
  449    HA   LEU  51           HA       LEU  51 -19.606  -6.197   1.123
  450    HB2  LEU  51           2HB      LEU  51 -17.042  -4.565   1.325
  451    HB3  LEU  51           3HB      LEU  51 -18.296  -4.521   2.557
  452    HG   LEU  51           HG       LEU  51 -16.727  -7.015   1.771
  453   HD11  LEU  51          1HD1      LEU  51 -15.273  -5.390   2.891
  454   HD12  LEU  51          2HD1      LEU  51 -15.560  -6.798   3.906
  455   HD13  LEU  51          3HD1      LEU  51 -16.404  -5.284   4.244
  456   HD21  LEU  51          3HD2      LEU  51 -17.730  -8.037   3.772
  457   HD22  LEU  51          1HD2      LEU  51 -18.949  -7.582   2.583
  458   HD23  LEU  51          2HD2      LEU  51 -18.711  -6.590   4.024
  459    H    GLY  52           H        GLY  52 -18.270  -3.870  -1.135
  460    HA2  GLY  52           2HA      GLY  52 -19.592  -2.498  -2.485
  461    HA3  GLY  52           3HA      GLY  52 -20.893  -2.568  -1.314
  462    H    CYS  53           H        CYS  53 -17.705  -1.854  -0.164
  463    HA   CYS  53           HA       CYS  53 -18.571   0.646   0.912
  464    HB2  CYS  53           2HB      CYS  53 -15.830  -0.647   0.840
  465    HB3  CYS  53           3HB      CYS  53 -16.234   0.802   1.766
  466    H    LYS  54           H        LYS  54 -19.004   2.207  -0.503
  467    HA   LYS  54           HA       LYS  54 -17.811   2.909  -2.924
  468    HB2  LYS  54           2HB      LYS  54 -19.145   4.732  -0.866
  469    HB3  LYS  54           3HB      LYS  54 -18.903   5.140  -2.559
  470    HG2  LYS  54           2HG      LYS  54 -20.612   2.823  -1.591
  471    HG3  LYS  54           3HG      LYS  54 -21.244   4.427  -1.956
  472    HD2  LYS  54           2HD      LYS  54 -19.837   2.603  -3.946
  473    HD3  LYS  54           3HD      LYS  54 -21.585   2.817  -3.819
  474    HE2  LYS  54           2HE      LYS  54 -21.318   5.227  -4.364
  475    HE3  LYS  54           3HE      LYS  54 -19.578   4.990  -4.528
  476    HZ1  LYS  54           3HZ      LYS  54 -20.718   4.987  -6.670
  477    HZ2  LYS  54           1HZ      LYS  54 -21.649   3.658  -6.187
  478    HZ3  LYS  54           2HZ      LYS  54 -19.977   3.498  -6.369
  479    H    ARG  55           H        ARG  55 -17.332   4.404   0.270
  480    HA   ARG  55           HA       ARG  55 -14.665   5.413  -0.499
  481    HB2  ARG  55           2HB      ARG  55 -16.061   7.196   0.323
  482    HB3  ARG  55           3HB      ARG  55 -16.621   6.242   1.687
  483    HG2  ARG  55           2HG      ARG  55 -15.049   8.037   2.355
  484    HG3  ARG  55           3HG      ARG  55 -14.456   6.434   2.786
  485    HD2  ARG  55           2HD      ARG  55 -12.639   7.825   1.927
  486    HD3  ARG  55           3HD      ARG  55 -12.942   6.473   0.838
  487    HE   ARG  55           HE       ARG  55 -13.970   7.985  -0.712
  488   HH11  ARG  55          1HH1      ARG  55 -12.309   9.611   1.943
  489   HH12  ARG  55          2HH1      ARG  55 -12.164  11.110   1.079
  490   HH21  ARG  55          1HH2      ARG  55 -13.719   9.957  -1.832
  491   HH22  ARG  55          2HH2      ARG  55 -12.961  11.300  -1.044
  492    H    VAL  56           H        VAL  56 -12.972   4.351   0.200
  493    HA   VAL  56           HA       VAL  56 -13.050   2.852   2.756
  494    HB   VAL  56           HB       VAL  56 -11.295   1.350   1.843
  495   HG11  VAL  56          1HG1      VAL  56 -13.808   1.422   0.132
  496   HG12  VAL  56          2HG1      VAL  56 -13.626   0.636   1.702
  497   HG13  VAL  56          3HG1      VAL  56 -12.723   0.037   0.312
  498   HG21  VAL  56          3HG2      VAL  56 -11.737   2.750  -0.832
  499   HG22  VAL  56          1HG2      VAL  56 -10.742   1.312  -0.569
  500   HG23  VAL  56          2HG2      VAL  56 -10.280   2.848   0.159
  501    H    ARG  57           H        ARG  57 -11.397   3.282   4.181
  502    HA   ARG  57           HA       ARG  57  -9.283   5.206   3.375
  503    HB2  ARG  57           2HB      ARG  57 -10.688   6.059   5.201
  504    HB3  ARG  57           3HB      ARG  57 -10.438   4.589   6.136
  505    HG2  ARG  57           2HG      ARG  57  -8.063   5.122   6.414
  506    HG3  ARG  57           3HG      ARG  57  -8.233   6.541   5.379
  507    HD2  ARG  57           2HD      ARG  57  -9.717   6.182   8.006
  508    HD3  ARG  57           3HD      ARG  57  -8.179   7.030   7.851
  509    HE   ARG  57           HE       ARG  57  -9.299   8.648   6.400
  510   HH11  ARG  57          1HH1      ARG  57 -11.422   6.689   8.428
  511   HH12  ARG  57          2HH1      ARG  57 -12.710   7.849   8.382
  512   HH21  ARG  57          1HH2      ARG  57 -10.976  10.134   6.361
  513   HH22  ARG  57          2HH2      ARG  57 -12.453   9.804   7.208
  514    H    ILE  58           H        ILE  58  -7.600   4.042   2.763
  515    HA   ILE  58           HA       ILE  58  -6.824   1.542   4.136
  516    HB   ILE  58           HB       ILE  58  -5.666   2.665   1.526
  517   HG12  ILE  58          2HG1      ILE  58  -7.931   0.624   1.785
  518   HG13  ILE  58          3HG1      ILE  58  -8.124   2.287   1.249
  519   HG21  ILE  58          1HG2      ILE  58  -4.266   0.990   2.680
  520   HG22  ILE  58          2HG2      ILE  58  -4.889   0.343   1.166
  521   HG23  ILE  58          3HG2      ILE  58  -5.612  -0.153   2.698
  522   HD11  ILE  58          3HD1      ILE  58  -6.744   1.820  -0.714
  523   HD12  ILE  58          1HD1      ILE  58  -8.142   0.751  -0.614
  524   HD13  ILE  58          2HD1      ILE  58  -6.546   0.148  -0.176
  525    H    SER  59           H        SER  59  -5.390   1.944   5.755
  526    HA   SER  59           HA       SER  59  -3.385   4.090   5.534
  527    HB2  SER  59           2HB      SER  59  -4.278   2.423   7.944
  528    HB3  SER  59           3HB      SER  59  -3.136   3.771   7.985
  529    HG   SER  59           HG       SER  59  -5.115   4.874   6.875
  530    H    ILE  60           H        ILE  60  -1.709   3.284   4.410
  531    HA   ILE  60           HA       ILE  60  -0.700   0.555   4.907
  532    HB   ILE  60           HB       ILE  60  -0.090   2.531   2.658
  533   HG12  ILE  60          2HG1      ILE  60  -1.602  -0.126   2.624
  534   HG13  ILE  60          3HG1      ILE  60  -2.334   1.470   2.507
  535   HG21  ILE  60          1HG2      ILE  60   1.251   0.731   1.606
  536   HG22  ILE  60          2HG2      ILE  60   1.010  -0.280   3.033
  537   HG23  ILE  60          3HG2      ILE  60   1.930   1.220   3.160
  538   HD11  ILE  60          3HD1      ILE  60  -1.170   1.815   0.362
  539   HD12  ILE  60          1HD1      ILE  60  -2.257   0.427   0.351
  540   HD13  ILE  60          2HD1      ILE  60  -0.517   0.178   0.478
  541    H    ARG  61           H        ARG  61   0.790   0.463   6.475
  542    HA   ARG  61           HA       ARG  61   2.802   2.608   6.782
  543    HB2  ARG  61           2HB      ARG  61   2.032   0.273   8.600
  544    HB3  ARG  61           3HB      ARG  61   3.382   1.364   8.917
  545    HG2  ARG  61           2HG      ARG  61   1.779   3.274   8.962
  546    HG3  ARG  61           3HG      ARG  61   0.452   2.133   8.761
  547    HD2  ARG  61           2HD      ARG  61   0.891   1.138  10.922
  548    HD3  ARG  61           3HD      ARG  61   2.394   2.056  11.095
  549    HE   ARG  61           HE       ARG  61   0.232   3.844  10.737
  550   HH11  ARG  61          1HH1      ARG  61   1.524   1.691  13.218
  551   HH12  ARG  61          2HH1      ARG  61   0.878   2.633  14.530
  552   HH21  ARG  61          1HH2      ARG  61  -0.566   5.080  12.469
  553   HH22  ARG  61          2HH2      ARG  61  -0.306   4.553  14.103
  554    H    VAL  62           H        VAL  62   4.734   2.305   5.895
  555    HA   VAL  62           HA       VAL  62   5.526  -0.321   4.829
  556    HB   VAL  62           HB       VAL  62   5.692   1.636   3.293
  557   HG11  VAL  62          1HG1      VAL  62   7.753   2.777   5.201
  558   HG12  VAL  62          2HG1      VAL  62   6.139   3.433   4.907
  559   HG13  VAL  62          3HG1      VAL  62   7.337   3.428   3.610
  560   HG21  VAL  62          3HG2      VAL  62   8.046   1.357   2.542
  561   HG22  VAL  62          1HG2      VAL  62   7.264  -0.178   2.917
  562   HG23  VAL  62          2HG2      VAL  62   8.412   0.523   4.056
  563    H    LYS  63           H        LYS  63   7.121  -1.533   5.855
  564    HA   LYS  63           HA       LYS  63   8.177  -0.545   8.382
  565    HB2  LYS  63           2HB      LYS  63   7.318  -2.919   7.951
  566    HB3  LYS  63           3HB      LYS  63   8.768  -3.203   7.012
  567    HG2  LYS  63           2HG      LYS  63   8.861  -2.372   9.928
  568    HG3  LYS  63           3HG      LYS  63   8.740  -4.061   9.432
  569    HD2  LYS  63           2HD      LYS  63  10.878  -3.899   8.246
  570    HD3  LYS  63           3HD      LYS  63  10.984  -2.179   8.620
  571    HE2  LYS  63           2HE      LYS  63  11.023  -2.819  11.075
  572    HE3  LYS  63           3HE      LYS  63  11.183  -4.501  10.555
  573    HZ1  LYS  63           3HZ      LYS  63  13.342  -3.560  10.997
  574    HZ2  LYS  63           1HZ      LYS  63  13.060  -2.280   9.926
  575    HZ3  LYS  63           2HZ      LYS  63  13.202  -3.862   9.342
  576    H    HIS  64           H        HIS  64   9.994   0.557   8.492
  577    HA   HIS  64           HA       HIS  64  11.634   1.125   6.205
  578    HB2  HIS  64           2HB      HIS  64  12.154   1.821   9.127
  579    HB3  HIS  64           3HB      HIS  64  12.888   2.590   7.725
  580    HD1  HIS  64           HD1      HIS  64  10.886   3.654  10.159
  581    HD2  HIS  64           HD2      HIS  64  10.212   3.437   6.061
  582    HE1  HIS  64           HE1      HIS  64   9.105   5.339   9.682
  583    HE2  HIS  64           HE2      HIS  64   8.567   5.035   7.254
  584    H    SER  65           H        SER  65  13.517   0.164   5.655
  585    HA   SER  65           HA       SER  65  14.340  -2.294   6.701
  586    HB2  SER  65           2HB      SER  65  14.794  -1.602   4.386
  587    HB3  SER  65           3HB      SER  65  15.887  -0.341   4.952
  588    HG   SER  65           HG       SER  65  17.376  -1.809   5.417
  589    H    ASP  66           H        ASP  66  15.668   0.978   7.204
  590    HA   ASP  66           HA       ASP  66  16.844   0.254   9.765
  591    HB2  ASP  66           2HB      ASP  66  18.635  -0.436   8.223
  592    HB3  ASP  66           3HB      ASP  66  18.596   1.121   7.416
  593    H    ALA  67           H        ALA  67  17.798   2.172  10.860
  594    HA   ALA  67           HA       ALA  67  16.074   4.336  11.035
  595    HB1  ALA  67           3HB      ALA  67  17.723   5.298  12.588
  596    HB2  ALA  67           1HB      ALA  67  18.948   4.166  12.000
  597    HB3  ALA  67           2HB      ALA  67  17.532   3.566  12.862
  598    H    ALA  68           H        ALA  68  19.320   4.244   9.506
  599    HA   ALA  68           HA       ALA  68  19.279   6.962   8.586
  600    HB1  ALA  68           3HB      ALA  68  21.262   6.332   7.258
  601    HB2  ALA  68           1HB      ALA  68  20.973   4.628   7.632
  602    HB3  ALA  68           2HB      ALA  68  21.386   5.759   8.920
  603    H    GLU  69           H        GLU  69  18.197   3.904   7.287
  604    HA   GLU  69           HA       GLU  69  17.783   4.775   4.570
  605    HB2  GLU  69           2HB      GLU  69  16.831   2.280   6.034
  606    HB3  GLU  69           3HB      GLU  69  16.586   2.577   4.314
  607    HG2  GLU  69           2HG      GLU  69  19.089   2.706   4.054
  608    HG3  GLU  69           3HG      GLU  69  19.229   2.202   5.739
  609    H    GLU  70           H        GLU  70  15.941   5.214   7.441
  610    HA   GLU  70           HA       GLU  70  13.315   4.793   6.638
  611    HB2  GLU  70           2HB      GLU  70  14.342   6.923   8.568
  612    HB3  GLU  70           3HB      GLU  70  12.645   6.489   8.385
  613    HG2  GLU  70           2HG      GLU  70  13.206   4.175   9.094
  614    HG3  GLU  70           3HG      GLU  70  14.862   4.686   9.377
  615    H    LYS  71           H        LYS  71  15.125   7.861   6.475
  616    HA   LYS  71           HA       LYS  71  13.001   9.412   5.397
  617    HB2  LYS  71           2HB      LYS  71  16.001   9.974   5.313
  618    HB3  LYS  71           3HB      LYS  71  14.718  11.163   5.080
  619    HG2  LYS  71           2HG      LYS  71  13.969  10.831   7.403
  620    HG3  LYS  71           3HG      LYS  71  15.219   9.606   7.638
  621    HD2  LYS  71           2HD      LYS  71  16.957  11.363   7.181
  622    HD3  LYS  71           3HD      LYS  71  15.668  12.568   7.086
  623    HE2  LYS  71           2HE      LYS  71  16.360  10.882   9.518
  624    HE3  LYS  71           3HE      LYS  71  16.740  12.588   9.297
  625    HZ1  LYS  71           3HZ      LYS  71  13.997  11.457   9.409
  626    HZ2  LYS  71           1HZ      LYS  71  14.399  13.096   9.293
  627    HZ3  LYS  71           2HZ      LYS  71  14.785  12.225  10.694
  628    H    LYS  72           H        LYS  72  15.826   7.847   3.930
  629    HA   LYS  72           HA       LYS  72  15.515   8.795   1.284
  630    HB2  LYS  72           2HB      LYS  72  17.635   7.860   2.114
  631    HB3  LYS  72           3HB      LYS  72  16.891   6.281   2.346
  632    HG2  LYS  72           2HG      LYS  72  16.596   6.021  -0.064
  633    HG3  LYS  72           3HG      LYS  72  17.220   7.645  -0.352
  634    HD2  LYS  72           2HD      LYS  72  18.799   5.322   0.831
  635    HD3  LYS  72           3HD      LYS  72  18.901   5.884  -0.839
  636    HE2  LYS  72           2HE      LYS  72  19.686   7.466   1.633
  637    HE3  LYS  72           3HE      LYS  72  20.788   6.736   0.468
  638    HZ1  LYS  72           3HZ      LYS  72  20.586   9.048  -0.004
  639    HZ2  LYS  72           1HZ      LYS  72  18.896   8.963  -0.042
  640    HZ3  LYS  72           2HZ      LYS  72  19.807   8.197  -1.234
  641    H    GLU  73           H        GLU  73  14.704   5.623   2.695
  642    HA   GLU  73           HA       GLU  73  13.525   4.650   0.285
  643    HB2  GLU  73           2HB      GLU  73  13.636   3.437   3.076
  644    HB3  GLU  73           3HB      GLU  73  12.991   2.612   1.660
  645    HG2  GLU  73           2HG      GLU  73  15.843   3.505   2.111
  646    HG3  GLU  73           3HG      GLU  73  15.235   1.853   2.060
  647    H    ALA  74           H        ALA  74  12.149   6.330   3.055
  648    HA   ALA  74           HA       ALA  74   9.454   5.406   2.631
  649    HB1  ALA  74           3HB      ALA  74  10.116   6.408   4.782
  650    HB2  ALA  74           1HB      ALA  74   8.759   7.276   4.064
  651    HB3  ALA  74           2HB      ALA  74  10.387   7.961   3.991
  652    H    LYS  75           H        LYS  75  11.302   8.277   1.654
  653    HA   LYS  75           HA       LYS  75   9.375   9.509   0.006
  654    HB2  LYS  75           2HB      LYS  75  11.412  10.631   0.888
  655    HB3  LYS  75           3HB      LYS  75  12.420   9.648  -0.168
  656    HG2  LYS  75           2HG      LYS  75  11.398  10.714  -2.150
  657    HG3  LYS  75           3HG      LYS  75  10.354  11.677  -1.099
  658    HD2  LYS  75           2HD      LYS  75  12.373  12.761  -0.112
  659    HD3  LYS  75           3HD      LYS  75  13.398  11.812  -1.194
  660    HE2  LYS  75           2HE      LYS  75  11.329  13.864  -2.059
  661    HE3  LYS  75           3HE      LYS  75  13.076  14.099  -2.036
  662    HZ1  LYS  75           3HZ      LYS  75  12.289  13.574  -4.248
  663    HZ2  LYS  75           1HZ      LYS  75  11.617  12.123  -3.700
  664    HZ3  LYS  75           2HZ      LYS  75  13.292  12.341  -3.676
  665    H    LYS  76           H        LYS  76  11.820   7.037  -0.729
  666    HA   LYS  76           HA       LYS  76  11.389   6.955  -3.570
  667    HB2  LYS  76           2HB      LYS  76  12.661   4.950  -1.655
  668    HB3  LYS  76           3HB      LYS  76  12.632   4.730  -3.407
  669    HG2  LYS  76           2HG      LYS  76  13.968   6.729  -3.734
  670    HG3  LYS  76           3HG      LYS  76  13.879   7.114  -2.018
  671    HD2  LYS  76           2HD      LYS  76  16.058   6.216  -2.431
  672    HD3  LYS  76           3HD      LYS  76  15.151   5.000  -1.535
  673    HE2  LYS  76           2HE      LYS  76  15.466   4.914  -4.549
  674    HE3  LYS  76           3HE      LYS  76  16.612   4.163  -3.443
  675    HZ1  LYS  76           3HZ      LYS  76  14.659   2.920  -2.508
  676    HZ2  LYS  76           1HZ      LYS  76  15.117   2.494  -4.080
  677    HZ3  LYS  76           2HZ      LYS  76  13.762   3.466  -3.834
  678    H    PHE  77           H        PHE  77  10.130   5.097  -0.810
  679    HA   PHE  77           HA       PHE  77   8.648   3.242  -2.455
  680    HB2  PHE  77           2HB      PHE  77   9.688   2.934   0.017
  681    HB3  PHE  77           3HB      PHE  77   8.084   3.456   0.511
  682    HD1  PHE  77           HD1      PHE  77  10.013   0.849  -1.299
  683    HD2  PHE  77           HD2      PHE  77   6.178   1.949   0.261
  684    HE1  PHE  77           HE1      PHE  77   9.200  -1.463  -1.618
  685    HE2  PHE  77           HE2      PHE  77   5.385  -0.358  -0.057
  686    HZ   PHE  77           HZ       PHE  77   6.892  -2.055  -0.990
  687    H    ALA  78           H        ALA  78   8.113   6.319  -1.023
  688    HA   ALA  78           HA       ALA  78   5.303   6.512  -1.085
  689    HB1  ALA  78           3HB      ALA  78   6.734   8.256  -0.100
  690    HB2  ALA  78           1HB      ALA  78   5.650   8.943  -1.311
  691    HB3  ALA  78           2HB      ALA  78   7.353   8.677  -1.697
  692    H    ALA  79           H        ALA  79   7.771   7.091  -3.588
  693    HA   ALA  79           HA       ALA  79   5.949   7.676  -5.723
  694    HB1  ALA  79           3HB      ALA  79   8.255   8.537  -5.684
  695    HB2  ALA  79           1HB      ALA  79   7.956   7.600  -7.149
  696    HB3  ALA  79           2HB      ALA  79   8.886   6.896  -5.821
  697    H    ILE  80           H        ILE  80   7.568   4.715  -4.565
  698    HA   ILE  80           HA       ILE  80   6.886   2.964  -6.680
  699    HB   ILE  80           HB       ILE  80   7.279   2.326  -3.715
  700   HG12  ILE  80          2HG1      ILE  80   9.310   3.245  -4.703
  701   HG13  ILE  80          3HG1      ILE  80   9.545   1.532  -4.420
  702   HG21  ILE  80          1HG2      ILE  80   7.212   0.354  -6.026
  703   HG22  ILE  80          2HG2      ILE  80   5.995   0.509  -4.759
  704   HG23  ILE  80          3HG2      ILE  80   7.624  -0.026  -4.352
  705   HD11  ILE  80          3HD1      ILE  80  10.525   2.165  -6.507
  706   HD12  ILE  80          1HD1      ILE  80   9.008   2.860  -7.079
  707   HD13  ILE  80          2HD1      ILE  80   9.147   1.116  -6.825
  708    H    LEU  81           H        LEU  81   5.231   3.589  -3.561
  709    HA   LEU  81           HA       LEU  81   2.979   1.955  -3.958
  710    HB2  LEU  81           2HB      LEU  81   3.557   4.325  -2.143
  711    HB3  LEU  81           3HB      LEU  81   1.939   3.647  -2.192
  712    HG   LEU  81           HG       LEU  81   4.426   2.054  -1.434
  713   HD11  LEU  81          1HD1      LEU  81   3.635   2.189   0.891
  714   HD12  LEU  81          2HD1      LEU  81   2.313   3.252   0.398
  715   HD13  LEU  81          3HD1      LEU  81   3.986   3.790   0.243
  716   HD21  LEU  81          3HD2      LEU  81   1.475   1.336  -1.245
  717   HD22  LEU  81          1HD2      LEU  81   2.815   0.366  -0.621
  718   HD23  LEU  81          2HD2      LEU  81   2.660   0.637  -2.353
  719    H    ASN  82           H        ASN  82   3.587   5.383  -4.652
  720    HA   ASN  82           HA       ASN  82   0.928   6.126  -5.325
  721    HB2  ASN  82           2HB      ASN  82   2.693   7.756  -4.642
  722    HB3  ASN  82           3HB      ASN  82   3.546   7.470  -6.154
  723   HD21  ASN  82          1HD2      ASN  82   3.394   9.717  -6.590
  724   HD22  ASN  82          2HD2      ASN  82   1.920  10.442  -7.130
  725    H    LYS  83           H        LYS  83   3.628   4.863  -7.231
  726    HA   LYS  83           HA       LYS  83   2.293   5.059  -9.763
  727    HB2  LYS  83           2HB      LYS  83   4.799   3.648  -8.816
  728    HB3  LYS  83           3HB      LYS  83   4.125   3.242 -10.391
  729    HG2  LYS  83           2HG      LYS  83   4.982   6.024  -9.519
  730    HG3  LYS  83           3HG      LYS  83   5.901   4.938 -10.570
  731    HD2  LYS  83           2HD      LYS  83   4.049   4.981 -12.228
  732    HD3  LYS  83           3HD      LYS  83   3.143   6.082 -11.184
  733    HE2  LYS  83           2HE      LYS  83   4.202   7.343 -12.952
  734    HE3  LYS  83           3HE      LYS  83   4.983   7.753 -11.425
  735    HZ1  LYS  83           3HZ      LYS  83   6.627   7.454 -13.116
  736    HZ2  LYS  83           1HZ      LYS  83   6.026   5.926 -13.526
  737    HZ3  LYS  83           2HZ      LYS  83   6.761   6.172 -12.023
  738    H    VAL  84           H        VAL  84   2.437   2.542  -7.253
  739    HA   VAL  84           HA       VAL  84   1.177   0.457  -8.745
  740    HB   VAL  84           HB       VAL  84   1.351   0.929  -5.725
  741   HG11  VAL  84          1HG1      VAL  84  -0.576  -0.531  -6.179
  742   HG12  VAL  84          2HG1      VAL  84   0.728  -1.448  -5.436
  743   HG13  VAL  84          3HG1      VAL  84   0.427  -1.592  -7.167
  744   HG21  VAL  84          3HG2      VAL  84   3.516   0.588  -6.846
  745   HG22  VAL  84          1HG2      VAL  84   2.933  -0.921  -7.551
  746   HG23  VAL  84          2HG2      VAL  84   3.127  -0.775  -5.802
  747    H    PHE  85           H        PHE  85   0.000   3.026  -6.683
  748    HA   PHE  85           HA       PHE  85  -2.761   2.473  -6.764
  749    HB2  PHE  85           2HB      PHE  85  -1.326   5.147  -6.446
  750    HB3  PHE  85           3HB      PHE  85  -3.048   4.913  -6.171
  751    HD1  PHE  85           HD1      PHE  85  -3.086   2.300  -4.713
  752    HD2  PHE  85           HD2      PHE  85  -0.468   5.652  -4.277
  753    HE1  PHE  85           HE1      PHE  85  -2.613   1.649  -2.384
  754    HE2  PHE  85           HE2      PHE  85  -0.003   4.988  -1.961
  755    HZ   PHE  85           HZ       PHE  85  -1.071   2.988  -1.014
  756    H    ALA  86           H        ALA  86  -0.683   4.383  -8.942
  757    HA   ALA  86           HA       ALA  86  -2.742   5.095 -10.804
  758    HB1  ALA  86           3HB      ALA  86   0.276   4.984 -11.194
  759    HB2  ALA  86           1HB      ALA  86  -0.652   6.372 -10.627
  760    HB3  ALA  86           2HB      ALA  86  -0.875   5.781 -12.273
  761    H    GLU  87           H        GLU  87  -0.699   2.250 -10.413
  762    HA   GLU  87           HA       GLU  87  -0.992   1.027 -12.960
  763    HB2  GLU  87           2HB      GLU  87  -0.448  -0.151 -10.199
  764    HB3  GLU  87           3HB      GLU  87  -0.507  -1.148 -11.639
  765    HG2  GLU  87           2HG      GLU  87   1.458   1.121 -11.250
  766    HG3  GLU  87           3HG      GLU  87   1.790  -0.555 -10.831
  767    H    LEU  88           H        LEU  88  -3.098   1.183 -10.133
  768    HA   LEU  88           HA       LEU  88  -4.801  -1.006 -11.169
  769    HB2  LEU  88           2HB      LEU  88  -4.503   0.012  -8.317
  770    HB3  LEU  88           3HB      LEU  88  -5.594  -1.267  -8.827
  771    HG   LEU  88           HG       LEU  88  -2.552  -1.371  -8.810
  772   HD11  LEU  88          1HD1      LEU  88  -2.859  -3.171  -7.169
  773   HD12  LEU  88          2HD1      LEU  88  -4.606  -2.938  -7.224
  774   HD13  LEU  88          3HD1      LEU  88  -3.560  -1.654  -6.611
  775   HD21  LEU  88          3HD2      LEU  88  -2.736  -3.703  -9.606
  776   HD22  LEU  88          1HD2      LEU  88  -3.335  -2.553 -10.800
  777   HD23  LEU  88          2HD2      LEU  88  -4.475  -3.490  -9.831
  778    H    GLY  89           H        GLY  89  -4.708   2.354 -10.851
  779    HA2  GLY  89           2HA      GLY  89  -6.332   3.765 -11.800
  780    HA3  GLY  89           3HA      GLY  89  -7.557   2.532 -11.560
  781    H    TYR  90           H        TYR  90  -5.290   4.201  -9.409
  782    HA   TYR  90           HA       TYR  90  -7.529   5.402  -7.881
  783    HB2  TYR  90           2HB      TYR  90  -4.695   4.867  -6.865
  784    HB3  TYR  90           3HB      TYR  90  -5.998   5.599  -5.944
  785    HD1  TYR  90           HD1      TYR  90  -4.739   2.418  -7.392
  786    HD2  TYR  90           HD2      TYR  90  -7.619   4.182  -4.769
  787    HE1  TYR  90           HE1      TYR  90  -5.245   0.207  -6.471
  788    HE2  TYR  90           HE2      TYR  90  -8.129   1.944  -3.856
  789    HH   TYR  90           HH       TYR  90  -7.924  -0.375  -4.416
  790    H    ASN  91           H        ASN  91  -7.331   7.634  -7.513
  791    HA   ASN  91           HA       ASN  91  -5.722   9.145  -9.373
  792    HB2  ASN  91           2HB      ASN  91  -7.542  10.083  -7.105
  793    HB3  ASN  91           3HB      ASN  91  -6.886  11.112  -8.379
  794   HD21  ASN  91          1HD2      ASN  91  -7.807  10.995 -10.455
  795   HD22  ASN  91          2HD2      ASN  91  -9.266  10.134 -10.783
  796    H    ASP  92           H        ASP  92  -4.224  10.870  -8.740
  797    HA   ASP  92           HA       ASP  92  -2.278  10.153  -6.814
  798    HB2  ASP  92           2HB      ASP  92  -1.838  11.513  -8.876
  799    HB3  ASP  92           3HB      ASP  92  -2.745  12.852  -8.183
  800    H    SER  93           H        SER  93  -4.942  12.434  -6.811
  801    HA   SER  93           HA       SER  93  -4.747  13.799  -4.459
  802    HB2  SER  93           2HB      SER  93  -7.291  12.593  -5.608
  803    HB3  SER  93           3HB      SER  93  -7.192  14.011  -4.556
  804    HG   SER  93           HG       SER  93  -6.139  15.120  -6.178
  805    H    ASN  94           H        ASN  94  -5.767  10.439  -4.857
  806    HA   ASN  94           HA       ASN  94  -6.874   9.867  -2.343
  807    HB2  ASN  94           2HB      ASN  94  -5.307   8.001  -4.193
  808    HB3  ASN  94           3HB      ASN  94  -6.325   7.477  -2.852
  809   HD21  ASN  94          1HD2      ASN  94  -7.420   6.198  -4.460
  810   HD22  ASN  94          2HD2      ASN  94  -8.628   6.911  -5.471
  811    H    VAL  95           H        VAL  95  -3.523  10.078  -3.387
  812    HA   VAL  95           HA       VAL  95  -2.428   8.528  -1.176
  813    HB   VAL  95           HB       VAL  95  -0.908  10.062  -3.353
  814   HG11  VAL  95          1HG1      VAL  95   0.905   8.444  -2.943
  815   HG12  VAL  95          2HG1      VAL  95  -0.057   7.652  -1.695
  816   HG13  VAL  95          3HG1      VAL  95   0.491   9.313  -1.464
  817   HG21  VAL  95          3HG2      VAL  95  -0.877   7.985  -4.695
  818   HG22  VAL  95          1HG2      VAL  95  -2.518   8.596  -4.466
  819   HG23  VAL  95          2HG2      VAL  95  -1.953   7.214  -3.527
  820    H    THR  96           H        THR  96  -2.393   9.675   0.766
  821    HA   THR  96           HA       THR  96  -0.815  12.186   0.806
  822    HB   THR  96           HB       THR  96  -3.371  11.737   2.436
  823    HG1  THR  96           HG1      THR  96  -3.545  12.289   0.077
  824   HG21  THR  96          3HG2      THR  96  -1.673  13.110   3.638
  825   HG22  THR  96          1HG2      THR  96  -3.075  14.070   3.168
  826   HG23  THR  96          2HG2      THR  96  -1.576  14.198   2.250
  827    H    TRP  97           H        TRP  97   0.977  11.680   1.936
  828    HA   TRP  97           HA       TRP  97   1.067   9.611   3.963
  829    HB2  TRP  97           2HB      TRP  97   3.160  11.534   2.876
  830    HB3  TRP  97           3HB      TRP  97   3.493  10.488   4.251
  831    HD1  TRP  97           HD1      TRP  97   2.634  10.197   0.462
  832    HE1  TRP  97           HE1      TRP  97   3.514   7.931  -0.380
  833    HE3  TRP  97           HE3      TRP  97   4.251   8.211   4.911
  834    HZ2  TRP  97           HZ2      TRP  97   4.752   5.630   0.673
  835    HZ3  TRP  97           HZ3      TRP  97   5.273   5.968   4.896
  836    HH2  TRP  97           HH2      TRP  97   5.516   4.705   2.817
  837    H    ASP  98           H        ASP  98   0.455   9.934   5.969
  838    HA   ASP  98           HA       ASP  98   0.795  12.506   7.375
  839    HB2  ASP  98           2HB      ASP  98  -0.759   9.959   8.090
  840    HB3  ASP  98           3HB      ASP  98  -0.534  11.307   9.208
  841    H    GLY  99           H        GLY  99   3.035  12.425   7.584
  842    HA2  GLY  99           2HA      GLY  99   5.058  11.922   8.522
  843    HA3  GLY  99           3HA      GLY  99   4.192  10.970   9.720
  844    H    ASP 100           H        ASP 100   4.191   8.764   9.547
  845    HA   ASP 100           HA       ASP 100   5.863   7.571   7.407
  846    HB2  ASP 100           2HB      ASP 100   5.295   6.627  10.250
  847    HB3  ASP 100           3HB      ASP 100   6.263   5.737   9.081
  848    H    THR 101           H        THR 101   2.644   7.793   8.374
  849    HA   THR 101           HA       THR 101   1.888   5.186   7.156
  850    HB   THR 101           HB       THR 101   0.199   7.036   8.925
  851    HG1  THR 101           HG1      THR 101   2.039   5.905   9.952
  852   HG21  THR 101          3HG2      THR 101  -1.350   5.124   9.091
  853   HG22  THR 101          1HG2      THR 101  -0.339   4.174   7.999
  854   HG23  THR 101          2HG2      THR 101  -1.169   5.617   7.410
  855    H    VAL 102           H        VAL 102   0.913   5.328   5.126
  856    HA   VAL 102           HA       VAL 102   0.104   8.013   4.191
  857    HB   VAL 102           HB       VAL 102   1.677   6.843   2.705
  858   HG11  VAL 102          1HG1      VAL 102  -0.406   4.689   2.303
  859   HG12  VAL 102          2HG1      VAL 102   1.147   4.505   3.118
  860   HG13  VAL 102          3HG1      VAL 102   1.098   4.860   1.390
  861   HG21  VAL 102          3HG2      VAL 102   0.442   7.125   0.569
  862   HG22  VAL 102          1HG2      VAL 102   0.131   8.438   1.707
  863   HG23  VAL 102          2HG2      VAL 102  -1.076   7.175   1.468
  864    H    THR 103           H        THR 103  -1.967   8.527   4.355
  865    HA   THR 103           HA       THR 103  -4.062   6.504   4.664
  866    HB   THR 103           HB       THR 103  -4.210   9.552   4.919
  867    HG1  THR 103           HG1      THR 103  -3.196   9.159   6.720
  868   HG21  THR 103          3HG2      THR 103  -6.328   9.146   6.125
  869   HG22  THR 103          1HG2      THR 103  -6.189   7.414   5.813
  870   HG23  THR 103          2HG2      THR 103  -6.421   8.540   4.472
  871    H    VAL 104           H        VAL 104  -4.492   5.745   2.692
  872    HA   VAL 104           HA       VAL 104  -4.921   7.532   0.385
  873    HB   VAL 104           HB       VAL 104  -4.596   4.485   0.455
  874   HG11  VAL 104          1HG1      VAL 104  -5.913   5.213  -1.493
  875   HG12  VAL 104          2HG1      VAL 104  -4.329   4.634  -2.004
  876   HG13  VAL 104          3HG1      VAL 104  -4.657   6.369  -1.945
  877   HG21  VAL 104          3HG2      VAL 104  -2.342   4.847  -0.442
  878   HG22  VAL 104          1HG2      VAL 104  -2.523   5.632   1.124
  879   HG23  VAL 104          2HG2      VAL 104  -2.560   6.594  -0.356
  880    H    GLU 105           H        GLU 105  -7.012   8.158   0.320
  881    HA   GLU 105           HA       GLU 105  -9.142   6.227   1.000
  882    HB2  GLU 105           2HB      GLU 105  -9.252   9.256   0.667
  883    HB3  GLU 105           3HB      GLU 105 -10.641   8.226   1.010
  884    HG2  GLU 105           2HG      GLU 105  -9.460   7.491   3.136
  885    HG3  GLU 105           3HG      GLU 105  -8.244   8.721   2.799
  886    H    GLY 106           H        GLY 106  -9.890   5.126  -0.644
  887    HA2  GLY 106           2HA      GLY 106  -9.685   6.210  -3.408
  888    HA3  GLY 106           3HA      GLY 106  -9.432   4.527  -2.968
  889    H    GLN 107           H        GLN 107 -11.279   5.707  -4.872
  890    HA   GLN 107           HA       GLN 107 -13.824   4.605  -3.838
  891    HB2  GLN 107           2HB      GLN 107 -14.886   5.613  -5.826
  892    HB3  GLN 107           3HB      GLN 107 -14.067   6.824  -4.850
  893    HG2  GLN 107           2HG      GLN 107 -12.261   6.990  -6.444
  894    HG3  GLN 107           3HG      GLN 107 -12.876   5.613  -7.356
  895   HE21  GLN 107          1HE2      GLN 107 -14.713   5.895  -8.671
  896   HE22  GLN 107          2HE2      GLN 107 -15.261   7.460  -9.153
  897    H    LEU 108           H        LEU 108 -14.873   2.997  -5.018
  898    HA   LEU 108           HA       LEU 108 -13.621   1.692  -7.272
  899    HB2  LEU 108           2HB      LEU 108 -13.605  -0.590  -6.200
  900    HB3  LEU 108           3HB      LEU 108 -12.369   0.495  -5.629
  901    HG   LEU 108           HG       LEU 108 -13.143  -0.897  -3.806
  902   HD11  LEU 108          1HD1      LEU 108 -13.730   0.723  -2.087
  903   HD12  LEU 108          2HD1      LEU 108 -14.144   1.909  -3.327
  904   HD13  LEU 108          3HD1      LEU 108 -12.480   1.351  -3.162
  905   HD21  LEU 108          3HD2      LEU 108 -15.959   0.151  -4.199
  906   HD22  LEU 108          1HD2      LEU 108 -15.411  -0.925  -2.910
  907   HD23  LEU 108          2HD2      LEU 108 -15.392  -1.475  -4.584
  908    H    GLU 109           H        GLU 109 -15.041  -0.226  -8.003
  909    HA   GLU 109           HA       GLU 109 -17.787   0.672  -8.055
  910    HB2  GLU 109           2HB      GLU 109 -16.614  -0.275 -10.089
  911    HB3  GLU 109           3HB      GLU 109 -16.623  -1.854  -9.312
  912    HG2  GLU 109           2HG      GLU 109 -18.444  -1.690 -10.926
  913    HG3  GLU 109           3HG      GLU 109 -19.084  -1.842  -9.290
  914    H    GLY 110           H        GLY 110 -18.207   0.488  -5.827
  915    HA2  GLY 110           2HA      GLY 110 -18.204  -2.093  -4.491
  916    HA3  GLY 110           3HA      GLY 110 -18.693  -0.544  -3.819
  917    H    VAL 111           H        VAL 111 -19.753  -3.438  -5.335
  918    HA   VAL 111           HA       VAL 111 -22.397  -2.638  -6.082
  919    HB   VAL 111           HB       VAL 111 -21.449  -5.440  -5.336
  920   HG11  VAL 111          1HG1      VAL 111 -23.828  -4.569  -7.018
  921   HG12  VAL 111          2HG1      VAL 111 -23.894  -5.263  -5.397
  922   HG13  VAL 111          3HG1      VAL 111 -23.317  -6.239  -6.747
  923   HG21  VAL 111          3HG2      VAL 111 -21.048  -5.793  -7.759
  924   HG22  VAL 111          1HG2      VAL 111 -20.011  -4.524  -7.103
  925   HG23  VAL 111          2HG2      VAL 111 -21.426  -4.095  -8.067
  926    H    ASP 112           H        ASP 112 -23.899  -1.992  -4.701
  927    HA   ASP 112           HA       ASP 112 -23.651  -2.246  -1.868
  928    HB2  ASP 112           2HB      ASP 112 -24.659  -0.275  -3.094
  929    HB3  ASP 112           3HB      ASP 112 -26.045  -1.287  -3.478
  930    H    LEU 113           H        LEU 113 -23.971  -4.192  -0.971
  931    HA   LEU 113           HA       LEU 113 -26.233  -5.919  -1.779
  932    HB2  LEU 113           2HB      LEU 113 -23.851  -6.446   0.051
  933    HB3  LEU 113           3HB      LEU 113 -25.108  -7.619  -0.310
  934    HG   LEU 113           HG       LEU 113 -23.069  -6.486  -2.266
  935   HD11  LEU 113          1HD1      LEU 113 -22.162  -8.192  -0.771
  936   HD12  LEU 113          2HD1      LEU 113 -22.263  -8.797  -2.422
  937   HD13  LEU 113          3HD1      LEU 113 -23.455  -9.309  -1.222
  938   HD21  LEU 113          3HD2      LEU 113 -25.355  -8.401  -2.855
  939   HD22  LEU 113          1HD2      LEU 113 -24.049  -7.983  -3.970
  940   HD23  LEU 113          2HD2      LEU 113 -25.189  -6.747  -3.452
  941    H    GLU 114           H        GLU 114 -26.101  -3.329   0.016
  942    HA   GLU 114           HA       GLU 114 -27.047  -4.282   2.585
  943    HB2  GLU 114           2HB      GLU 114 -26.793  -1.447   1.489
  944    HB3  GLU 114           3HB      GLU 114 -27.274  -1.854   3.138
  945    HG2  GLU 114           2HG      GLU 114 -25.063  -3.028   3.421
  946    HG3  GLU 114           3HG      GLU 114 -24.602  -2.429   1.832
  947    H    HIS 115           H        HIS 115 -28.971  -5.215   2.498
  948    HA   HIS 115           HA       HIS 115 -31.263  -4.270   1.050
  949    HB2  HIS 115           2HB      HIS 115 -31.067  -6.208   3.399
  950    HB3  HIS 115           3HB      HIS 115 -32.520  -5.943   2.439
  951    HD1  HIS 115           HD1      HIS 115 -30.620  -8.636   2.773
  952    HD2  HIS 115           HD2      HIS 115 -31.074  -6.183  -0.557
  953    HE1  HIS 115           HE1      HIS 115 -30.010 -10.056   0.794
  954    HE2  HIS 115           HE2      HIS 115 -30.080  -8.482  -1.167
  955    H    HIS 116           H        HIS 116 -33.367  -3.902   2.482
  956    HA   HIS 116           HA       HIS 116 -34.564  -2.191   3.374
  957    HB2  HIS 116           2HB      HIS 116 -32.246  -1.770   5.316
  958    HB3  HIS 116           3HB      HIS 116 -33.883  -1.157   5.506
  959    HD1  HIS 116           HD1      HIS 116 -35.555  -2.698   6.635
  960    HD2  HIS 116           HD2      HIS 116 -31.995  -4.632   5.702
  961    HE1  HIS 116           HE1      HIS 116 -35.669  -4.925   7.794
  962    HE2  HIS 116           HE2      HIS 116 -33.470  -6.029   7.293
  963    H    HIS 117           H        HIS 117 -33.170  -1.767   1.104
  964    HA   HIS 117           HA       HIS 117 -31.204   0.293   1.164
  965    HB2  HIS 117           2HB      HIS 117 -31.267  -1.591  -0.473
  966    HB3  HIS 117           3HB      HIS 117 -32.694  -0.889  -1.219
  967    HD1  HIS 117           HD1      HIS 117 -28.978  -0.382  -0.870
  968    HD2  HIS 117           HD2      HIS 117 -32.170   1.192  -3.020
  969    HE1  HIS 117           HE1      HIS 117 -27.960   1.084  -2.636
  970    HE2  HIS 117           HE2      HIS 117 -29.906   2.083  -3.868
  971    H    HIS 118           H        HIS 118 -34.598   0.554   1.286
  972    HA   HIS 118           HA       HIS 118 -35.060   2.933  -0.197
  973    HB2  HIS 118           2HB      HIS 118 -36.533   1.837   2.231
  974    HB3  HIS 118           3HB      HIS 118 -37.079   3.241   1.316
  975    HD1  HIS 118           HD1      HIS 118 -38.509   2.775  -0.696
  976    HD2  HIS 118           HD2      HIS 118 -36.582  -0.650   0.648
  977    HE1  HIS 118           HE1      HIS 118 -39.514   0.884  -2.002
  978    HE2  HIS 118           HE2      HIS 118 -38.209  -1.142  -1.300
  979    H    HIS 119           H        HIS 119 -33.453   2.418   2.831
  980    HA   HIS 119           HA       HIS 119 -33.021   5.347   3.105
  981    HB2  HIS 119           2HB      HIS 119 -32.538   5.072   5.449
  982    HB3  HIS 119           3HB      HIS 119 -34.030   4.198   5.153
  983    HD1  HIS 119           HD1      HIS 119 -30.311   3.477   5.610
  984    HD2  HIS 119           HD2      HIS 119 -33.985   1.586   6.057
  985    HE1  HIS 119           HE1      HIS 119 -29.808   1.287   6.714
  986    HE2  HIS 119           HE2      HIS 119 -32.020   0.104   6.847
  987    H    HIS 120           H        HIS 120 -30.839   6.043   3.487
  988    HA   HIS 120           HA       HIS 120 -28.688   4.044   3.027
  989    HB2  HIS 120           2HB      HIS 120 -28.778   5.762   1.226
  990    HB3  HIS 120           3HB      HIS 120 -28.640   7.046   2.423
  991    HD1  HIS 120           HD1      HIS 120 -26.281   7.393   3.528
  992    HD2  HIS 120           HD2      HIS 120 -26.354   4.448   0.585
  993    HE1  HIS 120           HE1      HIS 120 -23.872   6.887   3.013
  994    HE2  HIS 120           HE2      HIS 120 -23.941   5.194   1.158
  Start of MODEL   11
    1    H1   MET   1           1H       MET   1  20.508   0.493   1.711
    2    H2   MET   1           2H       MET   1  21.954  -0.221   2.201
    3    H3   MET   1           3H       MET   1  20.490  -0.791   2.808
    4    HA   MET   1           HA       MET   1  21.379  -0.921  -0.005
    5    HB2  MET   1           2HB      MET   1  21.034  -3.152   2.052
    6    HB3  MET   1           3HB      MET   1  21.445  -3.387   0.355
    7    HG2  MET   1           2HG      MET   1  23.430  -3.600   1.718
    8    HG3  MET   1           3HG      MET   1  23.560  -2.160   0.708
    9    HE1  MET   1           3HE      MET   1  25.456  -1.147   4.036
   10    HE2  MET   1           1HE      MET   1  25.591  -1.246   2.281
   11    HE3  MET   1           2HE      MET   1  25.446  -2.722   3.240
   12    H    SER   2           H        SER   2  19.630  -0.700  -1.289
   13    HA   SER   2           HA       SER   2  16.929  -1.345  -0.582
   14    HB2  SER   2           2HB      SER   2  18.170  -1.042  -3.367
   15    HB3  SER   2           3HB      SER   2  16.444  -0.964  -2.975
   16    HG   SER   2           HG       SER   2  17.456   0.767  -1.394
   17    H    GLY   3           H        GLY   3  16.584  -3.413   0.020
   18    HA2  GLY   3           2HA      GLY   3  16.224  -5.561  -1.612
   19    HA3  GLY   3           3HA      GLY   3  17.907  -5.710  -1.106
   20    H    LYS   4           H        LYS   4  14.924  -4.662   0.495
   21    HA   LYS   4           HA       LYS   4  15.811  -6.010   2.962
   22    HB2  LYS   4           2HB      LYS   4  13.672  -3.867   2.623
   23    HB3  LYS   4           3HB      LYS   4  14.390  -4.419   4.136
   24    HG2  LYS   4           2HG      LYS   4  16.539  -3.403   3.513
   25    HG3  LYS   4           3HG      LYS   4  15.876  -2.934   1.939
   26    HD2  LYS   4           2HD      LYS   4  14.152  -1.550   3.163
   27    HD3  LYS   4           3HD      LYS   4  14.998  -1.918   4.670
   28    HE2  LYS   4           2HE      LYS   4  16.171  -0.447   2.284
   29    HE3  LYS   4           3HE      LYS   4  15.630   0.298   3.788
   30    HZ1  LYS   4           3HZ      LYS   4  18.000   0.042   3.781
   31    HZ2  LYS   4           1HZ      LYS   4  17.874  -1.619   3.492
   32    HZ3  LYS   4           2HZ      LYS   4  17.341  -0.972   4.960
   33    H    LYS   5           H        LYS   5  14.383  -7.309   4.131
   34    HA   LYS   5           HA       LYS   5  11.894  -8.221   2.958
   35    HB2  LYS   5           2HB      LYS   5  13.333  -9.703   4.392
   36    HB3  LYS   5           3HB      LYS   5  13.052  -8.644   5.761
   37    HG2  LYS   5           2HG      LYS   5  10.730 -10.025   4.366
   38    HG3  LYS   5           3HG      LYS   5  11.692 -10.875   5.571
   39    HD2  LYS   5           2HD      LYS   5  10.060  -8.335   6.030
   40    HD3  LYS   5           3HD      LYS   5   9.669  -9.958   6.611
   41    HE2  LYS   5           2HE      LYS   5  11.603  -9.968   8.074
   42    HE3  LYS   5           3HE      LYS   5  12.177  -8.437   7.407
   43    HZ1  LYS   5           3HZ      LYS   5  10.062  -7.459   8.265
   44    HZ2  LYS   5           1HZ      LYS   5  11.159  -7.966   9.446
   45    HZ3  LYS   5           2HZ      LYS   5   9.799  -8.904   9.097
   46    H    VAL   6           H        VAL   6  10.437  -6.630   2.793
   47    HA   VAL   6           HA       VAL   6  10.016  -4.656   4.949
   48    HB   VAL   6           HB       VAL   6  10.348  -3.411   2.942
   49   HG11  VAL   6          1HG1      VAL   6   8.564  -5.382   1.445
   50   HG12  VAL   6          2HG1      VAL   6  10.324  -5.291   1.340
   51   HG13  VAL   6          3HG1      VAL   6   9.339  -3.955   0.741
   52   HG21  VAL   6          3HG2      VAL   6   7.326  -3.758   3.101
   53   HG22  VAL   6          1HG2      VAL   6   8.176  -2.405   2.344
   54   HG23  VAL   6          2HG2      VAL   6   8.295  -2.662   4.086
   55    H    GLU   7           H        GLU   7   8.092  -4.682   6.045
   56    HA   GLU   7           HA       GLU   7   6.031  -6.630   5.199
   57    HB2  GLU   7           2HB      GLU   7   6.672  -5.592   7.973
   58    HB3  GLU   7           3HB      GLU   7   5.254  -6.550   7.584
   59    HG2  GLU   7           2HG      GLU   7   6.719  -8.404   6.853
   60    HG3  GLU   7           3HG      GLU   7   8.134  -7.443   7.290
   61    H    VAL   8           H        VAL   8   4.415  -5.758   4.313
   62    HA   VAL   8           HA       VAL   8   3.847  -2.883   4.435
   63    HB   VAL   8           HB       VAL   8   2.910  -5.068   2.497
   64   HG11  VAL   8          1HG1      VAL   8   2.458  -2.064   2.318
   65   HG12  VAL   8          2HG1      VAL   8   1.218  -3.277   2.640
   66   HG13  VAL   8          3HG1      VAL   8   2.032  -3.241   1.074
   67   HG21  VAL   8          3HG2      VAL   8   5.322  -4.572   2.300
   68   HG22  VAL   8          1HG2      VAL   8   4.960  -2.854   2.091
   69   HG23  VAL   8          2HG2      VAL   8   4.446  -4.022   0.868
   70    H    GLN   9           H        GLN   9   2.319  -2.331   5.936
   71    HA   GLN   9           HA       GLN   9   0.368  -4.345   6.863
   72    HB2  GLN   9           2HB      GLN   9   1.026  -1.615   8.074
   73    HB3  GLN   9           3HB      GLN   9  -0.008  -2.857   8.777
   74    HG2  GLN   9           2HG      GLN   9   2.081  -4.349   8.828
   75    HG3  GLN   9           3HG      GLN   9   3.003  -2.891   8.460
   76   HE21  GLN   9          1HE2      GLN   9   1.140  -4.580  10.872
   77   HE22  GLN   9          2HE2      GLN   9   1.523  -3.536  12.195
   78    H    VAL  10           H        VAL  10  -1.301  -4.291   5.430
   79    HA   VAL  10           HA       VAL  10  -2.369  -1.724   4.460
   80    HB   VAL  10           HB       VAL  10  -3.056  -4.579   3.597
   81   HG11  VAL  10          1HG1      VAL  10  -4.977  -3.068   3.262
   82   HG12  VAL  10          2HG1      VAL  10  -4.276  -3.527   1.708
   83   HG13  VAL  10          3HG1      VAL  10  -3.949  -1.930   2.386
   84   HG21  VAL  10          3HG2      VAL  10  -0.763  -3.946   2.940
   85   HG22  VAL  10          1HG2      VAL  10  -1.371  -2.469   2.184
   86   HG23  VAL  10          2HG2      VAL  10  -1.808  -4.047   1.520
   87    H    LYS  11           H        LYS  11  -3.693  -0.845   5.912
   88    HA   LYS  11           HA       LYS  11  -5.653  -2.504   7.390
   89    HB2  LYS  11           2HB      LYS  11  -4.017  -1.249   8.801
   90    HB3  LYS  11           3HB      LYS  11  -4.511   0.256   8.032
   91    HG2  LYS  11           2HG      LYS  11  -6.794  -0.033   8.965
   92    HG3  LYS  11           3HG      LYS  11  -6.275  -1.523   9.747
   93    HD2  LYS  11           2HD      LYS  11  -6.290   0.320  11.362
   94    HD3  LYS  11           3HD      LYS  11  -4.637  -0.243  11.102
   95    HE2  LYS  11           2HE      LYS  11  -4.183   1.667   9.642
   96    HE3  LYS  11           3HE      LYS  11  -5.864   2.187   9.751
   97    HZ1  LYS  11           3HZ      LYS  11  -5.543   2.540  12.125
   98    HZ2  LYS  11           1HZ      LYS  11  -4.482   3.482  11.208
   99    HZ3  LYS  11           2HZ      LYS  11  -3.927   2.095  11.987
  100    H    ILE  12           H        ILE  12  -7.446  -2.470   6.118
  101    HA   ILE  12           HA       ILE  12  -8.315   0.055   4.872
  102    HB   ILE  12           HB       ILE  12  -7.777  -1.583   3.175
  103   HG12  ILE  12          2HG1      ILE  12 -10.809  -1.353   3.392
  104   HG13  ILE  12          3HG1      ILE  12  -9.746  -0.076   2.814
  105   HG21  ILE  12          1HG2      ILE  12  -8.897  -3.765   2.935
  106   HG22  ILE  12          2HG2      ILE  12  -9.749  -3.504   4.457
  107   HG23  ILE  12          3HG2      ILE  12  -7.992  -3.675   4.453
  108   HD11  ILE  12          3HD1      ILE  12 -10.162  -2.760   1.512
  109   HD12  ILE  12          1HD1      ILE  12  -9.076  -1.491   0.940
  110   HD13  ILE  12          2HD1      ILE  12 -10.816  -1.212   0.981
  111    H    THR  13           H        THR  13 -10.034   0.974   5.734
  112    HA   THR  13           HA       THR  13 -11.765  -0.475   7.596
  113    HB   THR  13           HB       THR  13 -11.847   2.514   6.960
  114    HG1  THR  13           HG1      THR  13 -10.213   1.118   8.844
  115   HG21  THR  13          3HG2      THR  13 -12.674   0.920   9.422
  116   HG22  THR  13          1HG2      THR  13 -13.778   1.618   8.231
  117   HG23  THR  13          2HG2      THR  13 -12.788   2.672   9.244
  118    H    CYS  14           H        CYS  14 -13.456  -1.481   6.646
  119    HA   CYS  14           HA       CYS  14 -14.941  -0.210   4.419
  120    HB2  CYS  14           2HB      CYS  14 -13.438  -1.958   3.537
  121    HB3  CYS  14           3HB      CYS  14 -14.106  -3.129   4.654
  122    H    ASN  15           H        ASN  15 -16.912   0.184   5.098
  123    HA   ASN  15           HA       ASN  15 -19.063  -0.095   5.654
  124    HB2  ASN  15           2HB      ASN  15 -18.878  -2.445   4.849
  125    HB3  ASN  15           3HB      ASN  15 -18.383  -2.960   6.455
  126   HD21  ASN  15          1HD2      ASN  15 -21.043  -1.575   4.610
  127   HD22  ASN  15          2HD2      ASN  15 -22.296  -2.112   5.669
  128    H    GLY  16           H        GLY  16 -16.550  -0.139   7.810
  129    HA2  GLY  16           2HA      GLY  16 -16.959   1.118   9.914
  130    HA3  GLY  16           3HA      GLY  16 -18.297   0.019  10.217
  131    H    LYS  17           H        LYS  17 -15.992  -1.859   8.803
  132    HA   LYS  17           HA       LYS  17 -14.883  -2.716  11.415
  133    HB2  LYS  17           2HB      LYS  17 -15.304  -4.278   8.829
  134    HB3  LYS  17           3HB      LYS  17 -14.441  -4.902  10.232
  135    HG2  LYS  17           2HG      LYS  17 -16.500  -4.729  11.586
  136    HG3  LYS  17           3HG      LYS  17 -17.369  -4.102  10.181
  137    HD2  LYS  17           2HD      LYS  17 -17.828  -6.510  10.488
  138    HD3  LYS  17           3HD      LYS  17 -16.972  -6.223   8.971
  139    HE2  LYS  17           2HE      LYS  17 -14.849  -6.925  10.047
  140    HE3  LYS  17           3HE      LYS  17 -15.715  -7.221  11.556
  141    HZ1  LYS  17           3HZ      LYS  17 -15.362  -9.254  10.322
  142    HZ2  LYS  17           1HZ      LYS  17 -16.184  -8.629   8.986
  143    HZ3  LYS  17           2HZ      LYS  17 -17.012  -8.914  10.428
  144    H    THR  18           H        THR  18 -12.710  -3.042  11.611
  145    HA   THR  18           HA       THR  18 -10.944  -1.779   9.639
  146    HB   THR  18           HB       THR  18 -10.372  -2.763  12.476
  147    HG1  THR  18           HG1      THR  18 -11.892  -0.962  12.235
  148   HG21  THR  18          3HG2      THR  18  -8.310  -2.615  11.100
  149   HG22  THR  18          1HG2      THR  18  -8.343  -1.362  12.346
  150   HG23  THR  18          2HG2      THR  18  -8.721  -0.953  10.672
  151    H    TYR  19           H        TYR  19 -10.301  -3.197   8.083
  152    HA   TYR  19           HA       TYR  19  -9.640  -6.003   8.763
  153    HB2  TYR  19           2HB      TYR  19  -9.944  -4.747   5.996
  154    HB3  TYR  19           3HB      TYR  19  -9.703  -6.454   6.344
  155    HD1  TYR  19           HD1      TYR  19 -11.576  -7.841   7.211
  156    HD2  TYR  19           HD2      TYR  19 -12.145  -3.700   6.292
  157    HE1  TYR  19           HE1      TYR  19 -14.021  -8.158   7.240
  158    HE2  TYR  19           HE2      TYR  19 -14.568  -4.028   6.325
  159    HH   TYR  19           HH       TYR  19 -16.208  -5.751   6.100
  160    H    GLU  20           H        GLU  20  -7.551  -5.939   9.509
  161    HA   GLU  20           HA       GLU  20  -5.527  -4.610   7.814
  162    HB2  GLU  20           2HB      GLU  20  -4.235  -4.305  10.074
  163    HB3  GLU  20           3HB      GLU  20  -5.498  -3.183   9.629
  164    HG2  GLU  20           2HG      GLU  20  -5.669  -3.641  11.977
  165    HG3  GLU  20           3HG      GLU  20  -7.068  -4.336  11.160
  166    H    ARG  21           H        ARG  21  -3.671  -5.642   7.409
  167    HA   ARG  21           HA       ARG  21  -2.890  -8.067   8.770
  168    HB2  ARG  21           2HB      ARG  21  -4.512  -8.924   7.081
  169    HB3  ARG  21           3HB      ARG  21  -3.578  -8.166   5.793
  170    HG2  ARG  21           2HG      ARG  21  -1.680  -9.654   6.238
  171    HG3  ARG  21           3HG      ARG  21  -2.511 -10.342   7.637
  172    HD2  ARG  21           2HD      ARG  21  -3.407 -10.572   4.744
  173    HD3  ARG  21           3HD      ARG  21  -2.629 -11.846   5.687
  174    HE   ARG  21           HE       ARG  21  -4.748 -11.349   7.217
  175   HH11  ARG  21          1HH1      ARG  21  -4.658 -11.723   3.716
  176   HH12  ARG  21          2HH1      ARG  21  -6.274 -12.348   3.634
  177   HH21  ARG  21          1HH2      ARG  21  -6.846 -12.225   7.078
  178   HH22  ARG  21          2HH2      ARG  21  -7.503 -12.631   5.525
  179    H    THR  22           H        THR  22  -0.756  -8.287   8.721
  180    HA   THR  22           HA       THR  22   0.909  -6.341   7.294
  181    HB   THR  22           HB       THR  22   1.658  -8.342   9.485
  182    HG1  THR  22           HG1      THR  22   0.067  -6.607  10.009
  183   HG21  THR  22          3HG2      THR  22   3.637  -6.904   9.817
  184   HG22  THR  22          1HG2      THR  22   3.125  -5.874   8.486
  185   HG23  THR  22          2HG2      THR  22   3.604  -7.546   8.170
  186    H    TYR  23           H        TYR  23   1.767  -6.976   5.406
  187    HA   TYR  23           HA       TYR  23   1.907  -9.825   4.652
  188    HB2  TYR  23           2HB      TYR  23   2.055  -7.292   2.941
  189    HB3  TYR  23           3HB      TYR  23   2.088  -8.941   2.318
  190    HD1  TYR  23           HD2      TYR  23   0.042 -10.364   2.414
  191    HD2  TYR  23           HD1      TYR  23  -0.072  -6.281   3.659
  192    HE1  TYR  23           HE2      TYR  23  -2.413 -10.403   2.332
  193    HE2  TYR  23           HE1      TYR  23  -2.529  -6.329   3.592
  194    HH   TYR  23           HH       TYR  23  -4.315  -7.676   2.383
  195    H    GLN  24           H        GLN  24   3.838 -10.806   4.713
  196    HA   GLN  24           HA       GLN  24   6.312  -9.260   4.991
  197    HB2  GLN  24           2HB      GLN  24   5.839 -12.278   5.023
  198    HB3  GLN  24           3HB      GLN  24   7.426 -11.535   5.165
  199    HG2  GLN  24           2HG      GLN  24   6.711 -12.161   7.367
  200    HG3  GLN  24           3HG      GLN  24   6.672 -10.410   7.261
  201   HE21  GLN  24          1HE2      GLN  24   4.702  -9.345   7.467
  202   HE22  GLN  24          2HE2      GLN  24   3.241 -10.149   7.910
  203    H    LEU  25           H        LEU  25   7.111  -8.464   3.164
  204    HA   LEU  25           HA       LEU  25   7.183 -10.095   0.681
  205    HB2  LEU  25           2HB      LEU  25   6.989  -7.057   0.953
  206    HB3  LEU  25           3HB      LEU  25   7.177  -7.918  -0.568
  207    HG   LEU  25           HG       LEU  25   4.751  -8.085   1.275
  208   HD11  LEU  25          1HD1      LEU  25   4.888  -5.935   0.116
  209   HD12  LEU  25          2HD1      LEU  25   3.542  -6.897  -0.487
  210   HD13  LEU  25          3HD1      LEU  25   5.024  -6.757  -1.440
  211   HD21  LEU  25          3HD2      LEU  25   3.683  -9.393  -0.532
  212   HD22  LEU  25          1HD2      LEU  25   5.086 -10.224   0.143
  213   HD23  LEU  25          2HD2      LEU  25   5.210  -9.416  -1.422
  214    H    TYR  26           H        TYR  26   9.124 -10.078  -0.467
  215    HA   TYR  26           HA       TYR  26  11.393  -8.499   0.565
  216    HB2  TYR  26           2HB      TYR  26  11.589 -10.856   1.460
  217    HB3  TYR  26           3HB      TYR  26  11.586 -11.464  -0.192
  218    HD1  TYR  26           HD2      TYR  26  13.605 -11.088  -1.669
  219    HD2  TYR  26           HD1      TYR  26  13.573  -9.766   2.395
  220    HE1  TYR  26           HE2      TYR  26  16.039 -10.753  -1.758
  221    HE2  TYR  26           HE1      TYR  26  15.996  -9.423   2.305
  222    HH   TYR  26           HH       TYR  26  17.757  -9.377  -0.547
  223    H    ALA  27           H        ALA  27  12.640  -7.668  -1.025
  224    HA   ALA  27           HA       ALA  27  12.838  -8.770  -3.673
  225    HB1  ALA  27           3HB      ALA  27  11.983  -6.804  -4.867
  226    HB2  ALA  27           1HB      ALA  27  11.494  -6.062  -3.345
  227    HB3  ALA  27           2HB      ALA  27  10.710  -7.538  -3.906
  228    H    VAL  28           H        VAL  28  14.571  -7.847  -4.821
  229    HA   VAL  28           HA       VAL  28  16.580  -6.492  -3.271
  230    HB   VAL  28           HB       VAL  28  16.608  -7.067  -6.276
  231   HG11  VAL  28          1HG1      VAL  28  19.079  -6.890  -6.062
  232   HG12  VAL  28          2HG1      VAL  28  18.900  -6.454  -4.362
  233   HG13  VAL  28          3HG1      VAL  28  18.278  -5.379  -5.616
  234   HG21  VAL  28          3HG2      VAL  28  17.910  -9.110  -5.735
  235   HG22  VAL  28          1HG2      VAL  28  16.290  -9.171  -5.033
  236   HG23  VAL  28          2HG2      VAL  28  17.681  -8.800  -4.012
  237    H    ARG  29           H        ARG  29  15.204  -5.615  -6.480
  238    HA   ARG  29           HA       ARG  29  15.706  -2.799  -5.992
  239    HB2  ARG  29           2HB      ARG  29  14.462  -4.190  -8.397
  240    HB3  ARG  29           3HB      ARG  29  14.843  -2.469  -8.310
  241    HG2  ARG  29           2HG      ARG  29  17.255  -3.092  -7.953
  242    HG3  ARG  29           3HG      ARG  29  16.814  -4.778  -8.250
  243    HD2  ARG  29           2HD      ARG  29  17.735  -3.707 -10.274
  244    HD3  ARG  29           3HD      ARG  29  16.056  -4.193 -10.512
  245    HE   ARG  29           HE       ARG  29  15.391  -1.913 -10.404
  246   HH11  ARG  29          1HH1      ARG  29  18.892  -2.258 -10.429
  247   HH12  ARG  29          2HH1      ARG  29  19.164  -0.617 -10.914
  248   HH21  ARG  29          1HH2      ARG  29  15.771   0.235 -11.011
  249   HH22  ARG  29          2HH2      ARG  29  17.398   0.791 -11.241
  250    H    ASP  30           H        ASP  30  14.137  -1.173  -6.122
  251    HA   ASP  30           HA       ASP  30  11.689  -1.617  -4.737
  252    HB2  ASP  30           2HB      ASP  30  11.286   0.848  -5.274
  253    HB3  ASP  30           3HB      ASP  30  12.763   0.492  -4.394
  254    H    GLU  31           H        GLU  31  12.542  -1.355  -8.148
  255    HA   GLU  31           HA       GLU  31  10.017  -1.222  -9.342
  256    HB2  GLU  31           2HB      GLU  31  12.564  -2.616 -10.247
  257    HB3  GLU  31           3HB      GLU  31  11.127  -2.522 -11.263
  258    HG2  GLU  31           2HG      GLU  31  12.743  -0.179 -10.229
  259    HG3  GLU  31           3HG      GLU  31  12.755  -0.809 -11.876
  260    H    GLU  32           H        GLU  32  11.719  -3.953  -7.935
  261    HA   GLU  32           HA       GLU  32  10.077  -6.058  -8.893
  262    HB2  GLU  32           2HB      GLU  32  11.793  -5.913  -6.391
  263    HB3  GLU  32           3HB      GLU  32  11.203  -7.396  -7.135
  264    HG2  GLU  32           2HG      GLU  32  13.077  -5.441  -8.502
  265    HG3  GLU  32           3HG      GLU  32  13.629  -6.816  -7.553
  266    H    LEU  33           H        LEU  33   9.917  -3.915  -6.096
  267    HA   LEU  33           HA       LEU  33   7.959  -5.390  -4.617
  268    HB2  LEU  33           2HB      LEU  33   9.713  -3.301  -4.007
  269    HB3  LEU  33           3HB      LEU  33   8.165  -2.492  -3.978
  270    HG   LEU  33           HG       LEU  33   8.786  -3.211  -1.717
  271   HD11  LEU  33          1HD1      LEU  33   6.387  -3.232  -2.200
  272   HD12  LEU  33          2HD1      LEU  33   6.816  -4.467  -1.020
  273   HD13  LEU  33          3HD1      LEU  33   6.486  -4.924  -2.695
  274   HD21  LEU  33          3HD2      LEU  33   9.034  -5.583  -1.097
  275   HD22  LEU  33          1HD2      LEU  33  10.261  -5.078  -2.259
  276   HD23  LEU  33          2HD2      LEU  33   8.886  -6.048  -2.794
  277    H    LYS  34           H        LYS  34   7.809  -3.033  -7.185
  278    HA   LYS  34           HA       LYS  34   5.336  -1.823  -6.855
  279    HB2  LYS  34           2HB      LYS  34   6.817  -2.617  -9.386
  280    HB3  LYS  34           3HB      LYS  34   5.322  -1.685  -9.430
  281    HG2  LYS  34           2HG      LYS  34   6.336   0.156  -8.257
  282    HG3  LYS  34           3HG      LYS  34   7.790  -0.788  -7.915
  283    HD2  LYS  34           2HD      LYS  34   8.192   0.805  -9.744
  284    HD3  LYS  34           3HD      LYS  34   8.335  -0.860 -10.306
  285    HE2  LYS  34           2HE      LYS  34   5.991  -0.673 -11.217
  286    HE3  LYS  34           3HE      LYS  34   6.017   1.042 -10.792
  287    HZ1  LYS  34           3HZ      LYS  34   6.617   0.646 -13.111
  288    HZ2  LYS  34           1HZ      LYS  34   7.935  -0.296 -12.627
  289    HZ3  LYS  34           2HZ      LYS  34   7.890   1.349 -12.261
  290    H    GLU  35           H        GLU  35   5.944  -4.719  -8.905
  291    HA   GLU  35           HA       GLU  35   3.303  -5.314  -9.553
  292    HB2  GLU  35           2HB      GLU  35   4.122  -7.553 -10.197
  293    HB3  GLU  35           3HB      GLU  35   5.220  -6.290 -10.744
  294    HG2  GLU  35           2HG      GLU  35   6.755  -6.790  -8.879
  295    HG3  GLU  35           3HG      GLU  35   5.654  -8.040  -8.295
  296    H    LYS  36           H        LYS  36   5.150  -6.163  -6.690
  297    HA   LYS  36           HA       LYS  36   3.430  -8.186  -5.653
  298    HB2  LYS  36           2HB      LYS  36   5.382  -6.407  -4.122
  299    HB3  LYS  36           3HB      LYS  36   4.704  -7.941  -3.567
  300    HG2  LYS  36           2HG      LYS  36   5.861  -9.118  -5.407
  301    HG3  LYS  36           3HG      LYS  36   6.546  -7.581  -5.953
  302    HD2  LYS  36           2HD      LYS  36   7.693  -7.368  -3.723
  303    HD3  LYS  36           3HD      LYS  36   7.089  -8.976  -3.298
  304    HE2  LYS  36           2HE      LYS  36   8.973  -8.295  -5.584
  305    HE3  LYS  36           3HE      LYS  36   9.401  -9.119  -4.085
  306    HZ1  LYS  36           3HZ      LYS  36   7.893 -10.927  -4.742
  307    HZ2  LYS  36           1HZ      LYS  36   9.155 -10.702  -5.844
  308    HZ3  LYS  36           2HZ      LYS  36   7.604 -10.146  -6.209
  309    H    LEU  37           H        LEU  37   3.786  -4.692  -5.060
  310    HA   LEU  37           HA       LEU  37   1.761  -4.394  -3.110
  311    HB2  LEU  37           2HB      LEU  37   2.990  -2.399  -5.047
  312    HB3  LEU  37           3HB      LEU  37   1.865  -1.937  -3.774
  313    HG   LEU  37           HG       LEU  37   4.528  -3.307  -3.253
  314   HD11  LEU  37          1HD1      LEU  37   4.891  -1.110  -4.256
  315   HD12  LEU  37          2HD1      LEU  37   5.386  -1.142  -2.569
  316   HD13  LEU  37          3HD1      LEU  37   3.868  -0.366  -3.025
  317   HD21  LEU  37          3HD2      LEU  37   2.592  -1.946  -1.342
  318   HD22  LEU  37          1HD2      LEU  37   4.170  -2.614  -0.916
  319   HD23  LEU  37          2HD2      LEU  37   2.884  -3.683  -1.468
  320    H    LYS  38           H        LYS  38   1.687  -4.213  -6.690
  321    HA   LYS  38           HA       LYS  38  -0.950  -3.279  -6.971
  322    HB2  LYS  38           2HB      LYS  38   0.734  -5.000  -8.846
  323    HB3  LYS  38           3HB      LYS  38  -0.799  -4.245  -9.293
  324    HG2  LYS  38           2HG      LYS  38   0.189  -2.008  -8.849
  325    HG3  LYS  38           3HG      LYS  38   1.725  -2.783  -8.454
  326    HD2  LYS  38           2HD      LYS  38   1.823  -1.931 -10.731
  327    HD3  LYS  38           3HD      LYS  38   1.838  -3.693 -10.773
  328    HE2  LYS  38           2HE      LYS  38  -0.528  -3.730 -11.414
  329    HE3  LYS  38           3HE      LYS  38  -0.628  -1.975 -11.252
  330    HZ1  LYS  38           3HZ      LYS  38   1.142  -3.374 -13.185
  331    HZ2  LYS  38           1HZ      LYS  38   0.870  -1.712 -13.076
  332    HZ3  LYS  38           2HZ      LYS  38  -0.379  -2.737 -13.563
  333    H    LYS  39           H        LYS  39   0.404  -6.586  -6.777
  334    HA   LYS  39           HA       LYS  39  -2.067  -7.948  -7.021
  335    HB2  LYS  39           2HB      LYS  39   0.608  -8.830  -5.877
  336    HB3  LYS  39           3HB      LYS  39  -0.783  -9.909  -5.931
  337    HG2  LYS  39           2HG      LYS  39   0.583  -8.622  -8.313
  338    HG3  LYS  39           3HG      LYS  39   0.694 -10.319  -7.834
  339    HD2  LYS  39           2HD      LYS  39  -1.766 -10.573  -8.266
  340    HD3  LYS  39           3HD      LYS  39  -1.834  -8.884  -8.778
  341    HE2  LYS  39           2HE      LYS  39  -0.216  -9.435 -10.613
  342    HE3  LYS  39           3HE      LYS  39  -0.309 -11.135 -10.140
  343    HZ1  LYS  39           3HZ      LYS  39  -2.678 -11.091 -10.616
  344    HZ2  LYS  39           1HZ      LYS  39  -1.792 -10.630 -11.976
  345    HZ3  LYS  39           2HZ      LYS  39  -2.588  -9.462 -11.050
  346    H    VAL  40           H        VAL  40  -0.198  -6.993  -4.113
  347    HA   VAL  40           HA       VAL  40  -1.815  -8.155  -2.152
  348    HB   VAL  40           HB       VAL  40   0.004  -5.701  -1.985
  349   HG11  VAL  40          1HG1      VAL  40  -1.347  -7.127   0.334
  350   HG12  VAL  40          2HG1      VAL  40  -1.674  -5.476  -0.200
  351   HG13  VAL  40          3HG1      VAL  40  -0.098  -5.886   0.481
  352   HG21  VAL  40          3HG2      VAL  40   1.150  -7.855  -2.423
  353   HG22  VAL  40          1HG2      VAL  40   0.395  -8.552  -0.990
  354   HG23  VAL  40          2HG2      VAL  40   1.561  -7.236  -0.822
  355    H    LEU  41           H        LEU  41  -2.025  -4.953  -3.688
  356    HA   LEU  41           HA       LEU  41  -4.236  -4.039  -2.126
  357    HB2  LEU  41           2HB      LEU  41  -2.970  -3.019  -4.681
  358    HB3  LEU  41           3HB      LEU  41  -4.402  -2.262  -3.996
  359    HG   LEU  41           HG       LEU  41  -1.746  -2.541  -2.533
  360   HD11  LEU  41          1HD1      LEU  41  -1.449  -0.149  -2.892
  361   HD12  LEU  41          2HD1      LEU  41  -2.933  -0.087  -3.846
  362   HD13  LEU  41          3HD1      LEU  41  -1.546  -1.009  -4.428
  363   HD21  LEU  41          3HD2      LEU  41  -3.642  -2.480  -0.979
  364   HD22  LEU  41          1HD2      LEU  41  -4.267  -1.020  -1.760
  365   HD23  LEU  41          2HD2      LEU  41  -2.728  -0.977  -0.892
  366    H    ASN  42           H        ASN  42  -4.031  -5.272  -5.540
  367    HA   ASN  42           HA       ASN  42  -6.739  -5.080  -6.182
  368    HB2  ASN  42           2HB      ASN  42  -4.628  -7.024  -7.196
  369    HB3  ASN  42           3HB      ASN  42  -6.262  -7.003  -7.856
  370   HD21  ASN  42          1HD2      ASN  42  -3.764  -6.452  -9.194
  371   HD22  ASN  42          2HD2      ASN  42  -3.897  -4.858  -9.837
  372    H    GLU  43           H        GLU  43  -5.056  -7.912  -4.820
  373    HA   GLU  43           HA       GLU  43  -7.300  -9.601  -4.592
  374    HB2  GLU  43           2HB      GLU  43  -4.726  -9.603  -2.958
  375    HB3  GLU  43           3HB      GLU  43  -5.899 -10.913  -2.990
  376    HG2  GLU  43           2HG      GLU  43  -4.159  -9.966  -5.283
  377    HG3  GLU  43           3HG      GLU  43  -4.017 -11.483  -4.399
  378    H    ARG  44           H        ARG  44  -5.929  -7.175  -2.402
  379    HA   ARG  44           HA       ARG  44  -7.534  -7.666  -0.142
  380    HB2  ARG  44           2HB      ARG  44  -5.422  -6.174  -0.350
  381    HB3  ARG  44           3HB      ARG  44  -6.490  -4.920  -0.963
  382    HG2  ARG  44           2HG      ARG  44  -6.020  -4.606   1.423
  383    HG3  ARG  44           3HG      ARG  44  -7.739  -4.935   1.168
  384    HD2  ARG  44           2HD      ARG  44  -7.524  -7.180   1.948
  385    HD3  ARG  44           3HD      ARG  44  -5.762  -7.126   1.871
  386    HE   ARG  44           HE       ARG  44  -6.521  -5.190   3.701
  387   HH11  ARG  44          1HH1      ARG  44  -6.883  -8.688   3.404
  388   HH12  ARG  44          2HH1      ARG  44  -6.882  -8.949   5.119
  389   HH21  ARG  44          1HH2      ARG  44  -6.434  -5.587   5.943
  390   HH22  ARG  44          2HH2      ARG  44  -6.628  -7.208   6.537
  391    H    MET  45           H        MET  45  -8.006  -5.597  -2.975
  392    HA   MET  45           HA       MET  45 -10.309  -4.229  -1.894
  393    HB2  MET  45           2HB      MET  45  -8.990  -4.083  -4.633
  394    HB3  MET  45           3HB      MET  45 -10.289  -3.025  -4.085
  395    HG2  MET  45           2HG      MET  45  -7.520  -3.211  -2.876
  396    HG3  MET  45           3HG      MET  45  -8.139  -1.905  -3.883
  397    HE1  MET  45           3HE      MET  45 -11.115  -1.607  -2.764
  398    HE2  MET  45           1HE      MET  45 -10.085  -0.205  -3.057
  399    HE3  MET  45           2HE      MET  45 -10.905  -0.394  -1.508
  400    H    ASP  46           H        ASP  46  -9.801  -7.034  -3.855
  401    HA   ASP  46           HA       ASP  46 -12.080  -7.050  -5.470
  402    HB2  ASP  46           2HB      ASP  46 -10.236  -8.595  -5.903
  403    HB3  ASP  46           3HB      ASP  46 -10.500  -9.418  -4.376
  404    HA   PRO  47           HA       PRO  47 -14.594  -9.441  -2.032
  405    HB2  PRO  47           2HB      PRO  47 -13.661  -9.513   0.550
  406    HB3  PRO  47           3HB      PRO  47 -13.228 -10.747  -0.655
  407    HG2  PRO  47           2HG      PRO  47 -11.644  -8.335   0.199
  408    HG3  PRO  47           3HG      PRO  47 -11.101 -10.019   0.002
  409    HD2  PRO  47           2HD      PRO  47 -10.665  -8.174  -1.911
  410    HD3  PRO  47           3HD      PRO  47 -11.019  -9.863  -2.318
  411    H    ILE  48           H        ILE  48 -12.794  -6.533  -1.269
  412    HA   ILE  48           HA       ILE  48 -14.604  -5.353   0.593
  413    HB   ILE  48           HB       ILE  48 -12.404  -4.142  -1.126
  414   HG12  ILE  48          2HG1      ILE  48 -11.606  -5.844   0.491
  415   HG13  ILE  48          3HG1      ILE  48 -11.013  -4.246   0.908
  416   HG21  ILE  48          1HG2      ILE  48 -13.811  -2.851   1.223
  417   HG22  ILE  48          2HG2      ILE  48 -13.972  -2.376  -0.465
  418   HG23  ILE  48          3HG2      ILE  48 -12.425  -2.190   0.358
  419   HD11  ILE  48          3HD1      ILE  48 -11.624  -5.482   2.879
  420   HD12  ILE  48          1HD1      ILE  48 -13.259  -5.733   2.269
  421   HD13  ILE  48          2HD1      ILE  48 -12.710  -4.109   2.688
  422    H    LYS  49           H        LYS  49 -14.279  -5.166  -2.954
  423    HA   LYS  49           HA       LYS  49 -16.276  -3.184  -3.406
  424    HB2  LYS  49           2HB      LYS  49 -15.287  -5.423  -5.214
  425    HB3  LYS  49           3HB      LYS  49 -16.361  -4.129  -5.740
  426    HG2  LYS  49           2HG      LYS  49 -14.593  -2.464  -5.255
  427    HG3  LYS  49           3HG      LYS  49 -13.522  -3.764  -4.721
  428    HD2  LYS  49           2HD      LYS  49 -12.957  -3.127  -7.022
  429    HD3  LYS  49           3HD      LYS  49 -13.609  -4.766  -6.999
  430    HE2  LYS  49           2HE      LYS  49 -15.806  -3.890  -7.755
  431    HE3  LYS  49           3HE      LYS  49 -15.142  -2.258  -7.785
  432    HZ1  LYS  49           3HZ      LYS  49 -14.227  -4.533  -9.460
  433    HZ2  LYS  49           1HZ      LYS  49 -13.579  -2.974  -9.484
  434    HZ3  LYS  49           2HZ      LYS  49 -15.174  -3.233  -9.977
  435    H    LYS  50           H        LYS  50 -16.342  -6.695  -3.033
  436    HA   LYS  50           HA       LYS  50 -19.088  -7.148  -3.605
  437    HB2  LYS  50           2HB      LYS  50 -17.023  -8.821  -3.365
  438    HB3  LYS  50           3HB      LYS  50 -17.516  -8.902  -1.688
  439    HG2  LYS  50           2HG      LYS  50 -19.237  -9.648  -4.079
  440    HG3  LYS  50           3HG      LYS  50 -18.367 -10.789  -3.060
  441    HD2  LYS  50           2HD      LYS  50 -20.690  -9.015  -2.195
  442    HD3  LYS  50           3HD      LYS  50 -20.766 -10.748  -2.508
  443    HE2  LYS  50           2HE      LYS  50 -19.288 -11.187  -0.601
  444    HE3  LYS  50           3HE      LYS  50 -19.101  -9.455  -0.318
  445    HZ1  LYS  50           3HZ      LYS  50 -20.704 -10.313   1.195
  446    HZ2  LYS  50           1HZ      LYS  50 -21.592 -11.040  -0.044
  447    HZ3  LYS  50           2HZ      LYS  50 -21.523  -9.357   0.068
  448    H    LEU  51           H        LEU  51 -17.304  -6.276  -0.657
  449    HA   LEU  51           HA       LEU  51 -19.521  -6.417   1.162
  450    HB2  LEU  51           2HB      LEU  51 -16.920  -4.843   1.382
  451    HB3  LEU  51           3HB      LEU  51 -18.077  -5.058   2.690
  452    HG   LEU  51           HG       LEU  51 -16.409  -7.255   1.398
  453   HD11  LEU  51          1HD1      LEU  51 -15.093  -5.784   2.839
  454   HD12  LEU  51          2HD1      LEU  51 -15.255  -7.387   3.552
  455   HD13  LEU  51          3HD1      LEU  51 -16.222  -6.045   4.171
  456   HD21  LEU  51          3HD2      LEU  51 -17.313  -8.764   3.126
  457   HD22  LEU  51          1HD2      LEU  51 -18.576  -8.172   2.047
  458   HD23  LEU  51          2HD2      LEU  51 -18.412  -7.493   3.669
  459    H    GLY  52           H        GLY  52 -18.318  -4.037  -1.089
  460    HA2  GLY  52           2HA      GLY  52 -19.470  -2.383  -2.134
  461    HA3  GLY  52           3HA      GLY  52 -20.898  -2.821  -1.213
  462    H    CYS  53           H        CYS  53 -17.734  -1.714  -0.033
  463    HA   CYS  53           HA       CYS  53 -19.003   0.221   1.688
  464    HB2  CYS  53           2HB      CYS  53 -16.086  -0.448   1.202
  465    HB3  CYS  53           3HB      CYS  53 -16.674   0.651   2.456
  466    H    LYS  54           H        LYS  54 -19.698   2.054   0.910
  467    HA   LYS  54           HA       LYS  54 -19.269   3.396  -1.413
  468    HB2  LYS  54           2HB      LYS  54 -20.291   5.377  -0.383
  469    HB3  LYS  54           3HB      LYS  54 -21.116   3.926   0.158
  470    HG2  LYS  54           2HG      LYS  54 -19.100   5.518   1.791
  471    HG3  LYS  54           3HG      LYS  54 -20.850   5.603   1.971
  472    HD2  LYS  54           2HD      LYS  54 -20.823   3.150   2.612
  473    HD3  LYS  54           3HD      LYS  54 -19.059   3.209   2.556
  474    HE2  LYS  54           2HE      LYS  54 -19.804   3.414   4.858
  475    HE3  LYS  54           3HE      LYS  54 -19.092   4.942   4.341
  476    HZ1  LYS  54           3HZ      LYS  54 -21.271   5.867   4.062
  477    HZ2  LYS  54           1HZ      LYS  54 -21.170   5.198   5.612
  478    HZ3  LYS  54           2HZ      LYS  54 -22.009   4.386   4.392
  479    H    ARG  55           H        ARG  55 -17.331   3.754   1.537
  480    HA   ARG  55           HA       ARG  55 -15.140   4.861  -0.034
  481    HB2  ARG  55           2HB      ARG  55 -16.581   6.768   1.149
  482    HB3  ARG  55           3HB      ARG  55 -15.778   6.233   2.614
  483    HG2  ARG  55           2HG      ARG  55 -14.292   7.152   0.125
  484    HG3  ARG  55           3HG      ARG  55 -14.743   8.232   1.439
  485    HD2  ARG  55           2HD      ARG  55 -13.033   5.780   1.931
  486    HD3  ARG  55           3HD      ARG  55 -12.334   7.300   1.393
  487    HE   ARG  55           HE       ARG  55 -12.985   8.320   3.439
  488   HH11  ARG  55          1HH1      ARG  55 -13.496   4.840   3.514
  489   HH12  ARG  55          2HH1      ARG  55 -13.518   4.765   5.243
  490   HH21  ARG  55          1HH2      ARG  55 -12.928   8.171   5.683
  491   HH22  ARG  55          2HH2      ARG  55 -13.198   6.647   6.472
  492    H    VAL  56           H        VAL  56 -13.240   4.029   0.649
  493    HA   VAL  56           HA       VAL  56 -13.067   2.534   3.194
  494    HB   VAL  56           HB       VAL  56 -11.495   0.957   2.078
  495   HG11  VAL  56          1HG1      VAL  56 -13.187  -0.317   0.808
  496   HG12  VAL  56          2HG1      VAL  56 -14.236   1.102   0.784
  497   HG13  VAL  56          3HG1      VAL  56 -13.834   0.321   2.317
  498   HG21  VAL  56          3HG2      VAL  56 -10.684   2.375   0.230
  499   HG22  VAL  56          1HG2      VAL  56 -12.284   2.340  -0.526
  500   HG23  VAL  56          2HG2      VAL  56 -11.333   0.862  -0.393
  501    H    ARG  57           H        ARG  57 -11.229   2.851   4.376
  502    HA   ARG  57           HA       ARG  57  -9.213   4.781   3.362
  503    HB2  ARG  57           2HB      ARG  57 -10.499   5.517   5.348
  504    HB3  ARG  57           3HB      ARG  57  -9.993   4.072   6.217
  505    HG2  ARG  57           2HG      ARG  57  -7.608   4.864   6.034
  506    HG3  ARG  57           3HG      ARG  57  -8.206   6.357   5.297
  507    HD2  ARG  57           2HD      ARG  57  -7.753   6.597   7.740
  508    HD3  ARG  57           3HD      ARG  57  -9.445   6.910   7.324
  509    HE   ARG  57           HE       ARG  57  -8.801   4.183   8.144
  510   HH11  ARG  57          1HH1      ARG  57 -10.118   7.278   9.180
  511   HH12  ARG  57          2HH1      ARG  57 -10.901   6.601  10.570
  512   HH21  ARG  57          1HH2      ARG  57  -9.817   3.327   9.934
  513   HH22  ARG  57          2HH2      ARG  57 -10.726   4.356  10.996
  514    H    ILE  58           H        ILE  58  -7.618   3.587   2.520
  515    HA   ILE  58           HA       ILE  58  -6.559   1.158   3.749
  516    HB   ILE  58           HB       ILE  58  -5.730   2.545   1.144
  517   HG12  ILE  58          2HG1      ILE  58  -7.616   0.159   1.433
  518   HG13  ILE  58          3HG1      ILE  58  -8.128   1.801   1.060
  519   HG21  ILE  58          1HG2      ILE  58  -4.652   0.389   0.569
  520   HG22  ILE  58          2HG2      ILE  58  -5.133  -0.271   2.131
  521   HG23  ILE  58          3HG2      ILE  58  -3.984   1.066   2.059
  522   HD11  ILE  58          3HD1      ILE  58  -6.376   0.053  -0.673
  523   HD12  ILE  58          1HD1      ILE  58  -6.863   1.713  -1.038
  524   HD13  ILE  58          2HD1      ILE  58  -8.076   0.440  -0.931
  525    H    SER  59           H        SER  59  -5.125   1.664   5.363
  526    HA   SER  59           HA       SER  59  -3.187   3.866   5.040
  527    HB2  SER  59           2HB      SER  59  -4.029   2.389   7.580
  528    HB3  SER  59           3HB      SER  59  -2.943   3.781   7.493
  529    HG   SER  59           HG       SER  59  -5.110   4.528   6.245
  530    H    ILE  60           H        ILE  60  -1.444   3.032   4.037
  531    HA   ILE  60           HA       ILE  60  -0.459   0.321   4.661
  532    HB   ILE  60           HB       ILE  60   0.311   2.260   2.435
  533   HG12  ILE  60          2HG1      ILE  60  -1.231  -0.375   2.312
  534   HG13  ILE  60          3HG1      ILE  60  -1.945   1.228   2.171
  535   HG21  ILE  60          1HG2      ILE  60   1.340  -0.560   2.909
  536   HG22  ILE  60          2HG2      ILE  60   2.277   0.926   3.063
  537   HG23  ILE  60          3HG2      ILE  60   1.680   0.422   1.482
  538   HD11  ILE  60          3HD1      ILE  60  -0.674   1.595   0.103
  539   HD12  ILE  60          1HD1      ILE  60  -1.741   0.194   0.012
  540   HD13  ILE  60          2HD1      ILE  60  -0.007  -0.037   0.238
  541    H    ARG  61           H        ARG  61   1.145   0.126   6.110
  542    HA   ARG  61           HA       ARG  61   3.039   2.358   6.585
  543    HB2  ARG  61           2HB      ARG  61   2.284   0.019   8.395
  544    HB3  ARG  61           3HB      ARG  61   3.540   1.203   8.766
  545    HG2  ARG  61           2HG      ARG  61   1.790   2.993   8.727
  546    HG3  ARG  61           3HG      ARG  61   0.566   1.740   8.490
  547    HD2  ARG  61           2HD      ARG  61   1.226   0.708  10.641
  548    HD3  ARG  61           3HD      ARG  61   2.439   1.970  10.877
  549    HE   ARG  61           HE       ARG  61  -0.495   2.328  10.926
  550   HH11  ARG  61          1HH1      ARG  61   2.701   3.605  11.674
  551   HH12  ARG  61          2HH1      ARG  61   2.072   4.895  12.649
  552   HH21  ARG  61          1HH2      ARG  61  -1.276   3.975  12.266
  553   HH22  ARG  61          2HH2      ARG  61  -0.171   5.107  12.982
  554    H    VAL  62           H        VAL  62   5.150   2.022   6.181
  555    HA   VAL  62           HA       VAL  62   6.126  -0.658   5.417
  556    HB   VAL  62           HB       VAL  62   6.593   1.310   3.887
  557   HG11  VAL  62          1HG1      VAL  62   6.978   3.069   5.580
  558   HG12  VAL  62          2HG1      VAL  62   8.331   2.943   4.451
  559   HG13  VAL  62          3HG1      VAL  62   8.472   2.260   6.072
  560   HG21  VAL  62          3HG2      VAL  62   8.965   0.756   3.455
  561   HG22  VAL  62          1HG2      VAL  62   7.988  -0.683   3.745
  562   HG23  VAL  62          2HG2      VAL  62   9.050  -0.071   5.014
  563    H    LYS  63           H        LYS  63   7.675  -1.704   6.663
  564    HA   LYS  63           HA       LYS  63   8.052  -0.793   9.393
  565    HB2  LYS  63           2HB      LYS  63   8.982  -3.295   7.955
  566    HB3  LYS  63           3HB      LYS  63   9.296  -2.978   9.653
  567    HG2  LYS  63           2HG      LYS  63   6.523  -3.252   8.442
  568    HG3  LYS  63           3HG      LYS  63   7.416  -4.552   9.222
  569    HD2  LYS  63           2HD      LYS  63   6.029  -3.866  10.958
  570    HD3  LYS  63           3HD      LYS  63   7.479  -2.930  11.300
  571    HE2  LYS  63           2HE      LYS  63   6.433  -0.958  10.213
  572    HE3  LYS  63           3HE      LYS  63   4.987  -1.914   9.892
  573    HZ1  LYS  63           3HZ      LYS  63   6.072  -1.257  12.574
  574    HZ2  LYS  63           1HZ      LYS  63   4.702  -2.197  12.272
  575    HZ3  LYS  63           2HZ      LYS  63   4.711  -0.564  11.848
  576    H    HIS  64           H        HIS  64   9.784   0.197  10.204
  577    HA   HIS  64           HA       HIS  64  12.384   0.107   8.930
  578    HB2  HIS  64           2HB      HIS  64  12.615   2.588   8.864
  579    HB3  HIS  64           3HB      HIS  64  11.412   1.981   7.732
  580    HD1  HIS  64           HD1      HIS  64  11.487   3.521  11.229
  581    HD2  HIS  64           HD2      HIS  64   9.109   3.429   7.818
  582    HE1  HIS  64           HE1      HIS  64   9.600   5.106  11.674
  583    HE2  HIS  64           HE2      HIS  64   8.132   4.951   9.648
  584    H    SER  65           H        SER  65  14.071   0.792  10.302
  585    HA   SER  65           HA       SER  65  13.674   2.001  12.871
  586    HB2  SER  65           2HB      SER  65  14.548   0.072  14.236
  587    HB3  SER  65           3HB      SER  65  12.988  -0.289  13.492
  588    HG   SER  65           HG       SER  65  14.412  -1.211  11.727
  589    H    ASP  66           H        ASP  66  15.099   2.512  10.490
  590    HA   ASP  66           HA       ASP  66  17.919   2.533  11.367
  591    HB2  ASP  66           2HB      ASP  66  17.531   0.621   9.737
  592    HB3  ASP  66           3HB      ASP  66  16.993   1.791   8.544
  593    H    ALA  67           H        ALA  67  17.531   4.707  11.919
  594    HA   ALA  67           HA       ALA  67  15.861   6.458  10.485
  595    HB1  ALA  67           3HB      ALA  67  16.212   6.619  12.898
  596    HB2  ALA  67           1HB      ALA  67  16.557   8.160  12.108
  597    HB3  ALA  67           2HB      ALA  67  17.884   7.122  12.644
  598    H    ALA  68           H        ALA  68  19.039   5.604   9.745
  599    HA   ALA  68           HA       ALA  68  19.804   8.012   8.358
  600    HB1  ALA  68           3HB      ALA  68  21.496   6.443   9.197
  601    HB2  ALA  68           1HB      ALA  68  21.629   6.608   7.446
  602    HB3  ALA  68           2HB      ALA  68  20.869   5.174   8.147
  603    H    GLU  69           H        GLU  69  18.905   4.721   7.186
  604    HA   GLU  69           HA       GLU  69  18.691   5.725   4.463
  605    HB2  GLU  69           2HB      GLU  69  18.612   2.932   5.646
  606    HB3  GLU  69           3HB      GLU  69  18.325   3.237   3.937
  607    HG2  GLU  69           2HG      GLU  69  20.857   4.002   5.418
  608    HG3  GLU  69           3HG      GLU  69  20.656   2.542   4.451
  609    H    GLU  70           H        GLU  70  16.443   4.805   6.989
  610    HA   GLU  70           HA       GLU  70  14.312   3.811   5.437
  611    HB2  GLU  70           2HB      GLU  70  12.889   4.179   7.382
  612    HB3  GLU  70           3HB      GLU  70  14.448   3.537   7.884
  613    HG2  GLU  70           2HG      GLU  70  15.157   5.757   8.630
  614    HG3  GLU  70           3HG      GLU  70  13.648   6.460   8.048
  615    H    LYS  71           H        LYS  71  15.265   7.091   6.092
  616    HA   LYS  71           HA       LYS  71  12.805   8.383   5.349
  617    HB2  LYS  71           2HB      LYS  71  15.636   9.463   5.734
  618    HB3  LYS  71           3HB      LYS  71  14.181  10.455   5.594
  619    HG2  LYS  71           2HG      LYS  71  13.274   9.511   7.654
  620    HG3  LYS  71           3HG      LYS  71  14.632   8.387   7.778
  621    HD2  LYS  71           2HD      LYS  71  16.176  10.302   8.106
  622    HD3  LYS  71           3HD      LYS  71  14.815  11.423   7.972
  623    HE2  LYS  71           2HE      LYS  71  13.799  10.481   9.990
  624    HE3  LYS  71           3HE      LYS  71  15.075   9.266  10.097
  625    HZ1  LYS  71           3HZ      LYS  71  16.673  11.049  10.438
  626    HZ2  LYS  71           1HZ      LYS  71  15.468  11.069  11.621
  627    HZ3  LYS  71           2HZ      LYS  71  15.439  12.199  10.367
  628    H    LYS  72           H        LYS  72  15.784   7.471   3.773
  629    HA   LYS  72           HA       LYS  72  15.338   8.701   1.225
  630    HB2  LYS  72           2HB      LYS  72  17.585   8.044   1.978
  631    HB3  LYS  72           3HB      LYS  72  17.080   6.366   2.123
  632    HG2  LYS  72           2HG      LYS  72  16.730   6.328  -0.377
  633    HG3  LYS  72           3HG      LYS  72  17.425   7.950  -0.445
  634    HD2  LYS  72           2HD      LYS  72  18.825   5.436   0.554
  635    HD3  LYS  72           3HD      LYS  72  19.107   6.229  -0.996
  636    HE2  LYS  72           2HE      LYS  72  20.012   8.200   0.143
  637    HE3  LYS  72           3HE      LYS  72  19.640   7.492   1.718
  638    HZ1  LYS  72           3HZ      LYS  72  21.192   5.699   1.221
  639    HZ2  LYS  72           1HZ      LYS  72  21.955   7.207   1.174
  640    HZ3  LYS  72           2HZ      LYS  72  21.571   6.413  -0.262
  641    H    GLU  73           H        GLU  73  14.627   5.548   2.693
  642    HA   GLU  73           HA       GLU  73  13.779   4.316   0.219
  643    HB2  GLU  73           2HB      GLU  73  13.563   3.255   3.069
  644    HB3  GLU  73           3HB      GLU  73  13.346   2.317   1.593
  645    HG2  GLU  73           2HG      GLU  73  15.919   3.624   2.522
  646    HG3  GLU  73           3HG      GLU  73  15.545   1.911   2.601
  647    H    ALA  74           H        ALA  74  12.179   6.016   2.836
  648    HA   ALA  74           HA       ALA  74   9.503   5.125   2.221
  649    HB1  ALA  74           3HB      ALA  74   8.781   6.930   3.731
  650    HB2  ALA  74           1HB      ALA  74  10.431   7.569   3.781
  651    HB3  ALA  74           2HB      ALA  74  10.076   5.981   4.462
  652    H    LYS  75           H        LYS  75  11.481   7.985   1.509
  653    HA   LYS  75           HA       LYS  75   9.862   9.426  -0.245
  654    HB2  LYS  75           2HB      LYS  75  12.094  10.140   0.634
  655    HB3  LYS  75           3HB      LYS  75  12.873   8.959  -0.410
  656    HG2  LYS  75           2HG      LYS  75  11.932  10.219  -2.398
  657    HG3  LYS  75           3HG      LYS  75  11.365  11.458  -1.274
  658    HD2  LYS  75           2HD      LYS  75  14.246  10.631  -1.791
  659    HD3  LYS  75           3HD      LYS  75  13.488  12.156  -2.248
  660    HE2  LYS  75           2HE      LYS  75  14.011  11.209   0.599
  661    HE3  LYS  75           3HE      LYS  75  14.926  12.440  -0.268
  662    HZ1  LYS  75           3HZ      LYS  75  13.366  13.469   1.208
  663    HZ2  LYS  75           1HZ      LYS  75  12.073  12.612   0.536
  664    HZ3  LYS  75           2HZ      LYS  75  12.888  13.772  -0.379
  665    H    LYS  76           H        LYS  76  11.983   6.686  -0.841
  666    HA   LYS  76           HA       LYS  76  11.712   6.434  -3.643
  667    HB2  LYS  76           2HB      LYS  76  13.567   5.489  -2.353
  668    HB3  LYS  76           3HB      LYS  76  12.467   4.429  -1.485
  669    HG2  LYS  76           2HG      LYS  76  12.033   3.143  -3.508
  670    HG3  LYS  76           3HG      LYS  76  12.996   4.270  -4.470
  671    HD2  LYS  76           2HD      LYS  76  14.053   2.514  -2.216
  672    HD3  LYS  76           3HD      LYS  76  14.267   2.207  -3.944
  673    HE2  LYS  76           2HE      LYS  76  15.566   4.310  -4.152
  674    HE3  LYS  76           3HE      LYS  76  15.339   4.620  -2.427
  675    HZ1  LYS  76           3HZ      LYS  76  16.566   2.643  -1.921
  676    HZ2  LYS  76           1HZ      LYS  76  17.486   3.647  -2.920
  677    HZ3  LYS  76           2HZ      LYS  76  16.747   2.274  -3.562
  678    H    PHE  77           H        PHE  77  10.036   4.944  -0.892
  679    HA   PHE  77           HA       PHE  77   8.443   3.098  -2.400
  680    HB2  PHE  77           2HB      PHE  77   9.274   2.933   0.066
  681    HB3  PHE  77           3HB      PHE  77   7.936   3.993   0.471
  682    HD1  PHE  77           HD1      PHE  77   8.663   0.731  -1.268
  683    HD2  PHE  77           HD2      PHE  77   5.864   2.986   1.066
  684    HE1  PHE  77           HE1      PHE  77   7.244  -1.268  -1.021
  685    HE2  PHE  77           HE2      PHE  77   4.456   0.982   1.298
  686    HZ   PHE  77           HZ       PHE  77   5.145  -1.142   0.264
  687    H    ALA  78           H        ALA  78   8.160   6.406  -1.391
  688    HA   ALA  78           HA       ALA  78   5.391   6.846  -1.655
  689    HB1  ALA  78           3HB      ALA  78   6.903   8.456  -0.576
  690    HB2  ALA  78           1HB      ALA  78   5.974   9.220  -1.868
  691    HB3  ALA  78           2HB      ALA  78   7.668   8.792  -2.131
  692    H    ALA  79           H        ALA  79   8.081   7.125  -3.958
  693    HA   ALA  79           HA       ALA  79   6.513   7.848  -6.214
  694    HB1  ALA  79           3HB      ALA  79   8.580   7.461  -7.484
  695    HB2  ALA  79           1HB      ALA  79   9.308   6.671  -6.076
  696    HB3  ALA  79           2HB      ALA  79   8.898   8.386  -6.017
  697    H    ILE  80           H        ILE  80   7.655   4.755  -4.921
  698    HA   ILE  80           HA       ILE  80   6.955   3.059  -7.046
  699    HB   ILE  80           HB       ILE  80   7.208   2.518  -4.057
  700   HG12  ILE  80          2HG1      ILE  80   9.304   3.154  -5.139
  701   HG13  ILE  80          3HG1      ILE  80   9.369   1.436  -4.767
  702   HG21  ILE  80          1HG2      ILE  80   6.867   0.434  -6.240
  703   HG22  ILE  80          2HG2      ILE  80   5.713   0.789  -4.958
  704   HG23  ILE  80          3HG2      ILE  80   7.286   0.096  -4.560
  705   HD11  ILE  80          3HD1      ILE  80  10.311   1.906  -6.947
  706   HD12  ILE  80          1HD1      ILE  80   8.803   2.640  -7.484
  707   HD13  ILE  80          2HD1      ILE  80   8.867   0.913  -7.113
  708    H    LEU  81           H        LEU  81   5.080   3.799  -4.062
  709    HA   LEU  81           HA       LEU  81   2.745   2.451  -4.945
  710    HB2  LEU  81           2HB      LEU  81   3.391   4.272  -2.639
  711    HB3  LEU  81           3HB      LEU  81   1.701   4.007  -3.023
  712    HG   LEU  81           HG       LEU  81   3.693   1.806  -2.318
  713   HD11  LEU  81          1HD1      LEU  81   3.149   3.165  -0.362
  714   HD12  LEU  81          2HD1      LEU  81   2.414   1.570  -0.228
  715   HD13  LEU  81          3HD1      LEU  81   1.422   2.963  -0.670
  716   HD21  LEU  81          3HD2      LEU  81   1.984   0.983  -3.874
  717   HD22  LEU  81          1HD2      LEU  81   0.701   1.622  -2.840
  718   HD23  LEU  81          2HD2      LEU  81   1.731   0.304  -2.269
  719    H    ASN  82           H        ASN  82   3.944   5.711  -5.456
  720    HA   ASN  82           HA       ASN  82   1.573   6.978  -6.345
  721    HB2  ASN  82           2HB      ASN  82   3.595   8.270  -5.856
  722    HB3  ASN  82           3HB      ASN  82   4.492   7.439  -7.115
  723   HD21  ASN  82          1HD2      ASN  82   4.318   8.140  -9.216
  724   HD22  ASN  82          2HD2      ASN  82   3.421   9.538  -9.690
  725    H    LYS  83           H        LYS  83   3.969   4.960  -8.035
  726    HA   LYS  83           HA       LYS  83   2.730   4.952 -10.596
  727    HB2  LYS  83           2HB      LYS  83   4.557   2.886  -9.300
  728    HB3  LYS  83           3HB      LYS  83   4.092   2.872 -11.000
  729    HG2  LYS  83           2HG      LYS  83   5.616   5.127  -9.662
  730    HG3  LYS  83           3HG      LYS  83   6.374   3.806 -10.545
  731    HD2  LYS  83           2HD      LYS  83   4.380   5.741 -11.806
  732    HD3  LYS  83           3HD      LYS  83   6.128   5.979 -11.828
  733    HE2  LYS  83           2HE      LYS  83   5.668   4.999 -13.924
  734    HE3  LYS  83           3HE      LYS  83   6.258   3.652 -12.959
  735    HZ1  LYS  83           3HZ      LYS  83   3.431   4.260 -13.629
  736    HZ2  LYS  83           1HZ      LYS  83   3.905   3.024 -12.583
  737    HZ3  LYS  83           2HZ      LYS  83   4.352   2.973 -14.207
  738    H    VAL  84           H        VAL  84   2.427   2.812  -7.746
  739    HA   VAL  84           HA       VAL  84   1.039   0.683  -8.982
  740    HB   VAL  84           HB       VAL  84   1.251   1.506  -6.046
  741   HG11  VAL  84          1HG1      VAL  84   0.101  -1.083  -7.152
  742   HG12  VAL  84          2HG1      VAL  84  -0.788   0.163  -6.275
  743   HG13  VAL  84          3HG1      VAL  84   0.459  -0.774  -5.452
  744   HG21  VAL  84          3HG2      VAL  84   3.387   0.829  -7.100
  745   HG22  VAL  84          1HG2      VAL  84   2.665  -0.705  -7.589
  746   HG23  VAL  84          2HG2      VAL  84   2.887  -0.338  -5.875
  747    H    PHE  85           H        PHE  85  -0.159   3.247  -6.807
  748    HA   PHE  85           HA       PHE  85  -2.892   2.705  -6.904
  749    HB2  PHE  85           2HB      PHE  85  -1.480   5.364  -6.413
  750    HB3  PHE  85           3HB      PHE  85  -3.212   5.133  -6.194
  751    HD1  PHE  85           HD1      PHE  85  -3.591   2.686  -4.796
  752    HD2  PHE  85           HD2      PHE  85  -0.398   5.493  -4.327
  753    HE1  PHE  85           HE1      PHE  85  -3.232   1.910  -2.489
  754    HE2  PHE  85           HE2      PHE  85  -0.043   4.699  -2.032
  755    HZ   PHE  85           HZ       PHE  85  -1.456   2.913  -1.112
  756    H    ALA  86           H        ALA  86  -0.959   4.838  -9.007
  757    HA   ALA  86           HA       ALA  86  -3.078   5.951 -10.518
  758    HB1  ALA  86           3HB      ALA  86  -0.175   5.556 -11.313
  759    HB2  ALA  86           1HB      ALA  86  -0.832   6.942 -10.447
  760    HB3  ALA  86           2HB      ALA  86  -1.327   6.633 -12.113
  761    H    GLU  87           H        GLU  87  -1.323   2.926 -10.795
  762    HA   GLU  87           HA       GLU  87  -2.365   2.245 -13.445
  763    HB2  GLU  87           2HB      GLU  87  -0.515   0.783 -11.513
  764    HB3  GLU  87           3HB      GLU  87  -1.035   0.098 -13.055
  765    HG2  GLU  87           2HG      GLU  87   0.071   1.883 -14.290
  766    HG3  GLU  87           3HG      GLU  87   0.473   2.723 -12.789
  767    H    LEU  88           H        LEU  88  -3.485   2.004 -10.249
  768    HA   LEU  88           HA       LEU  88  -5.152  -0.390 -10.812
  769    HB2  LEU  88           2HB      LEU  88  -4.435   0.810  -8.109
  770    HB3  LEU  88           3HB      LEU  88  -5.483  -0.576  -8.362
  771    HG   LEU  88           HG       LEU  88  -2.479  -0.426  -8.788
  772   HD11  LEU  88          1HD1      LEU  88  -2.395  -2.235  -7.150
  773   HD12  LEU  88          2HD1      LEU  88  -4.153  -2.206  -6.999
  774   HD13  LEU  88          3HD1      LEU  88  -3.197  -0.810  -6.489
  775   HD21  LEU  88          3HD2      LEU  88  -3.362  -1.664 -10.695
  776   HD22  LEU  88          1HD2      LEU  88  -4.293  -2.712  -9.622
  777   HD23  LEU  88          2HD2      LEU  88  -2.528  -2.757  -9.594
  778    H    GLY  89           H        GLY  89  -5.372   2.788 -11.181
  779    HA2  GLY  89           2HA      GLY  89  -7.272   3.925 -11.870
  780    HA3  GLY  89           3HA      GLY  89  -8.285   2.711 -11.112
  781    H    TYR  90           H        TYR  90  -5.857   3.953  -9.042
  782    HA   TYR  90           HA       TYR  90  -7.779   5.651  -7.612
  783    HB2  TYR  90           2HB      TYR  90  -4.978   4.749  -6.802
  784    HB3  TYR  90           3HB      TYR  90  -6.079   5.682  -5.791
  785    HD1  TYR  90           HD2      TYR  90  -8.511   4.563  -5.517
  786    HD2  TYR  90           HD1      TYR  90  -4.919   2.411  -6.426
  787    HE1  TYR  90           HE2      TYR  90  -9.528   2.493  -4.670
  788    HE2  TYR  90           HE1      TYR  90  -5.946   0.344  -5.573
  789    HH   TYR  90           HH       TYR  90  -7.770  -0.267  -3.990
  790    H    ASN  91           H        ASN  91  -7.606   7.795  -7.480
  791    HA   ASN  91           HA       ASN  91  -5.695   9.233  -9.170
  792    HB2  ASN  91           2HB      ASN  91  -8.184   9.734  -9.231
  793    HB3  ASN  91           3HB      ASN  91  -8.083  10.285  -7.567
  794   HD21  ASN  91          1HD2      ASN  91  -7.265  11.008 -10.883
  795   HD22  ASN  91          2HD2      ASN  91  -6.891  12.677 -10.635
  796    H    ASP  92           H        ASP  92  -4.607  11.166  -8.262
  797    HA   ASP  92           HA       ASP  92  -3.129  10.710  -5.920
  798    HB2  ASP  92           2HB      ASP  92  -2.279  12.110  -7.737
  799    HB3  ASP  92           3HB      ASP  92  -3.555  13.296  -7.479
  800    H    SER  93           H        SER  93  -6.157  12.349  -6.421
  801    HA   SER  93           HA       SER  93  -6.424  13.866  -4.087
  802    HB2  SER  93           2HB      SER  93  -7.949  14.074  -6.020
  803    HB3  SER  93           3HB      SER  93  -8.606  12.468  -5.699
  804    HG   SER  93           HG       SER  93  -8.712  14.724  -3.979
  805    H    ASN  94           H        ASN  94  -6.871  10.415  -4.659
  806    HA   ASN  94           HA       ASN  94  -8.121   9.843  -2.135
  807    HB2  ASN  94           2HB      ASN  94  -6.702   7.880  -3.996
  808    HB3  ASN  94           3HB      ASN  94  -7.850   7.477  -2.717
  809   HD21  ASN  94          1HD2      ASN  94 -10.084   8.338  -2.995
  810   HD22  ASN  94          2HD2      ASN  94 -10.721   8.443  -4.602
  811    H    VAL  95           H        VAL  95  -4.808  10.181  -3.224
  812    HA   VAL  95           HA       VAL  95  -3.755   8.528  -0.995
  813    HB   VAL  95           HB       VAL  95  -2.402   9.328  -3.617
  814   HG11  VAL  95          1HG1      VAL  95  -1.548   7.289  -1.530
  815   HG12  VAL  95          2HG1      VAL  95  -0.785   8.856  -1.816
  816   HG13  VAL  95          3HG1      VAL  95  -0.727   7.603  -3.060
  817   HG21  VAL  95          3HG2      VAL  95  -4.337   7.855  -4.060
  818   HG22  VAL  95          1HG2      VAL  95  -3.703   6.670  -2.911
  819   HG23  VAL  95          2HG2      VAL  95  -2.814   7.024  -4.395
  820    H    THR  96           H        THR  96  -3.066   9.789   0.701
  821    HA   THR  96           HA       THR  96  -1.309  12.107   0.090
  822    HB   THR  96           HB       THR  96  -3.421  12.939   1.033
  823    HG1  THR  96           HG1      THR  96  -1.782  14.224   1.628
  824   HG21  THR  96          3HG2      THR  96  -2.811  11.307   3.520
  825   HG22  THR  96          1HG2      THR  96  -4.144  11.020   2.395
  826   HG23  THR  96          2HG2      THR  96  -4.105  12.496   3.355
  827    H    TRP  97           H        TRP  97   0.722  11.853   0.785
  828    HA   TRP  97           HA       TRP  97   1.446   9.577   2.482
  829    HB2  TRP  97           2HB      TRP  97   2.929  11.303   0.497
  830    HB3  TRP  97           3HB      TRP  97   3.871  10.516   1.756
  831    HD1  TRP  97           HD1      TRP  97   1.875   9.690  -1.416
  832    HE1  TRP  97           HE1      TRP  97   2.324   7.229  -2.031
  833    HE3  TRP  97           HE3      TRP  97   4.479   8.257   2.762
  834    HZ2  TRP  97           HZ2      TRP  97   3.612   4.989  -0.898
  835    HZ3  TRP  97           HZ3      TRP  97   5.289   5.935   2.916
  836    HH2  TRP  97           HH2      TRP  97   4.859   4.333   1.118
  837    H    ASP  98           H        ASP  98   2.554   9.684   4.364
  838    HA   ASP  98           HA       ASP  98   3.717  12.151   5.357
  839    HB2  ASP  98           2HB      ASP  98   1.342  12.267   6.166
  840    HB3  ASP  98           3HB      ASP  98   1.558  10.725   6.987
  841    H    GLY  99           H        GLY  99   5.432  10.659   4.706
  842    HA2  GLY  99           2HA      GLY  99   7.337   9.574   5.291
  843    HA3  GLY  99           3HA      GLY  99   6.871   9.824   6.959
  844    H    ASP 100           H        ASP 100   5.804   8.190   8.076
  845    HA   ASP 100           HA       ASP 100   6.613   5.516   7.483
  846    HB2  ASP 100           2HB      ASP 100   6.526   6.357   9.798
  847    HB3  ASP 100           3HB      ASP 100   4.800   6.654   9.668
  848    H    THR 101           H        THR 101   3.517   7.238   7.409
  849    HA   THR 101           HA       THR 101   2.126   4.829   6.386
  850    HB   THR 101           HB       THR 101   0.875   6.997   8.142
  851    HG1  THR 101           HG1      THR 101   2.394   4.809   8.830
  852   HG21  THR 101          3HG2      THR 101  -0.955   5.350   8.448
  853   HG22  THR 101          1HG2      THR 101  -0.142   4.234   7.358
  854   HG23  THR 101          2HG2      THR 101  -0.766   5.768   6.739
  855    H    VAL 102           H        VAL 102   0.954   5.126   4.566
  856    HA   VAL 102           HA       VAL 102   0.337   7.861   3.631
  857    HB   VAL 102           HB       VAL 102   1.563   6.577   1.952
  858   HG11  VAL 102          1HG1      VAL 102   1.026   4.282   2.630
  859   HG12  VAL 102          2HG1      VAL 102   0.717   4.521   0.909
  860   HG13  VAL 102          3HG1      VAL 102  -0.630   4.483   2.049
  861   HG21  VAL 102          3HG2      VAL 102   0.008   6.782   0.042
  862   HG22  VAL 102          1HG2      VAL 102  -0.126   8.154   1.144
  863   HG23  VAL 102          2HG2      VAL 102  -1.354   6.886   1.162
  864    H    THR 103           H        THR 103  -1.720   8.529   3.790
  865    HA   THR 103           HA       THR 103  -3.841   6.661   4.605
  866    HB   THR 103           HB       THR 103  -3.854   9.717   4.563
  867    HG1  THR 103           HG1      THR 103  -2.926   7.867   6.422
  868   HG21  THR 103          3HG2      THR 103  -5.821   9.490   6.059
  869   HG22  THR 103          1HG2      THR 103  -5.764   7.739   5.881
  870   HG23  THR 103          2HG2      THR 103  -6.131   8.758   4.481
  871    H    VAL 104           H        VAL 104  -4.664   5.766   2.806
  872    HA   VAL 104           HA       VAL 104  -5.307   7.418   0.441
  873    HB   VAL 104           HB       VAL 104  -5.193   4.366   0.682
  874   HG11  VAL 104          1HG1      VAL 104  -5.302   4.366  -1.805
  875   HG12  VAL 104          2HG1      VAL 104  -5.494   6.122  -1.793
  876   HG13  VAL 104          3HG1      VAL 104  -6.745   5.094  -1.091
  877   HG21  VAL 104          3HG2      VAL 104  -3.159   6.248  -0.561
  878   HG22  VAL 104          1HG2      VAL 104  -3.080   4.486  -0.566
  879   HG23  VAL 104          2HG2      VAL 104  -2.957   5.369   0.956
  880    H    GLU 105           H        GLU 105  -7.378   8.196   0.717
  881    HA   GLU 105           HA       GLU 105  -9.475   6.313   1.638
  882    HB2  GLU 105           2HB      GLU 105  -9.493   9.368   1.573
  883    HB3  GLU 105           3HB      GLU 105 -10.873   8.365   2.014
  884    HG2  GLU 105           2HG      GLU 105  -9.500   7.434   3.910
  885    HG3  GLU 105           3HG      GLU 105  -8.245   8.610   3.513
  886    H    GLY 106           H        GLY 106 -10.350   5.355  -0.070
  887    HA2  GLY 106           2HA      GLY 106 -10.818   6.902  -2.568
  888    HA3  GLY 106           3HA      GLY 106 -10.419   5.189  -2.512
  889    H    GLN 107           H        GLN 107 -12.863   7.030  -3.247
  890    HA   GLN 107           HA       GLN 107 -15.035   5.661  -1.907
  891    HB2  GLN 107           2HB      GLN 107 -16.533   6.963  -3.269
  892    HB3  GLN 107           3HB      GLN 107 -15.217   8.045  -2.850
  893    HG2  GLN 107           2HG      GLN 107 -15.558   6.646  -5.524
  894    HG3  GLN 107           3HG      GLN 107 -15.976   8.322  -5.192
  895   HE21  GLN 107          1HE2      GLN 107 -14.027   7.027  -7.075
  896   HE22  GLN 107          2HE2      GLN 107 -12.533   7.842  -6.789
  897    H    LEU 108           H        LEU 108 -16.191   3.909  -2.721
  898    HA   LEU 108           HA       LEU 108 -15.167   2.629  -5.195
  899    HB2  LEU 108           2HB      LEU 108 -16.289   1.280  -2.707
  900    HB3  LEU 108           3HB      LEU 108 -15.875   0.447  -4.197
  901    HG   LEU 108           HG       LEU 108 -13.934   1.838  -2.310
  902   HD11  LEU 108          1HD1      LEU 108 -14.781  -0.311  -1.491
  903   HD12  LEU 108          2HD1      LEU 108 -13.075  -0.412  -1.907
  904   HD13  LEU 108          3HD1      LEU 108 -14.285  -1.099  -2.995
  905   HD21  LEU 108          3HD2      LEU 108 -13.332   0.429  -4.944
  906   HD22  LEU 108          1HD2      LEU 108 -12.128   1.003  -3.785
  907   HD23  LEU 108          2HD2      LEU 108 -13.165   2.156  -4.620
  908    H    GLU 109           H        GLU 109 -16.575   1.835  -6.612
  909    HA   GLU 109           HA       GLU 109 -19.234   2.623  -6.889
  910    HB2  GLU 109           2HB      GLU 109 -19.302   0.787  -8.643
  911    HB3  GLU 109           3HB      GLU 109 -17.947   1.898  -8.815
  912    HG2  GLU 109           2HG      GLU 109 -16.454   0.253  -7.738
  913    HG3  GLU 109           3HG      GLU 109 -17.807  -0.861  -7.555
  914    H    GLY 110           H        GLY 110 -17.779  -0.186  -5.329
  915    HA2  GLY 110           2HA      GLY 110 -18.549  -1.788  -3.906
  916    HA3  GLY 110           3HA      GLY 110 -19.983  -0.794  -3.662
  917    H    VAL 111           H        VAL 111 -21.609  -2.278  -3.860
  918    HA   VAL 111           HA       VAL 111 -21.783  -4.019  -6.221
  919    HB   VAL 111           HB       VAL 111 -23.872  -3.760  -4.005
  920   HG11  VAL 111          1HG1      VAL 111 -23.271  -6.046  -5.927
  921   HG12  VAL 111          2HG1      VAL 111 -24.634  -4.930  -6.039
  922   HG13  VAL 111          3HG1      VAL 111 -24.523  -6.052  -4.680
  923   HG21  VAL 111          3HG2      VAL 111 -21.471  -5.640  -4.008
  924   HG22  VAL 111          1HG2      VAL 111 -22.808  -5.688  -2.854
  925   HG23  VAL 111          2HG2      VAL 111 -21.734  -4.288  -2.902
  926    H    ASP 112           H        ASP 112 -21.645  -1.691  -7.234
  927    HA   ASP 112           HA       ASP 112 -22.497  -0.000  -8.460
  928    HB2  ASP 112           2HB      ASP 112 -23.665  -1.932  -9.568
  929    HB3  ASP 112           3HB      ASP 112 -25.044  -1.690  -8.501
  930    H    LEU 113           H        LEU 113 -22.748   0.086  -5.521
  931    HA   LEU 113           HA       LEU 113 -25.262   1.299  -4.804
  932    HB2  LEU 113           2HB      LEU 113 -22.638   1.211  -3.256
  933    HB3  LEU 113           3HB      LEU 113 -24.209   1.656  -2.600
  934    HG   LEU 113           HG       LEU 113 -23.415  -1.106  -3.615
  935   HD11  LEU 113          1HD1      LEU 113 -23.973  -0.163  -0.786
  936   HD12  LEU 113          2HD1      LEU 113 -22.389  -0.539  -1.468
  937   HD13  LEU 113          3HD1      LEU 113 -23.589  -1.812  -1.287
  938   HD21  LEU 113          3HD2      LEU 113 -25.782  -0.698  -4.095
  939   HD22  LEU 113          1HD2      LEU 113 -26.067  -0.213  -2.419
  940   HD23  LEU 113          2HD2      LEU 113 -25.606  -1.876  -2.798
  941    H    GLU 114           H        GLU 114 -25.776   3.419  -4.827
  942    HA   GLU 114           HA       GLU 114 -24.123   5.345  -6.145
  943    HB2  GLU 114           2HB      GLU 114 -26.668   5.866  -4.553
  944    HB3  GLU 114           3HB      GLU 114 -25.961   6.903  -5.792
  945    HG2  GLU 114           2HG      GLU 114 -26.436   5.138  -7.490
  946    HG3  GLU 114           3HG      GLU 114 -27.196   4.168  -6.228
  947    H    HIS 115           H        HIS 115 -22.458   6.329  -5.170
  948    HA   HIS 115           HA       HIS 115 -22.064   6.549  -2.346
  949    HB2  HIS 115           2HB      HIS 115 -20.172   6.367  -3.908
  950    HB3  HIS 115           3HB      HIS 115 -20.632   7.870  -4.691
  951    HD1  HIS 115           HD1      HIS 115 -19.897  10.050  -3.588
  952    HD2  HIS 115           HD2      HIS 115 -18.911   6.678  -1.377
  953    HE1  HIS 115           HE1      HIS 115 -18.277  10.839  -1.843
  954    HE2  HIS 115           HE2      HIS 115 -17.830   8.809  -0.428
  955    H    HIS 116           H        HIS 116 -23.833   7.651  -1.516
  956    HA   HIS 116           HA       HIS 116 -24.204  10.515  -2.165
  957    HB2  HIS 116           2HB      HIS 116 -25.942   8.523  -0.643
  958    HB3  HIS 116           3HB      HIS 116 -26.265  10.254  -0.640
  959    HD1  HIS 116           HD1      HIS 116 -26.792  11.316  -3.054
  960    HD2  HIS 116           HD2      HIS 116 -27.048   7.178  -2.782
  961    HE1  HIS 116           HE1      HIS 116 -28.131  10.591  -5.048
  962    HE2  HIS 116           HE2      HIS 116 -28.448   8.116  -4.746
  963    H    HIS 117           H        HIS 117 -24.190  12.046  -0.486
  964    HA   HIS 117           HA       HIS 117 -23.440  11.340   2.227
  965    HB2  HIS 117           2HB      HIS 117 -21.230  11.470   1.022
  966    HB3  HIS 117           3HB      HIS 117 -21.593  13.131   0.569
  967    HD1  HIS 117           HD1      HIS 117 -21.287  14.947   2.358
  968    HD2  HIS 117           HD2      HIS 117 -20.595  11.109   3.792
  969    HE1  HIS 117           HE1      HIS 117 -20.241  15.240   4.614
  970    HE2  HIS 117           HE2      HIS 117 -19.671  12.916   5.369
  971    H    HIS 118           H        HIS 118 -25.110  12.367   3.123
  972    HA   HIS 118           HA       HIS 118 -26.074  14.966   2.239
  973    HB2  HIS 118           2HB      HIS 118 -27.011  13.072   4.440
  974    HB3  HIS 118           3HB      HIS 118 -27.756  14.634   4.134
  975    HD1  HIS 118           HD1      HIS 118 -29.579  14.695   2.435
  976    HD2  HIS 118           HD2      HIS 118 -27.308  11.228   2.155
  977    HE1  HIS 118           HE1      HIS 118 -30.773  13.237   0.780
  978    HE2  HIS 118           HE2      HIS 118 -29.451  11.101   0.730
  979    H    HIS 119           H        HIS 119 -26.308  16.772   3.694
  980    HA   HIS 119           HA       HIS 119 -24.684  16.844   6.147
  981    HB2  HIS 119           2HB      HIS 119 -23.171  17.649   4.351
  982    HB3  HIS 119           3HB      HIS 119 -24.359  18.848   3.858
  983    HD1  HIS 119           HD1      HIS 119 -23.391  21.057   4.478
  984    HD2  HIS 119           HD2      HIS 119 -22.757  18.224   7.461
  985    HE1  HIS 119           HE1      HIS 119 -22.266  22.280   6.360
  986    HE2  HIS 119           HE2      HIS 119 -22.084  20.595   8.209
  987    H    HIS 120           H        HIS 120 -27.481  17.758   4.383
  988    HA   HIS 120           HA       HIS 120 -28.319  19.998   5.953
  989    HB2  HIS 120           2HB      HIS 120 -29.889  18.097   4.175
  990    HB3  HIS 120           3HB      HIS 120 -30.613  19.485   4.972
  991    HD1  HIS 120           HD1      HIS 120 -29.751  18.680   1.776
  992    HD2  HIS 120           HD2      HIS 120 -28.669  21.895   4.175
  993    HE1  HIS 120           HE1      HIS 120 -29.075  20.504   0.193
  994    HE2  HIS 120           HE2      HIS 120 -28.228  22.347   1.673
  Start of MODEL   12
    1    H1   MET   1           1H       MET   1  21.433  -0.754  -3.907
    2    H2   MET   1           2H       MET   1  22.501  -1.848  -4.636
    3    H3   MET   1           3H       MET   1  22.387  -1.766  -2.950
    4    HA   MET   1           HA       MET   1  20.237  -2.602  -4.780
    5    HB2  MET   1           2HB      MET   1  22.066  -4.255  -4.670
    6    HB3  MET   1           3HB      MET   1  21.995  -4.254  -2.916
    7    HG2  MET   1           2HG      MET   1  19.807  -5.308  -2.958
    8    HG3  MET   1           3HG      MET   1  19.736  -5.180  -4.716
    9    HE1  MET   1           3HE      MET   1  22.473  -7.758  -5.848
   10    HE2  MET   1           1HE      MET   1  22.680  -6.018  -5.650
   11    HE3  MET   1           2HE      MET   1  21.207  -6.654  -6.385
   12    H    SER   2           H        SER   2  18.250  -2.789  -3.882
   13    HA   SER   2           HA       SER   2  17.833  -1.863  -1.107
   14    HB2  SER   2           2HB      SER   2  15.853  -2.089  -3.430
   15    HB3  SER   2           3HB      SER   2  15.545  -1.322  -1.870
   16    HG   SER   2           HG       SER   2  17.651  -0.123  -2.655
   17    H    GLY   3           H        GLY   3  18.781  -4.510  -1.555
   18    HA2  GLY   3           2HA      GLY   3  16.743  -6.496  -1.564
   19    HA3  GLY   3           3HA      GLY   3  18.419  -6.709  -1.093
   20    H    LYS   4           H        LYS   4  15.247  -5.690   0.035
   21    HA   LYS   4           HA       LYS   4  15.926  -6.352   2.811
   22    HB2  LYS   4           2HB      LYS   4  16.424  -3.847   2.243
   23    HB3  LYS   4           3HB      LYS   4  14.684  -3.649   2.134
   24    HG2  LYS   4           2HG      LYS   4  14.899  -3.052   4.327
   25    HG3  LYS   4           3HG      LYS   4  14.829  -4.789   4.606
   26    HD2  LYS   4           2HD      LYS   4  17.378  -3.137   4.362
   27    HD3  LYS   4           3HD      LYS   4  16.652  -3.654   5.878
   28    HE2  LYS   4           2HE      LYS   4  17.748  -5.541   3.755
   29    HE3  LYS   4           3HE      LYS   4  18.607  -5.040   5.208
   30    HZ1  LYS   4           3HZ      LYS   4  16.864  -6.075   6.540
   31    HZ2  LYS   4           1HZ      LYS   4  17.616  -7.187   5.515
   32    HZ3  LYS   4           2HZ      LYS   4  16.079  -6.597   5.136
   33    H    LYS   5           H        LYS   5  14.134  -7.005   3.993
   34    HA   LYS   5           HA       LYS   5  11.592  -7.397   2.633
   35    HB2  LYS   5           2HB      LYS   5  12.552  -9.201   4.068
   36    HB3  LYS   5           3HB      LYS   5  12.460  -8.133   5.465
   37    HG2  LYS   5           2HG      LYS   5   9.937  -8.027   5.100
   38    HG3  LYS   5           3HG      LYS   5  10.135  -9.281   3.878
   39    HD2  LYS   5           2HD      LYS   5   9.462 -10.429   5.846
   40    HD3  LYS   5           3HD      LYS   5  11.194 -10.724   5.720
   41    HE2  LYS   5           2HE      LYS   5  10.011  -8.550   7.481
   42    HE3  LYS   5           3HE      LYS   5  10.306 -10.190   8.046
   43    HZ1  LYS   5           3HZ      LYS   5  12.359  -8.292   7.059
   44    HZ2  LYS   5           1HZ      LYS   5  12.659  -9.890   7.524
   45    HZ3  LYS   5           2HZ      LYS   5  12.110  -8.763   8.659
   46    H    VAL   6           H        VAL   6  10.279  -5.679   2.585
   47    HA   VAL   6           HA       VAL   6   9.919  -3.983   4.983
   48    HB   VAL   6           HB       VAL   6  10.153  -2.537   3.085
   49   HG11  VAL   6          1HG1      VAL   6   9.902  -4.203   1.285
   50   HG12  VAL   6          2HG1      VAL   6   8.929  -2.765   0.964
   51   HG13  VAL   6          3HG1      VAL   6   8.159  -4.241   1.555
   52   HG21  VAL   6          3HG2      VAL   6   7.957  -1.436   2.860
   53   HG22  VAL   6          1HG2      VAL   6   8.244  -1.924   4.534
   54   HG23  VAL   6          2HG2      VAL   6   7.158  -2.868   3.510
   55    H    GLU   7           H        GLU   7   8.020  -4.064   6.071
   56    HA   GLU   7           HA       GLU   7   6.055  -6.144   5.323
   57    HB2  GLU   7           2HB      GLU   7   6.508  -4.765   8.003
   58    HB3  GLU   7           3HB      GLU   7   5.257  -5.961   7.685
   59    HG2  GLU   7           2HG      GLU   7   6.951  -7.679   7.264
   60    HG3  GLU   7           3HG      GLU   7   8.235  -6.483   7.451
   61    H    VAL   8           H        VAL   8   4.414  -5.377   4.249
   62    HA   VAL   8           HA       VAL   8   3.652  -2.546   4.349
   63    HB   VAL   8           HB       VAL   8   2.921  -4.776   2.380
   64   HG11  VAL   8          1HG1      VAL   8   1.073  -3.146   2.514
   65   HG12  VAL   8          2HG1      VAL   8   1.904  -3.028   0.962
   66   HG13  VAL   8          3HG1      VAL   8   2.205  -1.826   2.217
   67   HG21  VAL   8          3HG2      VAL   8   4.759  -2.374   2.043
   68   HG22  VAL   8          1HG2      VAL   8   4.374  -3.560   0.791
   69   HG23  VAL   8          2HG2      VAL   8   5.276  -4.052   2.227
   70    H    GLN   9           H        GLN   9   2.156  -2.115   5.868
   71    HA   GLN   9           HA       GLN   9   0.280  -4.212   6.766
   72    HB2  GLN   9           2HB      GLN   9   0.883  -1.482   8.004
   73    HB3  GLN   9           3HB      GLN   9  -0.058  -2.780   8.735
   74    HG2  GLN   9           2HG      GLN   9   2.005  -4.191   8.794
   75    HG3  GLN   9           3HG      GLN   9   2.919  -2.828   8.148
   76   HE21  GLN   9          1HE2      GLN   9   1.174  -4.037  10.944
   77   HE22  GLN   9          2HE2      GLN   9   1.834  -2.906  12.074
   78    H    VAL  10           H        VAL  10  -1.429  -4.192   5.354
   79    HA   VAL  10           HA       VAL  10  -2.540  -1.642   4.382
   80    HB   VAL  10           HB       VAL  10  -3.204  -4.508   3.523
   81   HG11  VAL  10          1HG1      VAL  10  -4.382  -3.473   1.607
   82   HG12  VAL  10          2HG1      VAL  10  -4.049  -1.869   2.265
   83   HG13  VAL  10          3HG1      VAL  10  -5.105  -2.979   3.142
   84   HG21  VAL  10          3HG2      VAL  10  -1.915  -4.009   1.472
   85   HG22  VAL  10          1HG2      VAL  10  -0.895  -3.885   2.910
   86   HG23  VAL  10          2HG2      VAL  10  -1.488  -2.423   2.118
   87    H    LYS  11           H        LYS  11  -3.961  -0.766   5.754
   88    HA   LYS  11           HA       LYS  11  -5.882  -2.460   7.258
   89    HB2  LYS  11           2HB      LYS  11  -4.302  -1.039   8.608
   90    HB3  LYS  11           3HB      LYS  11  -4.916   0.395   7.791
   91    HG2  LYS  11           2HG      LYS  11  -7.228  -0.238   8.740
   92    HG3  LYS  11           3HG      LYS  11  -6.379  -1.406   9.756
   93    HD2  LYS  11           2HD      LYS  11  -6.055   1.617   9.758
   94    HD3  LYS  11           3HD      LYS  11  -6.763   0.623  11.031
   95    HE2  LYS  11           2HE      LYS  11  -3.843   0.610  10.181
   96    HE3  LYS  11           3HE      LYS  11  -4.503   1.363  11.629
   97    HZ1  LYS  11           3HZ      LYS  11  -3.525  -0.745  12.168
   98    HZ2  LYS  11           1HZ      LYS  11  -4.495  -1.545  11.035
   99    HZ3  LYS  11           2HZ      LYS  11  -5.197  -0.835  12.392
  100    H    ILE  12           H        ILE  12  -7.715  -2.544   5.945
  101    HA   ILE  12           HA       ILE  12  -8.605  -0.011   4.685
  102    HB   ILE  12           HB       ILE  12  -8.027  -1.658   2.991
  103   HG12  ILE  12          2HG1      ILE  12 -11.045  -1.280   3.172
  104   HG13  ILE  12          3HG1      ILE  12  -9.903  -0.087   2.565
  105   HG21  ILE  12          1HG2      ILE  12  -8.351  -3.755   4.221
  106   HG22  ILE  12          2HG2      ILE  12  -9.221  -3.787   2.686
  107   HG23  ILE  12          3HG2      ILE  12 -10.101  -3.514   4.193
  108   HD11  ILE  12          3HD1      ILE  12 -11.045  -1.195   0.757
  109   HD12  ILE  12          1HD1      ILE  12 -10.486  -2.770   1.321
  110   HD13  ILE  12          2HD1      ILE  12  -9.327  -1.580   0.722
  111    H    THR  13           H        THR  13 -10.406   0.863   5.397
  112    HA   THR  13           HA       THR  13 -12.163  -0.620   7.244
  113    HB   THR  13           HB       THR  13 -12.019   2.396   6.770
  114    HG1  THR  13           HG1      THR  13 -10.073   1.108   7.690
  115   HG21  THR  13          3HG2      THR  13 -13.126   2.557   8.975
  116   HG22  THR  13          1HG2      THR  13 -13.158   0.802   9.109
  117   HG23  THR  13          2HG2      THR  13 -14.118   1.608   7.863
  118    H    CYS  14           H        CYS  14 -13.726  -1.609   6.020
  119    HA   CYS  14           HA       CYS  14 -15.142  -0.088   3.888
  120    HB2  CYS  14           2HB      CYS  14 -14.020  -2.036   2.965
  121    HB3  CYS  14           3HB      CYS  14 -14.679  -3.077   4.217
  122    H    ASN  15           H        ASN  15 -17.184   0.386   4.235
  123    HA   ASN  15           HA       ASN  15 -19.334   0.410   4.842
  124    HB2  ASN  15           2HB      ASN  15 -19.457  -1.993   4.322
  125    HB3  ASN  15           3HB      ASN  15 -18.844  -2.392   5.925
  126   HD21  ASN  15          1HD2      ASN  15 -21.619  -1.206   4.127
  127   HD22  ASN  15          2HD2      ASN  15 -22.773  -1.427   5.397
  128    H    GLY  16           H        GLY  16 -17.994  -1.410   7.621
  129    HA2  GLY  16           2HA      GLY  16 -17.795   0.933   9.306
  130    HA3  GLY  16           3HA      GLY  16 -19.150  -0.117   9.722
  131    H    LYS  17           H        LYS  17 -16.428  -1.730   8.367
  132    HA   LYS  17           HA       LYS  17 -15.396  -2.538  11.035
  133    HB2  LYS  17           2HB      LYS  17 -15.890  -4.371   8.638
  134    HB3  LYS  17           3HB      LYS  17 -15.083  -4.851  10.127
  135    HG2  LYS  17           2HG      LYS  17 -17.171  -4.498  11.397
  136    HG3  LYS  17           3HG      LYS  17 -17.974  -3.948   9.924
  137    HD2  LYS  17           2HD      LYS  17 -18.579  -6.277  10.423
  138    HD3  LYS  17           3HD      LYS  17 -17.681  -6.176   8.906
  139    HE2  LYS  17           2HE      LYS  17 -16.930  -8.105  10.208
  140    HE3  LYS  17           3HE      LYS  17 -15.624  -6.922  10.117
  141    HZ1  LYS  17           3HZ      LYS  17 -17.466  -7.308  12.428
  142    HZ2  LYS  17           1HZ      LYS  17 -16.217  -6.168  12.350
  143    HZ3  LYS  17           2HZ      LYS  17 -15.857  -7.816  12.348
  144    H    THR  18           H        THR  18 -13.205  -3.302  11.041
  145    HA   THR  18           HA       THR  18 -11.476  -2.104   8.964
  146    HB   THR  18           HB       THR  18 -10.791  -2.894  11.843
  147    HG1  THR  18           HG1      THR  18 -11.280  -0.901  12.365
  148   HG21  THR  18          3HG2      THR  18  -9.147  -1.330   9.815
  149   HG22  THR  18          1HG2      THR  18  -8.806  -2.981  10.349
  150   HG23  THR  18          2HG2      THR  18  -8.698  -1.640  11.491
  151    H    TYR  19           H        TYR  19 -10.533  -3.483   7.606
  152    HA   TYR  19           HA       TYR  19 -10.005  -6.305   8.352
  153    HB2  TYR  19           2HB      TYR  19 -10.394  -5.208   5.517
  154    HB3  TYR  19           3HB      TYR  19 -10.302  -6.897   6.004
  155    HD1  TYR  19           HD1      TYR  19 -12.243  -8.004   7.095
  156    HD2  TYR  19           HD2      TYR  19 -12.469  -3.929   5.812
  157    HE1  TYR  19           HE1      TYR  19 -14.692  -8.053   7.331
  158    HE2  TYR  19           HE2      TYR  19 -14.905  -3.980   6.047
  159    HH   TYR  19           HH       TYR  19 -16.717  -5.641   6.045
  160    H    GLU  20           H        GLU  20  -7.841  -6.382   8.881
  161    HA   GLU  20           HA       GLU  20  -5.899  -5.027   7.108
  162    HB2  GLU  20           2HB      GLU  20  -4.636  -4.178   9.057
  163    HB3  GLU  20           3HB      GLU  20  -6.251  -3.488   8.956
  164    HG2  GLU  20           2HG      GLU  20  -7.034  -4.976  10.747
  165    HG3  GLU  20           3HG      GLU  20  -5.452  -5.750  10.821
  166    H    ARG  21           H        ARG  21  -3.795  -5.795   7.145
  167    HA   ARG  21           HA       ARG  21  -2.955  -8.037   8.733
  168    HB2  ARG  21           2HB      ARG  21  -4.310  -9.251   7.060
  169    HB3  ARG  21           3HB      ARG  21  -3.460  -8.451   5.740
  170    HG2  ARG  21           2HG      ARG  21  -1.380  -9.603   6.351
  171    HG3  ARG  21           3HG      ARG  21  -2.180 -10.351   7.733
  172    HD2  ARG  21           2HD      ARG  21  -3.662 -11.602   6.230
  173    HD3  ARG  21           3HD      ARG  21  -2.940 -10.798   4.829
  174    HE   ARG  21           HE       ARG  21  -1.004 -12.151   6.457
  175   HH11  ARG  21          1HH1      ARG  21  -3.346 -12.697   3.868
  176   HH12  ARG  21          2HH1      ARG  21  -2.517 -14.106   3.279
  177   HH21  ARG  21          1HH2      ARG  21   0.029 -14.002   5.663
  178   HH22  ARG  21          2HH2      ARG  21  -0.627 -14.831   4.289
  179    H    THR  22           H        THR  22  -0.750  -8.139   8.820
  180    HA   THR  22           HA       THR  22   0.858  -6.184   7.354
  181    HB   THR  22           HB       THR  22   1.596  -8.108   9.617
  182    HG1  THR  22           HG1      THR  22   0.065  -6.191   9.932
  183   HG21  THR  22          3HG2      THR  22   3.595  -7.484   8.303
  184   HG22  THR  22          1HG2      THR  22   3.623  -6.694   9.884
  185   HG23  THR  22          2HG2      THR  22   3.166  -5.778   8.446
  186    H    TYR  23           H        TYR  23   1.672  -6.812   5.412
  187    HA   TYR  23           HA       TYR  23   2.080  -9.666   4.759
  188    HB2  TYR  23           2HB      TYR  23   2.086  -7.200   2.945
  189    HB3  TYR  23           3HB      TYR  23   2.194  -8.871   2.402
  190    HD1  TYR  23           HD2      TYR  23   0.185 -10.365   2.533
  191    HD2  TYR  23           HD1      TYR  23  -0.061  -6.231   3.593
  192    HE1  TYR  23           HE2      TYR  23  -2.272 -10.471   2.412
  193    HE2  TYR  23           HE1      TYR  23  -2.509  -6.338   3.478
  194    HH   TYR  23           HH       TYR  23  -4.238  -7.732   2.337
  195    H    GLN  24           H        GLN  24   4.077 -10.495   4.517
  196    HA   GLN  24           HA       GLN  24   6.443  -8.776   4.960
  197    HB2  GLN  24           2HB      GLN  24   6.106 -11.811   4.968
  198    HB3  GLN  24           3HB      GLN  24   7.680 -11.028   5.030
  199    HG2  GLN  24           2HG      GLN  24   7.025 -11.707   7.264
  200    HG3  GLN  24           3HG      GLN  24   7.073  -9.951   7.168
  201   HE21  GLN  24          1HE2      GLN  24   5.163  -8.794   7.438
  202   HE22  GLN  24          2HE2      GLN  24   3.687  -9.522   7.960
  203    H    LEU  25           H        LEU  25   7.245  -7.891   3.153
  204    HA   LEU  25           HA       LEU  25   7.221  -9.413   0.607
  205    HB2  LEU  25           2HB      LEU  25   6.721  -6.419   0.973
  206    HB3  LEU  25           3HB      LEU  25   6.854  -7.241  -0.573
  207    HG   LEU  25           HG       LEU  25   4.637  -7.629   1.479
  208   HD11  LEU  25          1HD1      LEU  25   4.432  -5.536   0.236
  209   HD12  LEU  25          2HD1      LEU  25   3.165  -6.666  -0.228
  210   HD13  LEU  25          3HD1      LEU  25   4.547  -6.405  -1.297
  211   HD21  LEU  25          3HD2      LEU  25   5.109  -9.765   0.395
  212   HD22  LEU  25          1HD2      LEU  25   5.005  -9.013  -1.201
  213   HD23  LEU  25          2HD2      LEU  25   3.572  -9.120  -0.172
  214    H    TYR  26           H        TYR  26   9.323 -10.064   0.589
  215    HA   TYR  26           HA       TYR  26  11.524  -8.199   0.969
  216    HB2  TYR  26           2HB      TYR  26  11.785 -10.589   1.636
  217    HB3  TYR  26           3HB      TYR  26  11.549 -11.093  -0.037
  218    HD1  TYR  26           HD1      TYR  26  13.850  -9.316   2.274
  219    HD2  TYR  26           HD2      TYR  26  13.407 -10.941  -1.655
  220    HE1  TYR  26           HE1      TYR  26  16.242  -8.996   1.873
  221    HE2  TYR  26           HE2      TYR  26  15.816 -10.625  -2.054
  222    HH   TYR  26           HH       TYR  26  17.635  -9.155  -1.178
  223    H    ALA  27           H        ALA  27  12.471  -7.058  -0.622
  224    HA   ALA  27           HA       ALA  27  12.095  -7.816  -3.463
  225    HB1  ALA  27           3HB      ALA  27  11.896  -5.400  -4.001
  226    HB2  ALA  27           1HB      ALA  27  11.894  -5.023  -2.278
  227    HB3  ALA  27           2HB      ALA  27  10.576  -5.963  -2.983
  228    H    VAL  28           H        VAL  28  13.852  -7.335  -4.785
  229    HA   VAL  28           HA       VAL  28  16.461  -7.014  -3.498
  230    HB   VAL  28           HB       VAL  28  15.773  -7.496  -6.445
  231   HG11  VAL  28          1HG1      VAL  28  18.123  -8.224  -6.689
  232   HG12  VAL  28          2HG1      VAL  28  18.436  -7.792  -5.007
  233   HG13  VAL  28          3HG1      VAL  28  18.020  -6.537  -6.177
  234   HG21  VAL  28          3HG2      VAL  28  16.338  -9.871  -6.033
  235   HG22  VAL  28          1HG2      VAL  28  14.961  -9.355  -5.052
  236   HG23  VAL  28          2HG2      VAL  28  16.557  -9.524  -4.315
  237    H    ARG  29           H        ARG  29  14.375  -5.401  -5.790
  238    HA   ARG  29           HA       ARG  29  15.745  -2.821  -5.341
  239    HB2  ARG  29           2HB      ARG  29  13.972  -3.530  -7.744
  240    HB3  ARG  29           3HB      ARG  29  14.936  -2.070  -7.522
  241    HG2  ARG  29           2HG      ARG  29  17.005  -3.381  -7.784
  242    HG3  ARG  29           3HG      ARG  29  16.051  -4.861  -7.938
  243    HD2  ARG  29           2HD      ARG  29  14.935  -3.799  -9.977
  244    HD3  ARG  29           3HD      ARG  29  16.148  -2.514  -9.870
  245    HE   ARG  29           HE       ARG  29  17.330  -5.103  -9.891
  246   HH11  ARG  29          1HH1      ARG  29  15.953  -2.716 -12.064
  247   HH12  ARG  29          2HH1      ARG  29  16.836  -3.288 -13.446
  248   HH21  ARG  29          1HH2      ARG  29  18.425  -5.899 -11.700
  249   HH22  ARG  29          2HH2      ARG  29  18.241  -5.100 -13.229
  250    H    ASP  30           H        ASP  30  14.282  -1.076  -4.947
  251    HA   ASP  30           HA       ASP  30  11.777  -1.425  -3.756
  252    HB2  ASP  30           2HB      ASP  30  11.423   1.016  -4.264
  253    HB3  ASP  30           3HB      ASP  30  12.965   0.665  -3.492
  254    H    GLU  31           H        GLU  31  12.710  -1.203  -7.109
  255    HA   GLU  31           HA       GLU  31  10.211  -0.877  -8.375
  256    HB2  GLU  31           2HB      GLU  31  12.750  -2.213  -9.392
  257    HB3  GLU  31           3HB      GLU  31  11.390  -1.729 -10.407
  258    HG2  GLU  31           2HG      GLU  31  11.773   0.639  -9.797
  259    HG3  GLU  31           3HG      GLU  31  13.123   0.153  -8.765
  260    H    GLU  32           H        GLU  32  11.813  -3.753  -7.082
  261    HA   GLU  32           HA       GLU  32  10.176  -5.695  -8.366
  262    HB2  GLU  32           2HB      GLU  32  11.598  -5.956  -5.688
  263    HB3  GLU  32           3HB      GLU  32  10.983  -7.282  -6.665
  264    HG2  GLU  32           2HG      GLU  32  13.273  -5.427  -7.332
  265    HG3  GLU  32           3HG      GLU  32  13.390  -7.123  -6.887
  266    H    LEU  33           H        LEU  33   9.797  -3.726  -5.494
  267    HA   LEU  33           HA       LEU  33   7.669  -5.192  -4.291
  268    HB2  LEU  33           2HB      LEU  33   9.401  -3.214  -3.436
  269    HB3  LEU  33           3HB      LEU  33   7.929  -2.289  -3.611
  270    HG   LEU  33           HG       LEU  33   8.213  -3.017  -1.295
  271   HD11  LEU  33          1HD1      LEU  33   5.905  -2.855  -2.032
  272   HD12  LEU  33          2HD1      LEU  33   6.094  -4.115  -0.818
  273   HD13  LEU  33          3HD1      LEU  33   5.914  -4.550  -2.522
  274   HD21  LEU  33          3HD2      LEU  33   8.174  -5.386  -0.620
  275   HD22  LEU  33          1HD2      LEU  33   9.586  -4.983  -1.591
  276   HD23  LEU  33          2HD2      LEU  33   8.246  -5.867  -2.317
  277    H    LYS  34           H        LYS  34   7.753  -3.000  -6.949
  278    HA   LYS  34           HA       LYS  34   5.342  -1.628  -6.869
  279    HB2  LYS  34           2HB      LYS  34   6.785  -2.827  -9.268
  280    HB3  LYS  34           3HB      LYS  34   5.422  -1.720  -9.413
  281    HG2  LYS  34           2HG      LYS  34   6.707   0.060  -8.335
  282    HG3  LYS  34           3HG      LYS  34   8.059  -1.050  -8.074
  283    HD2  LYS  34           2HD      LYS  34   8.431   0.436 -10.035
  284    HD3  LYS  34           3HD      LYS  34   8.406  -1.272 -10.486
  285    HE2  LYS  34           2HE      LYS  34   7.158   0.091 -12.111
  286    HE3  LYS  34           3HE      LYS  34   6.068  -1.018 -11.274
  287    HZ1  LYS  34           3HZ      LYS  34   5.021   1.076 -11.355
  288    HZ2  LYS  34           1HZ      LYS  34   6.399   1.893 -10.836
  289    HZ3  LYS  34           2HZ      LYS  34   5.549   0.903  -9.760
  290    H    GLU  35           H        GLU  35   5.846  -4.645  -8.721
  291    HA   GLU  35           HA       GLU  35   3.167  -5.172  -9.260
  292    HB2  GLU  35           2HB      GLU  35   3.997  -7.500  -9.855
  293    HB3  GLU  35           3HB      GLU  35   4.797  -6.161 -10.657
  294    HG2  GLU  35           2HG      GLU  35   6.584  -7.537 -10.164
  295    HG3  GLU  35           3HG      GLU  35   6.619  -6.425  -8.801
  296    H    LYS  36           H        LYS  36   5.078  -5.993  -6.436
  297    HA   LYS  36           HA       LYS  36   3.374  -7.959  -5.314
  298    HB2  LYS  36           2HB      LYS  36   5.216  -6.069  -3.783
  299    HB3  LYS  36           3HB      LYS  36   4.598  -7.627  -3.227
  300    HG2  LYS  36           2HG      LYS  36   5.868  -8.748  -5.062
  301    HG3  LYS  36           3HG      LYS  36   6.524  -7.174  -5.524
  302    HD2  LYS  36           2HD      LYS  36   7.432  -7.041  -3.108
  303    HD3  LYS  36           3HD      LYS  36   7.049  -8.760  -2.993
  304    HE2  LYS  36           2HE      LYS  36   8.980  -7.432  -4.917
  305    HE3  LYS  36           3HE      LYS  36   9.381  -8.519  -3.592
  306    HZ1  LYS  36           3HZ      LYS  36   7.893  -9.238  -6.055
  307    HZ2  LYS  36           1HZ      LYS  36   8.217 -10.291  -4.773
  308    HZ3  LYS  36           2HZ      LYS  36   9.490  -9.661  -5.695
  309    H    LEU  37           H        LEU  37   3.630  -4.435  -4.835
  310    HA   LEU  37           HA       LEU  37   1.570  -4.061  -2.960
  311    HB2  LEU  37           2HB      LEU  37   2.656  -2.211  -5.116
  312    HB3  LEU  37           3HB      LEU  37   1.489  -1.686  -3.912
  313    HG   LEU  37           HG       LEU  37   4.248  -2.750  -3.220
  314   HD11  LEU  37          1HD1      LEU  37   4.900  -0.424  -2.848
  315   HD12  LEU  37          2HD1      LEU  37   3.335   0.124  -3.453
  316   HD13  LEU  37          3HD1      LEU  37   4.458  -0.709  -4.529
  317   HD21  LEU  37          3HD2      LEU  37   2.203  -1.274  -1.521
  318   HD22  LEU  37          1HD2      LEU  37   3.823  -1.761  -1.011
  319   HD23  LEU  37          2HD2      LEU  37   2.618  -2.986  -1.395
  320    H    LYS  38           H        LYS  38   1.504  -4.015  -6.565
  321    HA   LYS  38           HA       LYS  38  -1.138  -3.262  -6.935
  322    HB2  LYS  38           2HB      LYS  38   0.563  -5.076  -8.697
  323    HB3  LYS  38           3HB      LYS  38  -0.931  -4.283  -9.202
  324    HG2  LYS  38           2HG      LYS  38   0.146  -2.063  -8.757
  325    HG3  LYS  38           3HG      LYS  38   1.643  -2.912  -8.371
  326    HD2  LYS  38           2HD      LYS  38   1.786  -2.079 -10.640
  327    HD3  LYS  38           3HD      LYS  38   1.670  -3.839 -10.699
  328    HE2  LYS  38           2HE      LYS  38  -0.719  -3.675 -11.282
  329    HE3  LYS  38           3HE      LYS  38  -0.645  -1.915 -11.151
  330    HZ1  LYS  38           3HZ      LYS  38  -0.501  -2.627 -13.444
  331    HZ2  LYS  38           1HZ      LYS  38   0.871  -3.563 -13.113
  332    HZ3  LYS  38           2HZ      LYS  38   0.938  -1.882 -12.974
  333    H    LYS  39           H        LYS  39   0.223  -6.583  -6.725
  334    HA   LYS  39           HA       LYS  39  -2.273  -7.897  -7.024
  335    HB2  LYS  39           2HB      LYS  39   0.261  -8.989  -5.739
  336    HB3  LYS  39           3HB      LYS  39  -1.114  -9.954  -6.265
  337    HG2  LYS  39           2HG      LYS  39   0.795  -8.375  -8.001
  338    HG3  LYS  39           3HG      LYS  39   0.643 -10.128  -7.916
  339    HD2  LYS  39           2HD      LYS  39  -1.626  -9.970  -8.937
  340    HD3  LYS  39           3HD      LYS  39  -1.469  -8.210  -8.997
  341    HE2  LYS  39           2HE      LYS  39   0.524  -8.486 -10.486
  342    HE3  LYS  39           3HE      LYS  39   0.233 -10.228 -10.504
  343    HZ1  LYS  39           3HZ      LYS  39  -1.656  -8.147 -11.456
  344    HZ2  LYS  39           1HZ      LYS  39  -1.937  -9.814 -11.485
  345    HZ3  LYS  39           2HZ      LYS  39  -0.717  -9.143 -12.442
  346    H    VAL  40           H        VAL  40  -0.377  -7.098  -4.084
  347    HA   VAL  40           HA       VAL  40  -1.982  -8.267  -2.130
  348    HB   VAL  40           HB       VAL  40  -0.189  -5.790  -2.004
  349   HG11  VAL  40          1HG1      VAL  40  -1.573  -7.098   0.362
  350   HG12  VAL  40          2HG1      VAL  40  -1.874  -5.469  -0.249
  351   HG13  VAL  40          3HG1      VAL  40  -0.311  -5.866   0.467
  352   HG21  VAL  40          3HG2      VAL  40   0.969  -7.951  -2.319
  353   HG22  VAL  40          1HG2      VAL  40   0.186  -8.591  -0.875
  354   HG23  VAL  40          2HG2      VAL  40   1.343  -7.264  -0.736
  355    H    LEU  41           H        LEU  41  -2.266  -5.025  -3.591
  356    HA   LEU  41           HA       LEU  41  -4.428  -4.109  -2.007
  357    HB2  LEU  41           2HB      LEU  41  -3.276  -3.217  -4.663
  358    HB3  LEU  41           3HB      LEU  41  -4.726  -2.458  -4.026
  359    HG   LEU  41           HG       LEU  41  -2.042  -2.519  -2.578
  360   HD11  LEU  41          1HD1      LEU  41  -1.923  -1.134  -4.598
  361   HD12  LEU  41          2HD1      LEU  41  -1.858  -0.143  -3.142
  362   HD13  LEU  41          3HD1      LEU  41  -3.351  -0.231  -4.082
  363   HD21  LEU  41          3HD2      LEU  41  -4.609  -1.031  -1.914
  364   HD22  LEU  41          1HD2      LEU  41  -3.071  -0.878  -1.062
  365   HD23  LEU  41          2HD2      LEU  41  -3.940  -2.408  -1.029
  366    H    ASN  42           H        ASN  42  -4.364  -5.553  -5.299
  367    HA   ASN  42           HA       ASN  42  -7.117  -5.498  -5.848
  368    HB2  ASN  42           2HB      ASN  42  -5.049  -7.564  -6.752
  369    HB3  ASN  42           3HB      ASN  42  -6.645  -7.369  -7.470
  370   HD21  ASN  42          1HD2      ASN  42  -3.973  -7.139  -8.624
  371   HD22  ASN  42          2HD2      ASN  42  -3.900  -5.576  -9.351
  372    H    GLU  43           H        GLU  43  -5.178  -8.069  -4.341
  373    HA   GLU  43           HA       GLU  43  -7.229 -10.008  -4.062
  374    HB2  GLU  43           2HB      GLU  43  -4.541  -9.716  -2.642
  375    HB3  GLU  43           3HB      GLU  43  -5.573 -11.138  -2.513
  376    HG2  GLU  43           2HG      GLU  43  -5.342 -11.519  -4.945
  377    HG3  GLU  43           3HG      GLU  43  -4.296 -10.110  -5.070
  378    H    ARG  44           H        ARG  44  -5.869  -7.604  -1.800
  379    HA   ARG  44           HA       ARG  44  -7.438  -8.298   0.435
  380    HB2  ARG  44           2HB      ARG  44  -5.401  -6.869   0.607
  381    HB3  ARG  44           3HB      ARG  44  -6.220  -5.588  -0.275
  382    HG2  ARG  44           2HG      ARG  44  -6.223  -4.990   2.051
  383    HG3  ARG  44           3HG      ARG  44  -7.876  -5.409   1.613
  384    HD2  ARG  44           2HD      ARG  44  -5.932  -7.213   3.107
  385    HD3  ARG  44           3HD      ARG  44  -7.224  -6.271   3.844
  386    HE   ARG  44           HE       ARG  44  -8.800  -7.662   2.472
  387   HH11  ARG  44          1HH1      ARG  44  -5.670  -8.992   3.426
  388   HH12  ARG  44          2HH1      ARG  44  -6.209 -10.634   3.326
  389   HH21  ARG  44          1HH2      ARG  44  -9.448  -9.816   2.265
  390   HH22  ARG  44          2HH2      ARG  44  -8.350 -11.101   2.670
  391    H    MET  45           H        MET  45  -8.011  -6.126  -2.287
  392    HA   MET  45           HA       MET  45 -10.468  -5.079  -1.094
  393    HB2  MET  45           2HB      MET  45  -8.924  -4.241  -3.562
  394    HB3  MET  45           3HB      MET  45 -10.442  -3.509  -3.073
  395    HG2  MET  45           2HG      MET  45  -9.244  -3.052  -0.807
  396    HG3  MET  45           3HG      MET  45  -7.764  -3.359  -1.716
  397    HE1  MET  45           3HE      MET  45 -11.116  -1.641  -3.047
  398    HE2  MET  45           1HE      MET  45 -10.721   0.045  -2.735
  399    HE3  MET  45           2HE      MET  45 -10.961  -1.064  -1.386
  400    H    ASP  46           H        ASP  46  -9.760  -7.648  -3.146
  401    HA   ASP  46           HA       ASP  46 -11.918  -7.433  -4.983
  402    HB2  ASP  46           2HB      ASP  46  -9.890  -8.889  -5.349
  403    HB3  ASP  46           3HB      ASP  46 -10.522 -10.018  -4.154
  404    HA   PRO  47           HA       PRO  47 -14.582  -9.975  -1.774
  405    HB2  PRO  47           2HB      PRO  47 -13.746 -10.038   0.845
  406    HB3  PRO  47           3HB      PRO  47 -13.300 -11.290  -0.337
  407    HG2  PRO  47           2HG      PRO  47 -11.695  -8.902   0.550
  408    HG3  PRO  47           3HG      PRO  47 -11.184 -10.602   0.402
  409    HD2  PRO  47           2HD      PRO  47 -10.621  -8.813  -1.525
  410    HD3  PRO  47           3HD      PRO  47 -11.030 -10.494  -1.929
  411    H    ILE  48           H        ILE  48 -12.822  -7.030  -0.986
  412    HA   ILE  48           HA       ILE  48 -14.713  -5.815   0.777
  413    HB   ILE  48           HB       ILE  48 -12.562  -4.604  -1.004
  414   HG12  ILE  48          2HG1      ILE  48 -11.680  -6.098   0.753
  415   HG13  ILE  48          3HG1      ILE  48 -11.200  -4.435   1.038
  416   HG21  ILE  48          1HG2      ILE  48 -12.694  -2.534   0.334
  417   HG22  ILE  48          2HG2      ILE  48 -14.110  -3.172   1.169
  418   HG23  ILE  48          3HG2      ILE  48 -14.184  -2.845  -0.561
  419   HD11  ILE  48          3HD1      ILE  48 -12.930  -4.264   2.787
  420   HD12  ILE  48          1HD1      ILE  48 -11.741  -5.528   3.099
  421   HD13  ILE  48          2HD1      ILE  48 -13.344  -5.958   2.508
  422    H    LYS  49           H        LYS  49 -14.357  -5.905  -2.748
  423    HA   LYS  49           HA       LYS  49 -16.274  -4.054  -3.608
  424    HB2  LYS  49           2HB      LYS  49 -15.793  -6.812  -4.827
  425    HB3  LYS  49           3HB      LYS  49 -16.450  -5.401  -5.653
  426    HG2  LYS  49           2HG      LYS  49 -14.279  -4.279  -5.514
  427    HG3  LYS  49           3HG      LYS  49 -13.619  -5.629  -4.587
  428    HD2  LYS  49           2HD      LYS  49 -14.019  -7.132  -6.537
  429    HD3  LYS  49           3HD      LYS  49 -14.624  -5.753  -7.458
  430    HE2  LYS  49           2HE      LYS  49 -12.430  -4.690  -7.386
  431    HE3  LYS  49           3HE      LYS  49 -11.810  -5.967  -6.334
  432    HZ1  LYS  49           3HZ      LYS  49 -12.776  -6.366  -9.121
  433    HZ2  LYS  49           1HZ      LYS  49 -12.119  -7.559  -8.115
  434    HZ3  LYS  49           2HZ      LYS  49 -11.154  -6.278  -8.650
  435    H    LYS  50           H        LYS  50 -16.565  -7.453  -2.754
  436    HA   LYS  50           HA       LYS  50 -19.333  -7.799  -3.218
  437    HB2  LYS  50           2HB      LYS  50 -17.762  -9.651  -3.302
  438    HB3  LYS  50           3HB      LYS  50 -17.297  -9.399  -1.623
  439    HG2  LYS  50           2HG      LYS  50 -19.494 -10.124  -0.858
  440    HG3  LYS  50           3HG      LYS  50 -20.069 -10.223  -2.522
  441    HD2  LYS  50           2HD      LYS  50 -19.552 -12.446  -1.590
  442    HD3  LYS  50           3HD      LYS  50 -18.540 -12.071  -2.986
  443    HE2  LYS  50           2HE      LYS  50 -16.691 -11.444  -1.410
  444    HE3  LYS  50           3HE      LYS  50 -17.718 -11.949  -0.062
  445    HZ1  LYS  50           3HZ      LYS  50 -16.798 -13.687  -2.289
  446    HZ2  LYS  50           1HZ      LYS  50 -17.799 -14.176  -1.018
  447    HZ3  LYS  50           2HZ      LYS  50 -16.207 -13.708  -0.707
  448    H    LEU  51           H        LEU  51 -17.494  -6.738  -0.392
  449    HA   LEU  51           HA       LEU  51 -19.643  -6.932   1.498
  450    HB2  LEU  51           2HB      LEU  51 -17.151  -5.175   1.580
  451    HB3  LEU  51           3HB      LEU  51 -18.229  -5.481   2.936
  452    HG   LEU  51           HG       LEU  51 -16.502  -7.569   1.552
  453   HD11  LEU  51          1HD1      LEU  51 -15.201  -7.586   3.622
  454   HD12  LEU  51          2HD1      LEU  51 -16.190  -6.275   4.268
  455   HD13  LEU  51          3HD1      LEU  51 -15.176  -6.003   2.850
  456   HD21  LEU  51          3HD2      LEU  51 -17.172  -9.087   3.368
  457   HD22  LEU  51          1HD2      LEU  51 -18.553  -8.591   2.390
  458   HD23  LEU  51          2HD2      LEU  51 -18.297  -7.870   3.980
  459    H    GLY  52           H        GLY  52 -18.538  -4.463  -0.782
  460    HA2  GLY  52           2HA      GLY  52 -19.777  -2.849  -1.844
  461    HA3  GLY  52           3HA      GLY  52 -21.193  -3.387  -0.956
  462    H    CYS  53           H        CYS  53 -18.359  -1.296  -0.851
  463    HA   CYS  53           HA       CYS  53 -19.705   0.445   1.121
  464    HB2  CYS  53           2HB      CYS  53 -17.215   0.896   1.926
  465    HB3  CYS  53           3HB      CYS  53 -18.112  -0.488   2.535
  466    H    LYS  54           H        LYS  54 -19.705   2.536   0.702
  467    HA   LYS  54           HA       LYS  54 -19.021   3.509  -1.904
  468    HB2  LYS  54           2HB      LYS  54 -20.037   5.038   0.542
  469    HB3  LYS  54           3HB      LYS  54 -19.967   5.673  -1.098
  470    HG2  LYS  54           2HG      LYS  54 -21.684   3.342  -0.189
  471    HG3  LYS  54           3HG      LYS  54 -22.247   4.994  -0.451
  472    HD2  LYS  54           2HD      LYS  54 -21.637   4.808  -2.858
  473    HD3  LYS  54           3HD      LYS  54 -21.097   3.147  -2.587
  474    HE2  LYS  54           2HE      LYS  54 -23.330   3.128  -3.553
  475    HE3  LYS  54           3HE      LYS  54 -23.419   2.540  -1.895
  476    HZ1  LYS  54           3HZ      LYS  54 -24.102   5.292  -2.788
  477    HZ2  LYS  54           1HZ      LYS  54 -24.224   4.709  -1.209
  478    HZ3  LYS  54           2HZ      LYS  54 -25.215   4.075  -2.423
  479    H    ARG  55           H        ARG  55 -17.688   3.927   1.364
  480    HA   ARG  55           HA       ARG  55 -15.260   5.097   0.130
  481    HB2  ARG  55           2HB      ARG  55 -16.445   6.872   1.405
  482    HB3  ARG  55           3HB      ARG  55 -16.396   5.877   2.859
  483    HG2  ARG  55           2HG      ARG  55 -13.890   5.954   2.796
  484    HG3  ARG  55           3HG      ARG  55 -13.975   6.997   1.376
  485    HD2  ARG  55           2HD      ARG  55 -15.067   7.671   4.128
  486    HD3  ARG  55           3HD      ARG  55 -13.552   8.273   3.459
  487    HE   ARG  55           HE       ARG  55 -15.115   9.217   1.620
  488   HH11  ARG  55          1HH1      ARG  55 -15.958   9.010   5.024
  489   HH12  ARG  55          2HH1      ARG  55 -17.018  10.385   4.971
  490   HH21  ARG  55          1HH2      ARG  55 -16.428  11.063   1.568
  491   HH22  ARG  55          2HH2      ARG  55 -17.286  11.561   2.995
  492    H    VAL  56           H        VAL  56 -13.502   4.016   0.538
  493    HA   VAL  56           HA       VAL  56 -13.226   2.277   2.904
  494    HB   VAL  56           HB       VAL  56 -11.575   0.940   1.580
  495   HG11  VAL  56          1HG1      VAL  56 -14.323   1.075   0.293
  496   HG12  VAL  56          2HG1      VAL  56 -13.888   0.152   1.734
  497   HG13  VAL  56          3HG1      VAL  56 -13.190  -0.278   0.172
  498   HG21  VAL  56          3HG2      VAL  56 -11.438   1.167  -0.888
  499   HG22  VAL  56          1HG2      VAL  56 -10.875   2.628  -0.074
  500   HG23  VAL  56          2HG2      VAL  56 -12.473   2.594  -0.817
  501    H    ARG  57           H        ARG  57 -11.473   2.752   4.202
  502    HA   ARG  57           HA       ARG  57  -9.515   4.786   3.286
  503    HB2  ARG  57           2HB      ARG  57 -10.786   5.296   5.411
  504    HB3  ARG  57           3HB      ARG  57 -10.053   3.876   6.149
  505    HG2  ARG  57           2HG      ARG  57  -7.770   5.035   5.485
  506    HG3  ARG  57           3HG      ARG  57  -8.761   6.487   5.340
  507    HD2  ARG  57           2HD      ARG  57  -8.405   4.778   7.815
  508    HD3  ARG  57           3HD      ARG  57  -7.720   6.380   7.536
  509    HE   ARG  57           HE       ARG  57 -10.454   6.686   7.295
  510   HH11  ARG  57          1HH1      ARG  57  -8.255   5.627   9.849
  511   HH12  ARG  57          2HH1      ARG  57  -9.289   6.172  11.131
  512   HH21  ARG  57          1HH2      ARG  57 -11.803   7.378   8.991
  513   HH22  ARG  57          2HH2      ARG  57 -11.305   7.169  10.642
  514    H    ILE  58           H        ILE  58  -7.844   3.720   2.399
  515    HA   ILE  58           HA       ILE  58  -6.816   1.197   3.508
  516    HB   ILE  58           HB       ILE  58  -5.928   2.644   0.960
  517   HG12  ILE  58          2HG1      ILE  58  -7.947   0.360   1.126
  518   HG13  ILE  58          3HG1      ILE  58  -8.389   2.047   0.893
  519   HG21  ILE  58          1HG2      ILE  58  -5.555  -0.249   1.830
  520   HG22  ILE  58          2HG2      ILE  58  -4.304   0.995   1.833
  521   HG23  ILE  58          3HG2      ILE  58  -5.000   0.448   0.306
  522   HD11  ILE  58          3HD1      ILE  58  -7.137   2.074  -1.215
  523   HD12  ILE  58          1HD1      ILE  58  -8.426   0.876  -1.197
  524   HD13  ILE  58          2HD1      ILE  58  -6.751   0.362  -0.999
  525    H    SER  59           H        SER  59  -5.461   1.657   5.174
  526    HA   SER  59           HA       SER  59  -3.565   3.910   5.025
  527    HB2  SER  59           2HB      SER  59  -5.169   3.846   6.966
  528    HB3  SER  59           3HB      SER  59  -4.501   2.285   7.446
  529    HG   SER  59           HG       SER  59  -3.358   4.849   7.568
  530    H    ILE  60           H        ILE  60  -1.779   3.137   4.038
  531    HA   ILE  60           HA       ILE  60  -0.783   0.411   4.587
  532    HB   ILE  60           HB       ILE  60  -0.189   2.375   2.330
  533   HG12  ILE  60          2HG1      ILE  60  -1.600  -0.330   2.346
  534   HG13  ILE  60          3HG1      ILE  60  -2.370   1.241   2.149
  535   HG21  ILE  60          1HG2      ILE  60   1.052  -0.367   2.747
  536   HG22  ILE  60          2HG2      ILE  60   1.892   1.180   2.852
  537   HG23  ILE  60          3HG2      ILE  60   1.243   0.633   1.306
  538   HD11  ILE  60          3HD1      ILE  60  -1.149   1.541   0.032
  539   HD12  ILE  60          1HD1      ILE  60  -2.210   0.137   0.037
  540   HD13  ILE  60          2HD1      ILE  60  -0.470  -0.079   0.216
  541    H    ARG  61           H        ARG  61   0.844   0.228   6.007
  542    HA   ARG  61           HA       ARG  61   2.651   2.515   6.528
  543    HB2  ARG  61           2HB      ARG  61   2.361  -0.074   8.111
  544    HB3  ARG  61           3HB      ARG  61   3.281   1.356   8.580
  545    HG2  ARG  61           2HG      ARG  61   1.072   2.634   8.584
  546    HG3  ARG  61           3HG      ARG  61   0.264   1.074   8.400
  547    HD2  ARG  61           2HD      ARG  61   0.321   1.790  10.755
  548    HD3  ARG  61           3HD      ARG  61   1.255   0.306  10.520
  549    HE   ARG  61           HE       ARG  61   2.802   2.755  10.354
  550   HH11  ARG  61          1HH1      ARG  61   1.643   0.278  12.564
  551   HH12  ARG  61          2HH1      ARG  61   2.890   0.575  13.729
  552   HH21  ARG  61          1HH2      ARG  61   4.460   3.076  11.851
  553   HH22  ARG  61          2HH2      ARG  61   4.485   2.158  13.328
  554    H    VAL  62           H        VAL  62   4.744   2.428   5.910
  555    HA   VAL  62           HA       VAL  62   5.828  -0.024   4.695
  556    HB   VAL  62           HB       VAL  62   5.999   2.209   3.454
  557   HG11  VAL  62          1HG1      VAL  62   7.710   3.843   4.085
  558   HG12  VAL  62          2HG1      VAL  62   8.062   2.917   5.549
  559   HG13  VAL  62          3HG1      VAL  62   6.489   3.693   5.357
  560   HG21  VAL  62          3HG2      VAL  62   7.467   0.348   2.862
  561   HG22  VAL  62          1HG2      VAL  62   8.638   0.855   4.077
  562   HG23  VAL  62          2HG2      VAL  62   8.317   1.884   2.676
  563    H    LYS  63           H        LYS  63   6.998  -1.339   6.039
  564    HA   LYS  63           HA       LYS  63   7.832  -0.352   8.675
  565    HB2  LYS  63           2HB      LYS  63   6.541  -2.405   8.622
  566    HB3  LYS  63           3HB      LYS  63   7.654  -3.131   7.485
  567    HG2  LYS  63           2HG      LYS  63   8.062  -4.116   9.624
  568    HG3  LYS  63           3HG      LYS  63   9.431  -3.064   9.256
  569    HD2  LYS  63           2HD      LYS  63   8.595  -1.352  10.771
  570    HD3  LYS  63           3HD      LYS  63   7.099  -2.255  11.035
  571    HE2  LYS  63           2HE      LYS  63   9.880  -3.182  11.837
  572    HE3  LYS  63           3HE      LYS  63   8.669  -2.501  12.923
  573    HZ1  LYS  63           3HZ      LYS  63   8.693  -4.903  13.045
  574    HZ2  LYS  63           1HZ      LYS  63   8.392  -5.034  11.388
  575    HZ3  LYS  63           2HZ      LYS  63   7.217  -4.375  12.411
  576    H    HIS  64           H        HIS  64   9.753   0.533   8.724
  577    HA   HIS  64           HA       HIS  64  12.012  -0.552   7.167
  578    HB2  HIS  64           2HB      HIS  64  13.011   1.758   7.531
  579    HB3  HIS  64           3HB      HIS  64  11.578   1.723   6.508
  580    HD1  HIS  64           HD1      HIS  64  12.767   2.876   9.887
  581    HD2  HIS  64           HD2      HIS  64   9.362   3.144   7.512
  582    HE1  HIS  64           HE1      HIS  64  11.304   4.589  10.987
  583    HE2  HIS  64           HE2      HIS  64   9.330   4.832   9.457
  584    H    SER  65           H        SER  65  13.150  -1.876   8.427
  585    HA   SER  65           HA       SER  65  13.241  -1.780  11.285
  586    HB2  SER  65           2HB      SER  65  13.531  -3.894   9.984
  587    HB3  SER  65           3HB      SER  65  15.073  -3.295   9.369
  588    HG   SER  65           HG       SER  65  15.935  -3.427  11.384
  589    H    ASP  66           H        ASP  66  15.213  -0.498   8.714
  590    HA   ASP  66           HA       ASP  66  17.370   0.448  10.429
  591    HB2  ASP  66           2HB      ASP  66  17.987  -0.324   8.212
  592    HB3  ASP  66           3HB      ASP  66  16.779   0.700   7.445
  593    H    ALA  67           H        ALA  67  17.917   2.728  10.590
  594    HA   ALA  67           HA       ALA  67  15.573   4.550  10.578
  595    HB1  ALA  67           3HB      ALA  67  16.511   5.586  12.596
  596    HB2  ALA  67           1HB      ALA  67  17.887   4.477  12.547
  597    HB3  ALA  67           2HB      ALA  67  16.260   3.858  12.837
  598    H    ALA  68           H        ALA  68  18.591   4.058   9.137
  599    HA   ALA  68           HA       ALA  68  19.466   6.842   9.045
  600    HB1  ALA  68           3HB      ALA  68  20.634   4.366   7.734
  601    HB2  ALA  68           1HB      ALA  68  21.123   5.040   9.288
  602    HB3  ALA  68           2HB      ALA  68  21.401   5.958   7.806
  603    H    GLU  69           H        GLU  69  18.948   4.402   6.494
  604    HA   GLU  69           HA       GLU  69  18.778   6.355   4.402
  605    HB2  GLU  69           2HB      GLU  69  18.507   3.330   4.481
  606    HB3  GLU  69           3HB      GLU  69  18.306   4.236   2.986
  607    HG2  GLU  69           2HG      GLU  69  20.819   4.417   4.667
  608    HG3  GLU  69           3HG      GLU  69  20.595   3.191   3.425
  609    H    GLU  70           H        GLU  70  16.428   4.992   6.489
  610    HA   GLU  70           HA       GLU  70  14.321   4.443   4.735
  611    HB2  GLU  70           2HB      GLU  70  12.847   4.566   6.770
  612    HB3  GLU  70           3HB      GLU  70  14.248   3.519   6.912
  613    HG2  GLU  70           2HG      GLU  70  14.039   4.596   8.989
  614    HG3  GLU  70           3HG      GLU  70  15.396   5.367   8.181
  615    H    LYS  71           H        LYS  71  15.296   7.547   6.011
  616    HA   LYS  71           HA       LYS  71  13.000   9.045   5.321
  617    HB2  LYS  71           2HB      LYS  71  14.559  11.010   5.447
  618    HB3  LYS  71           3HB      LYS  71  14.611   9.950   6.850
  619    HG2  LYS  71           2HG      LYS  71  16.697   8.886   5.882
  620    HG3  LYS  71           3HG      LYS  71  16.692  10.153   4.647
  621    HD2  LYS  71           2HD      LYS  71  16.856  11.882   6.415
  622    HD3  LYS  71           3HD      LYS  71  16.821  10.629   7.656
  623    HE2  LYS  71           2HE      LYS  71  19.106  11.361   7.353
  624    HE3  LYS  71           3HE      LYS  71  18.962   9.720   6.724
  625    HZ1  LYS  71           3HZ      LYS  71  18.874  12.171   5.052
  626    HZ2  LYS  71           1HZ      LYS  71  18.904  10.573   4.504
  627    HZ3  LYS  71           2HZ      LYS  71  20.250  11.219   5.289
  628    H    LYS  72           H        LYS  72  15.891   8.153   3.484
  629    HA   LYS  72           HA       LYS  72  15.214   9.452   1.027
  630    HB2  LYS  72           2HB      LYS  72  17.521   8.724   1.621
  631    HB3  LYS  72           3HB      LYS  72  17.001   7.042   1.592
  632    HG2  LYS  72           2HG      LYS  72  16.477   7.314  -0.866
  633    HG3  LYS  72           3HG      LYS  72  17.174   8.936  -0.783
  634    HD2  LYS  72           2HD      LYS  72  18.629   6.327  -0.199
  635    HD3  LYS  72           3HD      LYS  72  18.825   7.318  -1.644
  636    HE2  LYS  72           2HE      LYS  72  19.817   9.114  -0.337
  637    HE3  LYS  72           3HE      LYS  72  19.482   8.258   1.171
  638    HZ1  LYS  72           3HZ      LYS  72  21.051   6.598   0.622
  639    HZ2  LYS  72           1HZ      LYS  72  21.802   8.088   0.351
  640    HZ3  LYS  72           2HZ      LYS  72  21.245   7.172  -0.956
  641    H    GLU  73           H        GLU  73  14.779   6.207   2.386
  642    HA   GLU  73           HA       GLU  73  13.679   4.988   0.080
  643    HB2  GLU  73           2HB      GLU  73  13.379   4.047   2.967
  644    HB3  GLU  73           3HB      GLU  73  13.168   3.078   1.515
  645    HG2  GLU  73           2HG      GLU  73  15.755   4.219   2.590
  646    HG3  GLU  73           3HG      GLU  73  15.283   2.526   2.521
  647    H    ALA  74           H        ALA  74  12.257   6.994   2.506
  648    HA   ALA  74           HA       ALA  74   9.538   6.209   2.252
  649    HB1  ALA  74           3HB      ALA  74  10.722   8.922   2.930
  650    HB2  ALA  74           1HB      ALA  74  10.368   7.628   4.077
  651    HB3  ALA  74           2HB      ALA  74   9.051   8.420   3.211
  652    H    LYS  75           H        LYS  75  11.344   8.907   0.786
  653    HA   LYS  75           HA       LYS  75   9.423   9.752  -1.097
  654    HB2  LYS  75           2HB      LYS  75  12.463   9.985  -1.165
  655    HB3  LYS  75           3HB      LYS  75  11.352  10.940  -2.145
  656    HG2  LYS  75           2HG      LYS  75  10.524  12.130  -0.235
  657    HG3  LYS  75           3HG      LYS  75  11.278  10.995   0.890
  658    HD2  LYS  75           2HD      LYS  75  12.535  13.120   0.800
  659    HD3  LYS  75           3HD      LYS  75  13.516  11.776   0.223
  660    HE2  LYS  75           2HE      LYS  75  12.969  12.486  -2.135
  661    HE3  LYS  75           3HE      LYS  75  12.149  13.900  -1.467
  662    HZ1  LYS  75           3HZ      LYS  75  15.025  13.239  -1.057
  663    HZ2  LYS  75           1HZ      LYS  75  14.225  14.610  -0.475
  664    HZ3  LYS  75           2HZ      LYS  75  14.430  14.395  -2.136
  665    H    LYS  76           H        LYS  76  12.077   7.478  -1.293
  666    HA   LYS  76           HA       LYS  76  12.114   6.933  -4.064
  667    HB2  LYS  76           2HB      LYS  76  14.027   6.594  -2.625
  668    HB3  LYS  76           3HB      LYS  76  13.140   5.478  -1.601
  669    HG2  LYS  76           2HG      LYS  76  13.206   3.756  -3.288
  670    HG3  LYS  76           3HG      LYS  76  13.860   4.885  -4.485
  671    HD2  LYS  76           2HD      LYS  76  15.954   5.086  -3.285
  672    HD3  LYS  76           3HD      LYS  76  15.302   4.231  -1.884
  673    HE2  LYS  76           2HE      LYS  76  15.678   2.948  -4.604
  674    HE3  LYS  76           3HE      LYS  76  16.868   2.872  -3.300
  675    HZ1  LYS  76           3HZ      LYS  76  14.073   1.932  -3.051
  676    HZ2  LYS  76           1HZ      LYS  76  15.310   1.746  -1.917
  677    HZ3  LYS  76           2HZ      LYS  76  15.390   0.935  -3.400
  678    H    PHE  77           H        PHE  77  10.577   5.286  -1.324
  679    HA   PHE  77           HA       PHE  77   9.279   3.258  -2.921
  680    HB2  PHE  77           2HB      PHE  77   9.982   2.967  -0.484
  681    HB3  PHE  77           3HB      PHE  77   8.652   4.023  -0.029
  682    HD1  PHE  77           HD1      PHE  77   9.382   0.864  -1.909
  683    HD2  PHE  77           HD2      PHE  77   6.531   3.036   0.438
  684    HE1  PHE  77           HE1      PHE  77   7.894  -1.092  -1.875
  685    HE2  PHE  77           HE2      PHE  77   5.057   1.065   0.468
  686    HZ   PHE  77           HZ       PHE  77   5.734  -1.000  -0.692
  687    H    ALA  78           H        ALA  78   8.553   6.474  -1.894
  688    HA   ALA  78           HA       ALA  78   5.730   6.485  -2.129
  689    HB1  ALA  78           3HB      ALA  78   6.956   8.327  -1.088
  690    HB2  ALA  78           1HB      ALA  78   5.913   8.916  -2.381
  691    HB3  ALA  78           2HB      ALA  78   7.653   8.770  -2.649
  692    H    ALA  79           H        ALA  79   8.315   7.063  -4.520
  693    HA   ALA  79           HA       ALA  79   6.709   7.617  -6.771
  694    HB1  ALA  79           3HB      ALA  79   9.122   8.066  -6.700
  695    HB2  ALA  79           1HB      ALA  79   8.719   7.059  -8.090
  696    HB3  ALA  79           2HB      ALA  79   9.459   6.334  -6.658
  697    H    ILE  80           H        ILE  80   7.815   4.586  -5.360
  698    HA   ILE  80           HA       ILE  80   6.881   2.762  -7.304
  699    HB   ILE  80           HB       ILE  80   7.310   2.414  -4.303
  700   HG12  ILE  80          2HG1      ILE  80   9.365   3.100  -5.445
  701   HG13  ILE  80          3HG1      ILE  80   9.506   1.414  -4.965
  702   HG21  ILE  80          1HG2      ILE  80   7.486  -0.012  -4.705
  703   HG22  ILE  80          2HG2      ILE  80   7.025   0.235  -6.388
  704   HG23  ILE  80          3HG2      ILE  80   5.878   0.601  -5.104
  705   HD11  ILE  80          3HD1      ILE  80   9.016   0.735  -7.289
  706   HD12  ILE  80          1HD1      ILE  80  10.447   1.755  -7.153
  707   HD13  ILE  80          2HD1      ILE  80   8.938   2.438  -7.751
  708    H    LEU  81           H        LEU  81   5.366   4.119  -4.363
  709    HA   LEU  81           HA       LEU  81   2.960   2.630  -4.447
  710    HB2  LEU  81           2HB      LEU  81   3.768   5.200  -3.059
  711    HB3  LEU  81           3HB      LEU  81   2.118   4.610  -2.946
  712    HG   LEU  81           HG       LEU  81   4.567   3.047  -2.017
  713   HD11  LEU  81          1HD1      LEU  81   3.841   3.566   0.253
  714   HD12  LEU  81          2HD1      LEU  81   2.517   4.556  -0.371
  715   HD13  LEU  81          3HD1      LEU  81   4.192   5.043  -0.643
  716   HD21  LEU  81          3HD2      LEU  81   1.605   2.472  -1.629
  717   HD22  LEU  81          1HD2      LEU  81   2.944   1.555  -0.931
  718   HD23  LEU  81          2HD2      LEU  81   2.710   1.577  -2.677
  719    H    ASN  82           H        ASN  82   3.779   5.893  -5.654
  720    HA   ASN  82           HA       ASN  82   1.135   6.691  -6.316
  721    HB2  ASN  82           2HB      ASN  82   3.839   7.773  -7.217
  722    HB3  ASN  82           3HB      ASN  82   2.330   8.452  -7.824
  723   HD21  ASN  82          1HD2      ASN  82   4.568   8.516  -5.272
  724   HD22  ASN  82          2HD2      ASN  82   3.679   9.549  -4.212
  725    H    LYS  83           H        LYS  83   3.609   4.993  -8.187
  726    HA   LYS  83           HA       LYS  83   2.184   5.045 -10.672
  727    HB2  LYS  83           2HB      LYS  83   4.451   3.276  -9.692
  728    HB3  LYS  83           3HB      LYS  83   3.793   3.182 -11.319
  729    HG2  LYS  83           2HG      LYS  83   5.184   5.586 -10.089
  730    HG3  LYS  83           3HG      LYS  83   5.868   4.485 -11.280
  731    HD2  LYS  83           2HD      LYS  83   3.546   6.405 -11.715
  732    HD3  LYS  83           3HD      LYS  83   5.185   6.578 -12.340
  733    HE2  LYS  83           2HE      LYS  83   3.218   4.392 -13.111
  734    HE3  LYS  83           3HE      LYS  83   3.648   5.792 -14.088
  735    HZ1  LYS  83           3HZ      LYS  83   5.454   3.572 -13.300
  736    HZ2  LYS  83           1HZ      LYS  83   5.944   4.952 -14.146
  737    HZ3  LYS  83           2HZ      LYS  83   4.844   3.878 -14.842
  738    H    VAL  84           H        VAL  84   2.247   2.791  -7.930
  739    HA   VAL  84           HA       VAL  84   0.839   0.620  -9.147
  740    HB   VAL  84           HB       VAL  84   1.360   1.412  -6.240
  741   HG11  VAL  84          1HG1      VAL  84   0.530  -0.824  -5.541
  742   HG12  VAL  84          2HG1      VAL  84  -0.053  -1.109  -7.181
  743   HG13  VAL  84          3HG1      VAL  84  -0.756   0.183  -6.209
  744   HG21  VAL  84          3HG2      VAL  84   2.467  -0.847  -7.948
  745   HG22  VAL  84          1HG2      VAL  84   2.906  -0.519  -6.269
  746   HG23  VAL  84          2HG2      VAL  84   3.313   0.643  -7.532
  747    H    PHE  85           H        PHE  85  -0.156   3.155  -6.866
  748    HA   PHE  85           HA       PHE  85  -2.901   2.737  -6.788
  749    HB2  PHE  85           2HB      PHE  85  -1.284   5.293  -6.423
  750    HB3  PHE  85           3HB      PHE  85  -3.014   5.218  -6.118
  751    HD1  PHE  85           HD1      PHE  85  -3.497   2.778  -4.673
  752    HD2  PHE  85           HD2      PHE  85  -0.127   5.400  -4.370
  753    HE1  PHE  85           HE1      PHE  85  -3.093   2.010  -2.369
  754    HE2  PHE  85           HE2      PHE  85   0.272   4.619  -2.076
  755    HZ   PHE  85           HZ       PHE  85  -1.208   2.931  -1.075
  756    H    ALA  86           H        ALA  86  -0.991   4.712  -9.033
  757    HA   ALA  86           HA       ALA  86  -3.042   5.944 -10.496
  758    HB1  ALA  86           3HB      ALA  86  -1.337   6.339 -12.217
  759    HB2  ALA  86           1HB      ALA  86  -0.278   5.136 -11.461
  760    HB3  ALA  86           2HB      ALA  86  -0.680   6.624 -10.607
  761    H    GLU  87           H        GLU  87  -1.691   2.701 -10.759
  762    HA   GLU  87           HA       GLU  87  -2.890   2.185 -13.371
  763    HB2  GLU  87           2HB      GLU  87  -1.121   0.501 -11.557
  764    HB3  GLU  87           3HB      GLU  87  -1.782  -0.089 -13.080
  765    HG2  GLU  87           2HG      GLU  87  -0.627   1.842 -14.241
  766    HG3  GLU  87           3HG      GLU  87   0.150   2.217 -12.703
  767    H    LEU  88           H        LEU  88  -3.954   1.958 -10.146
  768    HA   LEU  88           HA       LEU  88  -5.625  -0.442 -10.688
  769    HB2  LEU  88           2HB      LEU  88  -4.688   0.663  -8.019
  770    HB3  LEU  88           3HB      LEU  88  -5.787  -0.695  -8.211
  771    HG   LEU  88           HG       LEU  88  -2.855  -0.610  -9.030
  772   HD11  LEU  88          1HD1      LEU  88  -3.208  -0.887  -6.632
  773   HD12  LEU  88          2HD1      LEU  88  -2.568  -2.358  -7.351
  774   HD13  LEU  88          3HD1      LEU  88  -4.276  -2.264  -6.923
  775   HD21  LEU  88          3HD2      LEU  88  -4.087  -1.901 -10.710
  776   HD22  LEU  88          1HD2      LEU  88  -4.827  -2.886  -9.444
  777   HD23  LEU  88          2HD2      LEU  88  -3.085  -2.960  -9.722
  778    H    GLY  89           H        GLY  89  -5.827   2.934 -10.319
  779    HA2  GLY  89           2HA      GLY  89  -7.991   3.808 -11.117
  780    HA3  GLY  89           3HA      GLY  89  -8.788   2.724  -9.990
  781    H    TYR  90           H        TYR  90  -5.972   4.168  -8.724
  782    HA   TYR  90           HA       TYR  90  -7.510   6.261  -7.287
  783    HB2  TYR  90           2HB      TYR  90  -4.755   5.215  -6.495
  784    HB3  TYR  90           3HB      TYR  90  -5.895   6.105  -5.502
  785    HD1  TYR  90           HD1      TYR  90  -5.044   2.793  -6.898
  786    HD2  TYR  90           HD2      TYR  90  -7.721   4.923  -4.327
  787    HE1  TYR  90           HE1      TYR  90  -5.824   0.667  -5.960
  788    HE2  TYR  90           HE2      TYR  90  -8.502   2.786  -3.394
  789    HH   TYR  90           HH       TYR  90  -8.588   0.443  -3.985
  790    H    ASN  91           H        ASN  91  -6.661   8.388  -7.283
  791    HA   ASN  91           HA       ASN  91  -4.651   9.071  -9.291
  792    HB2  ASN  91           2HB      ASN  91  -6.214  10.817  -7.332
  793    HB3  ASN  91           3HB      ASN  91  -5.120  11.440  -8.561
  794   HD21  ASN  91          1HD2      ASN  91  -5.925   9.574 -10.644
  795   HD22  ASN  91          2HD2      ASN  91  -7.518  10.033 -11.124
  796    H    ASP  92           H        ASP  92  -2.826  10.556  -8.647
  797    HA   ASP  92           HA       ASP  92  -1.470   9.642  -6.213
  798    HB2  ASP  92           2HB      ASP  92   0.513  10.732  -7.126
  799    HB3  ASP  92           3HB      ASP  92  -0.217   9.703  -8.349
  800    H    SER  93           H        SER  93  -3.812  11.231  -5.968
  801    HA   SER  93           HA       SER  93  -2.863  13.704  -4.632
  802    HB2  SER  93           2HB      SER  93  -5.225  14.478  -4.842
  803    HB3  SER  93           3HB      SER  93  -4.542  14.115  -6.428
  804    HG   SER  93           HG       SER  93  -6.734  13.110  -5.325
  805    H    ASN  94           H        ASN  94  -4.523  10.646  -4.438
  806    HA   ASN  94           HA       ASN  94  -5.533  10.899  -1.755
  807    HB2  ASN  94           2HB      ASN  94  -5.087   8.359  -3.385
  808    HB3  ASN  94           3HB      ASN  94  -6.151   8.545  -1.993
  809   HD21  ASN  94          1HD2      ASN  94  -8.102   9.787  -2.254
  810   HD22  ASN  94          2HD2      ASN  94  -8.777  10.022  -3.831
  811    H    VAL  95           H        VAL  95  -2.425  10.519  -2.966
  812    HA   VAL  95           HA       VAL  95  -1.459   8.592  -0.987
  813    HB   VAL  95           HB       VAL  95   0.112  10.044  -3.180
  814   HG11  VAL  95          1HG1      VAL  95   1.763   8.233  -2.924
  815   HG12  VAL  95          2HG1      VAL  95   0.782   7.493  -1.657
  816   HG13  VAL  95          3HG1      VAL  95   1.528   9.070  -1.386
  817   HG21  VAL  95          3HG2      VAL  95  -1.727   8.761  -4.201
  818   HG22  VAL  95          1HG2      VAL  95  -1.225   7.314  -3.321
  819   HG23  VAL  95          2HG2      VAL  95  -0.173   8.003  -4.561
  820    H    THR  96           H        THR  96  -1.407   9.593   0.990
  821    HA   THR  96           HA       THR  96   0.068  12.148   1.292
  822    HB   THR  96           HB       THR  96  -2.405  11.282   2.865
  823    HG1  THR  96           HG1      THR  96  -3.020  11.977   0.836
  824   HG21  THR  96          3HG2      THR  96  -0.880  12.649   4.262
  825   HG22  THR  96          1HG2      THR  96  -2.340  13.561   3.853
  826   HG23  THR  96          2HG2      THR  96  -0.826  13.889   3.010
  827    H    TRP  97           H        TRP  97   1.943  11.507   2.152
  828    HA   TRP  97           HA       TRP  97   2.228   9.323   4.010
  829    HB2  TRP  97           2HB      TRP  97   4.184  11.399   2.945
  830    HB3  TRP  97           3HB      TRP  97   4.637  10.214   4.166
  831    HD1  TRP  97           HD1      TRP  97   3.342  10.260   0.482
  832    HE1  TRP  97           HE1      TRP  97   4.282   8.169  -0.687
  833    HE3  TRP  97           HE3      TRP  97   5.614   8.021   4.491
  834    HZ2  TRP  97           HZ2      TRP  97   5.787   5.877  -0.006
  835    HZ3  TRP  97           HZ3      TRP  97   6.779   5.880   4.150
  836    HH2  TRP  97           HH2      TRP  97   6.864   4.827   1.943
  837    H    ASP  98           H        ASP  98   1.529   9.569   5.981
  838    HA   ASP  98           HA       ASP  98   2.150  11.967   7.603
  839    HB2  ASP  98           2HB      ASP  98  -0.284  11.307   7.523
  840    HB3  ASP  98           3HB      ASP  98   0.136   9.701   8.098
  841    H    GLY  99           H        GLY  99   4.255  11.457   8.138
  842    HA2  GLY  99           2HA      GLY  99   6.062  10.390   9.041
  843    HA3  GLY  99           3HA      GLY  99   4.933   9.374   9.929
  844    H    ASP 100           H        ASP 100   5.222   7.267   9.511
  845    HA   ASP 100           HA       ASP 100   6.518   6.333   7.039
  846    HB2  ASP 100           2HB      ASP 100   6.647   4.131   8.237
  847    HB3  ASP 100           3HB      ASP 100   7.383   5.437   9.156
  848    H    THR 101           H        THR 101   3.415   7.077   7.728
  849    HA   THR 101           HA       THR 101   2.198   4.631   6.566
  850    HB   THR 101           HB       THR 101   1.031   6.548   8.645
  851    HG1  THR 101           HG1      THR 101   2.775   4.773   9.127
  852   HG21  THR 101          3HG2      THR 101  -0.808   4.892   8.833
  853   HG22  THR 101          1HG2      THR 101  -0.112   3.967   7.506
  854   HG23  THR 101          2HG2      THR 101  -0.742   5.592   7.211
  855    H    VAL 102           H        VAL 102   1.373   5.066   4.582
  856    HA   VAL 102           HA       VAL 102   0.501   7.779   3.856
  857    HB   VAL 102           HB       VAL 102   1.938   6.673   2.205
  858   HG11  VAL 102          1HG1      VAL 102   1.505   4.316   2.695
  859   HG12  VAL 102          2HG1      VAL 102   1.278   4.640   0.975
  860   HG13  VAL 102          3HG1      VAL 102  -0.125   4.456   2.031
  861   HG21  VAL 102          3HG2      VAL 102  -0.920   6.840   1.198
  862   HG22  VAL 102          1HG2      VAL 102   0.531   6.897   0.190
  863   HG23  VAL 102          2HG2      VAL 102   0.209   8.188   1.351
  864    H    THR 103           H        THR 103  -1.634   8.312   3.860
  865    HA   THR 103           HA       THR 103  -3.688   6.234   4.310
  866    HB   THR 103           HB       THR 103  -3.856   9.244   4.839
  867    HG1  THR 103           HG1      THR 103  -2.392   8.125   6.255
  868   HG21  THR 103          3HG2      THR 103  -5.896   8.685   6.121
  869   HG22  THR 103          1HG2      THR 103  -5.727   6.991   5.677
  870   HG23  THR 103          2HG2      THR 103  -6.077   8.197   4.431
  871    H    VAL 104           H        VAL 104  -4.645   5.670   2.477
  872    HA   VAL 104           HA       VAL 104  -5.276   7.613   0.330
  873    HB   VAL 104           HB       VAL 104  -4.776   4.584   0.190
  874   HG11  VAL 104          1HG1      VAL 104  -5.496   6.473  -2.075
  875   HG12  VAL 104          2HG1      VAL 104  -6.524   5.196  -1.424
  876   HG13  VAL 104          3HG1      VAL 104  -5.027   4.781  -2.263
  877   HG21  VAL 104          3HG2      VAL 104  -2.811   5.182  -1.194
  878   HG22  VAL 104          1HG2      VAL 104  -2.690   5.861   0.431
  879   HG23  VAL 104          2HG2      VAL 104  -3.141   6.894  -0.929
  880    H    GLU 105           H        GLU 105  -7.390   8.138   0.465
  881    HA   GLU 105           HA       GLU 105  -9.385   6.067   1.212
  882    HB2  GLU 105           2HB      GLU 105 -10.772   7.765   2.269
  883    HB3  GLU 105           3HB      GLU 105  -9.184   7.762   3.015
  884    HG2  GLU 105           2HG      GLU 105 -10.231   9.815   1.037
  885    HG3  GLU 105           3HG      GLU 105 -10.046  10.037   2.774
  886    H    GLY 106           H        GLY 106 -11.315   6.081   0.093
  887    HA2  GLY 106           2HA      GLY 106 -12.304   7.660  -1.892
  888    HA3  GLY 106           3HA      GLY 106 -10.988   6.791  -2.685
  889    H    GLN 107           H        GLN 107 -12.371   5.597  -4.036
  890    HA   GLN 107           HA       GLN 107 -13.616   3.285  -2.715
  891    HB2  GLN 107           2HB      GLN 107 -15.681   3.414  -3.935
  892    HB3  GLN 107           3HB      GLN 107 -15.449   4.973  -3.166
  893    HG2  GLN 107           2HG      GLN 107 -14.935   4.370  -6.092
  894    HG3  GLN 107           3HG      GLN 107 -16.381   5.136  -5.448
  895   HE21  GLN 107          1HE2      GLN 107 -14.480   6.144  -7.411
  896   HE22  GLN 107          2HE2      GLN 107 -13.896   7.645  -6.789
  897    H    LEU 108           H        LEU 108 -14.079   1.562  -4.263
  898    HA   LEU 108           HA       LEU 108 -12.169   1.450  -6.497
  899    HB2  LEU 108           2HB      LEU 108 -12.374  -0.997  -6.431
  900    HB3  LEU 108           3HB      LEU 108 -11.828  -0.357  -4.906
  901    HG   LEU 108           HG       LEU 108 -13.247  -2.283  -4.508
  902   HD11  LEU 108          1HD1      LEU 108 -14.871  -1.495  -2.927
  903   HD12  LEU 108          2HD1      LEU 108 -14.865   0.113  -3.648
  904   HD13  LEU 108          3HD1      LEU 108 -13.421  -0.490  -2.836
  905   HD21  LEU 108          3HD2      LEU 108 -14.577  -2.324  -6.558
  906   HD22  LEU 108          1HD2      LEU 108 -15.525  -0.947  -5.995
  907   HD23  LEU 108          2HD2      LEU 108 -15.597  -2.485  -5.130
  908    H    GLU 109           H        GLU 109 -12.896   0.521  -8.534
  909    HA   GLU 109           HA       GLU 109 -15.753   0.929  -9.084
  910    HB2  GLU 109           2HB      GLU 109 -14.219   2.016 -10.659
  911    HB3  GLU 109           3HB      GLU 109 -13.453   0.472 -11.031
  912    HG2  GLU 109           2HG      GLU 109 -15.538  -0.374 -12.004
  913    HG3  GLU 109           3HG      GLU 109 -16.389   1.095 -11.528
  914    H    GLY 110           H        GLY 110 -16.980  -0.782  -8.744
  915    HA2  GLY 110           2HA      GLY 110 -16.247  -3.402  -9.891
  916    HA3  GLY 110           3HA      GLY 110 -16.740  -3.317  -8.199
  917    H    VAL 111           H        VAL 111 -17.803  -3.416 -11.445
  918    HA   VAL 111           HA       VAL 111 -20.475  -2.461 -11.038
  919    HB   VAL 111           HB       VAL 111 -21.016  -3.501 -13.222
  920   HG11  VAL 111          1HG1      VAL 111 -20.030  -1.257 -13.179
  921   HG12  VAL 111          2HG1      VAL 111 -19.510  -2.141 -14.613
  922   HG13  VAL 111          3HG1      VAL 111 -18.403  -1.948 -13.249
  923   HG21  VAL 111          3HG2      VAL 111 -19.292  -4.622 -14.578
  924   HG22  VAL 111          1HG2      VAL 111 -19.624  -5.533 -13.102
  925   HG23  VAL 111          2HG2      VAL 111 -18.160  -4.554 -13.224
  926    H    ASP 112           H        ASP 112 -18.872  -5.539 -10.710
  927    HA   ASP 112           HA       ASP 112 -21.359  -6.884  -9.836
  928    HB2  ASP 112           2HB      ASP 112 -19.799  -7.920 -11.622
  929    HB3  ASP 112           3HB      ASP 112 -18.635  -8.179 -10.332
  930    H    LEU 113           H        LEU 113 -21.604  -6.244  -7.742
  931    HA   LEU 113           HA       LEU 113 -19.432  -6.691  -5.782
  932    HB2  LEU 113           2HB      LEU 113 -22.239  -5.623  -5.230
  933    HB3  LEU 113           3HB      LEU 113 -20.856  -5.591  -4.150
  934    HG   LEU 113           HG       LEU 113 -21.275  -3.893  -6.643
  935   HD11  LEU 113          1HD1      LEU 113 -21.174  -1.995  -5.096
  936   HD12  LEU 113          2HD1      LEU 113 -20.990  -3.095  -3.726
  937   HD13  LEU 113          3HD1      LEU 113 -22.482  -3.099  -4.672
  938   HD21  LEU 113          3HD2      LEU 113 -19.108  -2.842  -6.221
  939   HD22  LEU 113          1HD2      LEU 113 -18.917  -4.558  -6.572
  940   HD23  LEU 113          2HD2      LEU 113 -18.783  -3.979  -4.910
  941    H    GLU 114           H        GLU 114 -22.934  -7.299  -5.850
  942    HA   GLU 114           HA       GLU 114 -22.628 -10.180  -6.031
  943    HB2  GLU 114           2HB      GLU 114 -23.813  -8.820  -3.576
  944    HB3  GLU 114           3HB      GLU 114 -24.543 -10.318  -4.138
  945    HG2  GLU 114           2HG      GLU 114 -22.351 -11.470  -3.890
  946    HG3  GLU 114           3HG      GLU 114 -21.658  -9.971  -3.261
  947    H    HIS 115           H        HIS 115 -24.174 -10.922  -7.410
  948    HA   HIS 115           HA       HIS 115 -26.437  -9.310  -8.238
  949    HB2  HIS 115           2HB      HIS 115 -25.784 -12.251  -8.769
  950    HB3  HIS 115           3HB      HIS 115 -27.119 -11.381  -9.511
  951    HD1  HIS 115           HD1      HIS 115 -26.630 -10.055 -11.585
  952    HD2  HIS 115           HD2      HIS 115 -23.174 -11.337  -9.667
  953    HE1  HIS 115           HE1      HIS 115 -24.757  -9.585 -13.177
  954    HE2  HIS 115           HE2      HIS 115 -22.674 -10.280 -11.958
  955    H    HIS 116           H        HIS 116 -28.709 -10.182  -7.993
  956    HA   HIS 116           HA       HIS 116 -29.214 -11.123  -5.258
  957    HB2  HIS 116           2HB      HIS 116 -30.450  -9.162  -6.359
  958    HB3  HIS 116           3HB      HIS 116 -31.266 -10.346  -7.372
  959    HD1  HIS 116           HD1      HIS 116 -33.384 -11.273  -6.439
  960    HD2  HIS 116           HD2      HIS 116 -31.010  -9.580  -3.489
  961    HE1  HIS 116           HE1      HIS 116 -34.751 -11.382  -4.342
  962    HE2  HIS 116           HE2      HIS 116 -33.350 -10.201  -2.613
  963    H    HIS 117           H        HIS 117 -27.990 -12.949  -7.072
  964    HA   HIS 117           HA       HIS 117 -29.798 -14.883  -8.107
  965    HB2  HIS 117           2HB      HIS 117 -27.597 -14.671  -9.115
  966    HB3  HIS 117           3HB      HIS 117 -26.779 -14.934  -7.578
  967    HD1  HIS 117           HD1      HIS 117 -28.810 -16.817 -10.186
  968    HD2  HIS 117           HD2      HIS 117 -26.224 -17.586  -7.033
  969    HE1  HIS 117           HE1      HIS 117 -28.348 -19.282 -10.275
  970    HE2  HIS 117           HE2      HIS 117 -26.692 -19.695  -8.434
  971    H    HIS 118           H        HIS 118 -28.377 -14.320  -4.951
  972    HA   HIS 118           HA       HIS 118 -28.431 -16.934  -3.932
  973    HB2  HIS 118           2HB      HIS 118 -27.219 -15.098  -2.785
  974    HB3  HIS 118           3HB      HIS 118 -28.752 -14.333  -2.371
  975    HD1  HIS 118           HD1      HIS 118 -26.454 -17.073  -1.330
  976    HD2  HIS 118           HD2      HIS 118 -30.219 -15.665  -0.288
  977    HE1  HIS 118           HE1      HIS 118 -27.067 -18.265   0.787
  978    HE2  HIS 118           HE2      HIS 118 -29.370 -17.444   1.364
  979    H    HIS 119           H        HIS 119 -30.290 -17.960  -4.459
  980    HA   HIS 119           HA       HIS 119 -32.620 -17.381  -2.705
  981    HB2  HIS 119           2HB      HIS 119 -32.548 -19.143  -5.220
  982    HB3  HIS 119           3HB      HIS 119 -33.967 -18.796  -4.228
  983    HD1  HIS 119           HD1      HIS 119 -31.805 -17.372  -6.889
  984    HD2  HIS 119           HD2      HIS 119 -35.038 -16.155  -4.582
  985    HE1  HIS 119           HE1      HIS 119 -32.598 -15.236  -7.926
  986    HE2  HIS 119           HE2      HIS 119 -34.535 -14.501  -6.501
  987    H    HIS 120           H        HIS 120 -30.421 -19.751  -4.057
  988    HA   HIS 120           HA       HIS 120 -30.354 -21.248  -1.516
  989    HB2  HIS 120           2HB      HIS 120 -31.578 -22.576  -3.253
  990    HB3  HIS 120           3HB      HIS 120 -30.192 -22.434  -4.332
  991    HD1  HIS 120           HD1      HIS 120 -27.965 -23.691  -3.506
  992    HD2  HIS 120           HD2      HIS 120 -31.453 -24.681  -1.469
  993    HE1  HIS 120           HE1      HIS 120 -27.451 -25.823  -2.283
  994    HE2  HIS 120           HE2      HIS 120 -29.542 -26.349  -0.988
  Start of MODEL   13
    1    H1   MET   1           1H       MET   1  23.560  -2.686  -2.446
    2    H2   MET   1           2H       MET   1  24.550  -2.624  -1.081
    3    H3   MET   1           3H       MET   1  23.246  -1.558  -1.229
    4    HA   MET   1           HA       MET   1  23.085  -4.493  -0.950
    5    HB2  MET   1           2HB      MET   1  22.360  -2.254   0.994
    6    HB3  MET   1           3HB      MET   1  22.025  -3.959   1.269
    7    HG2  MET   1           2HG      MET   1  24.805  -2.791   0.958
    8    HG3  MET   1           3HG      MET   1  24.018  -3.119   2.502
    9    HE1  MET   1           3HE      MET   1  23.549  -5.566   3.454
   10    HE2  MET   1           1HE      MET   1  23.795  -7.039   2.517
   11    HE3  MET   1           2HE      MET   1  22.533  -5.900   2.051
   12    H    SER   2           H        SER   2  21.779  -4.631  -2.815
   13    HA   SER   2           HA       SER   2  19.053  -3.516  -2.661
   14    HB2  SER   2           2HB      SER   2  18.891  -4.529  -5.027
   15    HB3  SER   2           3HB      SER   2  20.016  -3.186  -4.839
   16    HG   SER   2           HG       SER   2  20.739  -5.945  -4.810
   17    H    GLY   3           H        GLY   3  17.966  -4.733  -1.219
   18    HA2  GLY   3           2HA      GLY   3  16.915  -7.239  -1.683
   19    HA3  GLY   3           3HA      GLY   3  18.380  -7.522  -0.738
   20    H    LYS   4           H        LYS   4  15.389  -5.623  -0.794
   21    HA   LYS   4           HA       LYS   4  15.538  -5.219   2.125
   22    HB2  LYS   4           2HB      LYS   4  13.989  -3.733  -0.042
   23    HB3  LYS   4           3HB      LYS   4  13.804  -3.419   1.684
   24    HG2  LYS   4           2HG      LYS   4  16.175  -2.765   1.832
   25    HG3  LYS   4           3HG      LYS   4  16.377  -3.083   0.104
   26    HD2  LYS   4           2HD      LYS   4  14.885  -1.281  -0.488
   27    HD3  LYS   4           3HD      LYS   4  14.376  -1.067   1.192
   28    HE2  LYS   4           2HE      LYS   4  17.180  -0.555   0.140
   29    HE3  LYS   4           3HE      LYS   4  15.968   0.683   0.488
   30    HZ1  LYS   4           3HZ      LYS   4  17.560   0.362   2.312
   31    HZ2  LYS   4           1HZ      LYS   4  17.037  -1.230   2.486
   32    HZ3  LYS   4           2HZ      LYS   4  15.971   0.045   2.794
   33    H    LYS   5           H        LYS   5  14.236  -6.318   3.384
   34    HA   LYS   5           HA       LYS   5  11.700  -7.471   2.410
   35    HB2  LYS   5           2HB      LYS   5  13.331  -8.975   3.620
   36    HB3  LYS   5           3HB      LYS   5  13.205  -7.956   5.038
   37    HG2  LYS   5           2HG      LYS   5  10.742  -9.296   3.892
   38    HG3  LYS   5           3HG      LYS   5  11.849 -10.200   4.918
   39    HD2  LYS   5           2HD      LYS   5  10.332  -7.683   5.701
   40    HD3  LYS   5           3HD      LYS   5   9.971  -9.327   6.229
   41    HE2  LYS   5           2HE      LYS   5  12.075  -9.462   7.455
   42    HE3  LYS   5           3HE      LYS   5  12.590  -7.893   6.821
   43    HZ1  LYS   5           3HZ      LYS   5  10.229  -8.321   8.572
   44    HZ2  LYS   5           1HZ      LYS   5  10.797  -6.835   8.015
   45    HZ3  LYS   5           2HZ      LYS   5  11.727  -7.747   9.088
   46    H    VAL   6           H        VAL   6  10.233  -5.873   2.479
   47    HA   VAL   6           HA       VAL   6  10.052  -4.061   4.799
   48    HB   VAL   6           HB       VAL   6   9.967  -2.965   2.589
   49   HG11  VAL   6          1HG1      VAL   6   7.483  -4.616   2.021
   50   HG12  VAL   6          2HG1      VAL   6   9.050  -4.791   1.229
   51   HG13  VAL   6          3HG1      VAL   6   8.112  -3.312   1.008
   52   HG21  VAL   6          3HG2      VAL   6   7.899  -1.639   2.866
   53   HG22  VAL   6          1HG2      VAL   6   8.684  -1.929   4.421
   54   HG23  VAL   6          2HG2      VAL   6   7.256  -2.861   3.965
   55    H    GLU   7           H        GLU   7   8.285  -4.068   6.121
   56    HA   GLU   7           HA       GLU   7   6.247  -6.175   5.814
   57    HB2  GLU   7           2HB      GLU   7   6.985  -4.414   8.192
   58    HB3  GLU   7           3HB      GLU   7   5.670  -5.582   8.196
   59    HG2  GLU   7           2HG      GLU   7   7.197  -7.435   7.995
   60    HG3  GLU   7           3HG      GLU   7   8.551  -6.360   7.660
   61    H    VAL   8           H        VAL   8   4.630  -5.490   4.660
   62    HA   VAL   8           HA       VAL   8   3.715  -2.698   4.598
   63    HB   VAL   8           HB       VAL   8   3.133  -5.092   2.771
   64   HG11  VAL   8          1HG1      VAL   8   2.190  -2.226   2.431
   65   HG12  VAL   8          2HG1      VAL   8   1.175  -3.608   2.839
   66   HG13  VAL   8          3HG1      VAL   8   1.968  -3.534   1.267
   67   HG21  VAL   8          3HG2      VAL   8   4.462  -3.875   1.078
   68   HG22  VAL   8          1HG2      VAL   8   5.421  -4.227   2.518
   69   HG23  VAL   8          2HG2      VAL   8   4.799  -2.598   2.250
   70    H    GLN   9           H        GLN   9   2.226  -2.335   6.151
   71    HA   GLN   9           HA       GLN   9   0.392  -4.470   7.054
   72    HB2  GLN   9           2HB      GLN   9   0.991  -1.743   8.302
   73    HB3  GLN   9           3HB      GLN   9   0.095  -3.059   9.051
   74    HG2  GLN   9           2HG      GLN   9   2.119  -4.412   9.203
   75    HG3  GLN   9           3HG      GLN   9   3.031  -3.201   8.300
   76   HE21  GLN   9          1HE2      GLN   9   3.655  -1.275   9.350
   77   HE22  GLN   9          2HE2      GLN   9   3.594  -1.101  11.070
   78    H    VAL  10           H        VAL  10  -1.330  -4.439   5.658
   79    HA   VAL  10           HA       VAL  10  -2.414  -1.883   4.669
   80    HB   VAL  10           HB       VAL  10  -3.089  -4.757   3.832
   81   HG11  VAL  10          1HG1      VAL  10  -4.308  -3.736   1.935
   82   HG12  VAL  10          2HG1      VAL  10  -3.992  -2.127   2.590
   83   HG13  VAL  10          3HG1      VAL  10  -5.012  -3.258   3.482
   84   HG21  VAL  10          3HG2      VAL  10  -0.804  -4.132   3.184
   85   HG22  VAL  10          1HG2      VAL  10  -1.396  -2.651   2.426
   86   HG23  VAL  10          2HG2      VAL  10  -1.836  -4.224   1.757
   87    H    LYS  11           H        LYS  11  -3.712  -1.010   6.127
   88    HA   LYS  11           HA       LYS  11  -5.667  -2.632   7.645
   89    HB2  LYS  11           2HB      LYS  11  -3.956  -1.390   8.994
   90    HB3  LYS  11           3HB      LYS  11  -4.458   0.121   8.243
   91    HG2  LYS  11           2HG      LYS  11  -6.756  -0.249   9.241
   92    HG3  LYS  11           3HG      LYS  11  -6.089  -1.625  10.119
   93    HD2  LYS  11           2HD      LYS  11  -5.229   1.280  10.394
   94    HD3  LYS  11           3HD      LYS  11  -6.186   0.361  11.554
   95    HE2  LYS  11           2HE      LYS  11  -3.296  -0.180  10.797
   96    HE3  LYS  11           3HE      LYS  11  -3.861   0.545  12.300
   97    HZ1  LYS  11           3HZ      LYS  11  -4.329  -2.235  11.377
   98    HZ2  LYS  11           1HZ      LYS  11  -5.084  -1.551  12.726
   99    HZ3  LYS  11           2HZ      LYS  11  -3.408  -1.737  12.704
  100    H    ILE  12           H        ILE  12  -7.493  -2.568   6.353
  101    HA   ILE  12           HA       ILE  12  -8.370   0.071   5.299
  102    HB   ILE  12           HB       ILE  12  -7.927  -1.542   3.489
  103   HG12  ILE  12          2HG1      ILE  12 -10.909  -1.003   3.862
  104   HG13  ILE  12          3HG1      ILE  12  -9.738   0.132   3.203
  105   HG21  ILE  12          1HG2      ILE  12  -8.299  -3.661   4.680
  106   HG22  ILE  12          2HG2      ILE  12  -9.243  -3.606   3.192
  107   HG23  ILE  12          3HG2      ILE  12 -10.034  -3.334   4.746
  108   HD11  ILE  12          3HD1      ILE  12 -10.561  -2.481   1.958
  109   HD12  ILE  12          1HD1      ILE  12  -9.377  -1.350   1.301
  110   HD13  ILE  12          2HD1      ILE  12 -11.065  -0.867   1.462
  111    H    THR  13           H        THR  13 -10.442   0.748   5.724
  112    HA   THR  13           HA       THR  13 -12.046  -0.830   7.666
  113    HB   THR  13           HB       THR  13 -11.703   2.207   7.553
  114    HG1  THR  13           HG1      THR  13 -10.743   0.376   9.530
  115   HG21  THR  13          3HG2      THR  13 -13.135   0.464   9.606
  116   HG22  THR  13          1HG2      THR  13 -13.916   1.553   8.455
  117   HG23  THR  13          2HG2      THR  13 -12.887   2.207   9.730
  118    H    CYS  14           H        CYS  14 -14.098  -1.163   7.134
  119    HA   CYS  14           HA       CYS  14 -15.720   0.609   5.547
  120    HB2  CYS  14           2HB      CYS  14 -14.736  -0.559   3.679
  121    HB3  CYS  14           3HB      CYS  14 -14.974  -2.125   4.461
  122    H    ASN  15           H        ASN  15 -17.822   0.445   6.163
  123    HA   ASN  15           HA       ASN  15 -19.705  -0.107   7.295
  124    HB2  ASN  15           2HB      ASN  15 -18.710  -2.968   6.923
  125    HB3  ASN  15           3HB      ASN  15 -20.299  -2.563   7.562
  126   HD21  ASN  15          1HD2      ASN  15 -18.424  -2.962   4.716
  127   HD22  ASN  15          2HD2      ASN  15 -19.658  -2.540   3.583
  128    H    GLY  16           H        GLY  16 -17.194   0.445   8.771
  129    HA2  GLY  16           2HA      GLY  16 -16.539   0.649  10.974
  130    HA3  GLY  16           3HA      GLY  16 -18.011  -0.188  11.452
  131    H    LYS  17           H        LYS  17 -16.106  -1.830   9.141
  132    HA   LYS  17           HA       LYS  17 -14.879  -3.584  11.191
  133    HB2  LYS  17           2HB      LYS  17 -16.138  -4.255   8.501
  134    HB3  LYS  17           3HB      LYS  17 -15.039  -5.364   9.301
  135    HG2  LYS  17           2HG      LYS  17 -17.348  -4.413  10.953
  136    HG3  LYS  17           3HG      LYS  17 -17.736  -5.445   9.581
  137    HD2  LYS  17           2HD      LYS  17 -17.488  -6.798  11.592
  138    HD3  LYS  17           3HD      LYS  17 -16.212  -7.189  10.441
  139    HE2  LYS  17           2HE      LYS  17 -14.635  -5.786  11.745
  140    HE3  LYS  17           3HE      LYS  17 -15.920  -5.437  12.905
  141    HZ1  LYS  17           3HZ      LYS  17 -14.484  -7.219  13.671
  142    HZ2  LYS  17           1HZ      LYS  17 -14.832  -8.141  12.300
  143    HZ3  LYS  17           2HZ      LYS  17 -16.048  -7.794  13.420
  144    H    THR  18           H        THR  18 -12.754  -3.561  11.187
  145    HA   THR  18           HA       THR  18 -11.262  -2.518   8.871
  146    HB   THR  18           HB       THR  18 -10.349  -2.977  11.754
  147    HG1  THR  18           HG1      THR  18 -11.826  -1.233  11.539
  148   HG21  THR  18          3HG2      THR  18  -8.465  -3.143  10.158
  149   HG22  THR  18          1HG2      THR  18  -8.359  -1.664  11.116
  150   HG23  THR  18          2HG2      THR  18  -8.922  -1.594   9.446
  151    H    TYR  19           H        TYR  19 -10.319  -3.916   7.565
  152    HA   TYR  19           HA       TYR  19  -9.645  -6.673   8.384
  153    HB2  TYR  19           2HB      TYR  19 -10.039  -5.491   5.585
  154    HB3  TYR  19           3HB      TYR  19  -9.678  -7.175   5.944
  155    HD1  TYR  19           HD2      TYR  19 -12.308  -4.543   6.135
  156    HD2  TYR  19           HD1      TYR  19 -11.451  -8.701   6.654
  157    HE1  TYR  19           HE2      TYR  19 -14.716  -5.027   6.234
  158    HE2  TYR  19           HE1      TYR  19 -13.863  -9.180   6.746
  159    HH   TYR  19           HH       TYR  19 -16.226  -6.941   5.821
  160    H    GLU  20           H        GLU  20  -7.519  -6.799   8.923
  161    HA   GLU  20           HA       GLU  20  -5.507  -5.327   7.382
  162    HB2  GLU  20           2HB      GLU  20  -4.444  -4.473   9.476
  163    HB3  GLU  20           3HB      GLU  20  -6.022  -3.782   9.138
  164    HG2  GLU  20           2HG      GLU  20  -6.031  -4.116  11.451
  165    HG3  GLU  20           3HG      GLU  20  -6.955  -5.481  10.832
  166    H    ARG  21           H        ARG  21  -3.371  -6.052   7.576
  167    HA   ARG  21           HA       ARG  21  -2.532  -8.172   9.273
  168    HB2  ARG  21           2HB      ARG  21  -3.832  -9.578   7.698
  169    HB3  ARG  21           3HB      ARG  21  -2.952  -8.910   6.329
  170    HG2  ARG  21           2HG      ARG  21  -0.879  -9.975   7.097
  171    HG3  ARG  21           3HG      ARG  21  -1.686 -10.549   8.555
  172    HD2  ARG  21           2HD      ARG  21  -2.417 -11.382   5.730
  173    HD3  ARG  21           3HD      ARG  21  -1.419 -12.324   6.844
  174    HE   ARG  21           HE       ARG  21  -3.873 -11.717   8.081
  175   HH11  ARG  21          1HH1      ARG  21  -2.616 -13.775   5.537
  176   HH12  ARG  21          2HH1      ARG  21  -3.859 -14.969   5.714
  177   HH21  ARG  21          1HH2      ARG  21  -5.526 -13.273   8.302
  178   HH22  ARG  21          2HH2      ARG  21  -5.518 -14.683   7.291
  179    H    THR  22           H        THR  22  -0.305  -8.309   9.328
  180    HA   THR  22           HA       THR  22   1.289  -6.418   7.796
  181    HB   THR  22           HB       THR  22   2.138  -8.469   9.904
  182    HG1  THR  22           HG1      THR  22   1.630  -7.002  11.353
  183   HG21  THR  22          3HG2      THR  22   3.636  -6.059   8.797
  184   HG22  THR  22          1HG2      THR  22   4.045  -7.751   8.501
  185   HG23  THR  22          2HG2      THR  22   4.185  -7.079  10.127
  186    H    TYR  23           H        TYR  23   1.860  -7.010   5.785
  187    HA   TYR  23           HA       TYR  23   2.349  -9.830   5.051
  188    HB2  TYR  23           2HB      TYR  23   2.158  -7.374   3.227
  189    HB3  TYR  23           3HB      TYR  23   2.202  -9.062   2.718
  190    HD1  TYR  23           HD2      TYR  23   0.212 -10.564   3.230
  191    HD2  TYR  23           HD1      TYR  23   0.084  -6.340   3.884
  192    HE1  TYR  23           HE2      TYR  23  -2.246 -10.648   3.378
  193    HE2  TYR  23           HE1      TYR  23  -2.354  -6.438   4.039
  194    HH   TYR  23           HH       TYR  23  -4.060  -9.333   4.375
  195    H    GLN  24           H        GLN  24   4.345 -10.489   4.335
  196    HA   GLN  24           HA       GLN  24   6.629  -8.636   4.770
  197    HB2  GLN  24           2HB      GLN  24   6.492 -11.697   4.923
  198    HB3  GLN  24           3HB      GLN  24   7.982 -10.766   5.036
  199    HG2  GLN  24           2HG      GLN  24   7.331 -11.388   7.263
  200    HG3  GLN  24           3HG      GLN  24   7.079  -9.651   7.099
  201   HE21  GLN  24          1HE2      GLN  24   5.551  -9.545   8.780
  202   HE22  GLN  24          2HE2      GLN  24   3.967 -10.218   8.643
  203    H    LEU  25           H        LEU  25   7.314  -7.839   2.886
  204    HA   LEU  25           HA       LEU  25   7.186  -9.468   0.411
  205    HB2  LEU  25           2HB      LEU  25   6.891  -6.437   0.692
  206    HB3  LEU  25           3HB      LEU  25   6.886  -7.322  -0.824
  207    HG   LEU  25           HG       LEU  25   4.768  -7.474   1.357
  208   HD11  LEU  25          1HD1      LEU  25   4.598  -6.356  -1.460
  209   HD12  LEU  25          2HD1      LEU  25   4.636  -5.422   0.037
  210   HD13  LEU  25          3HD1      LEU  25   3.266  -6.474  -0.304
  211   HD21  LEU  25          3HD2      LEU  25   4.888  -9.013  -1.261
  212   HD22  LEU  25          1HD2      LEU  25   3.496  -8.952  -0.172
  213   HD23  LEU  25          2HD2      LEU  25   5.003  -9.686   0.366
  214    H    TYR  26           H        TYR  26   9.233 -10.211   0.249
  215    HA   TYR  26           HA       TYR  26  11.541  -8.423   0.600
  216    HB2  TYR  26           2HB      TYR  26  11.642 -10.701   1.611
  217    HB3  TYR  26           3HB      TYR  26  11.435 -11.431   0.020
  218    HD1  TYR  26           HD1      TYR  26  13.693  -9.051   1.847
  219    HD2  TYR  26           HD2      TYR  26  13.428 -12.049  -1.187
  220    HE1  TYR  26           HE1      TYR  26  16.113  -8.950   1.551
  221    HE2  TYR  26           HE2      TYR  26  15.878 -11.951  -1.475
  222    HH   TYR  26           HH       TYR  26  17.722 -10.324  -1.066
  223    H    ALA  27           H        ALA  27  12.432  -7.439  -1.118
  224    HA   ALA  27           HA       ALA  27  12.419  -8.700  -3.785
  225    HB1  ALA  27           3HB      ALA  27  11.680  -5.796  -3.255
  226    HB2  ALA  27           1HB      ALA  27  10.578  -7.059  -3.803
  227    HB3  ALA  27           2HB      ALA  27  11.897  -6.530  -4.845
  228    H    VAL  28           H        VAL  28  14.182  -8.080  -5.066
  229    HA   VAL  28           HA       VAL  28  16.579  -7.258  -3.700
  230    HB   VAL  28           HB       VAL  28  16.126  -7.612  -6.707
  231   HG11  VAL  28          1HG1      VAL  28  18.728  -7.628  -5.128
  232   HG12  VAL  28          2HG1      VAL  28  18.183  -6.363  -6.232
  233   HG13  VAL  28          3HG1      VAL  28  18.567  -7.967  -6.854
  234   HG21  VAL  28          3HG2      VAL  28  15.528  -9.683  -5.525
  235   HG22  VAL  28          1HG2      VAL  28  17.091  -9.687  -4.703
  236   HG23  VAL  28          2HG2      VAL  28  17.012  -9.904  -6.453
  237    H    ARG  29           H        ARG  29  14.707  -5.904  -6.434
  238    HA   ARG  29           HA       ARG  29  15.850  -3.222  -5.950
  239    HB2  ARG  29           2HB      ARG  29  14.427  -4.380  -8.387
  240    HB3  ARG  29           3HB      ARG  29  14.963  -2.707  -8.258
  241    HG2  ARG  29           2HG      ARG  29  17.295  -3.435  -8.099
  242    HG3  ARG  29           3HG      ARG  29  16.789  -5.124  -8.145
  243    HD2  ARG  29           2HD      ARG  29  15.953  -4.865 -10.414
  244    HD3  ARG  29           3HD      ARG  29  16.287  -3.127 -10.379
  245    HE   ARG  29           HE       ARG  29  18.555  -4.910  -9.950
  246   HH11  ARG  29          1HH1      ARG  29  16.787  -2.919 -12.238
  247   HH12  ARG  29          2HH1      ARG  29  18.110  -2.819 -13.355
  248   HH21  ARG  29          1HH2      ARG  29  20.300  -4.737 -11.399
  249   HH22  ARG  29          2HH2      ARG  29  20.105  -3.850 -12.878
  250    H    ASP  30           H        ASP  30  14.384  -1.421  -6.467
  251    HA   ASP  30           HA       ASP  30  12.216  -1.255  -4.647
  252    HB2  ASP  30           2HB      ASP  30  12.867   0.669  -6.934
  253    HB3  ASP  30           3HB      ASP  30  11.944   1.038  -5.485
  254    H    GLU  31           H        GLU  31  12.451  -1.304  -8.147
  255    HA   GLU  31           HA       GLU  31   9.766  -1.048  -8.916
  256    HB2  GLU  31           2HB      GLU  31  10.571  -1.942 -11.119
  257    HB3  GLU  31           3HB      GLU  31  11.608  -0.683 -10.465
  258    HG2  GLU  31           2HG      GLU  31  13.042  -2.649  -9.524
  259    HG3  GLU  31           3HG      GLU  31  12.152  -3.644 -10.669
  260    H    GLU  32           H        GLU  32  11.567  -3.851  -7.834
  261    HA   GLU  32           HA       GLU  32   9.812  -5.885  -8.811
  262    HB2  GLU  32           2HB      GLU  32  11.885  -5.946  -6.585
  263    HB3  GLU  32           3HB      GLU  32  11.134  -7.367  -7.302
  264    HG2  GLU  32           2HG      GLU  32  12.924  -5.380  -8.721
  265    HG3  GLU  32           3HG      GLU  32  13.372  -7.004  -8.204
  266    H    LEU  33           H        LEU  33   9.822  -3.842  -6.002
  267    HA   LEU  33           HA       LEU  33   8.077  -5.437  -4.375
  268    HB2  LEU  33           2HB      LEU  33   9.725  -3.284  -3.862
  269    HB3  LEU  33           3HB      LEU  33   8.173  -2.477  -3.889
  270    HG   LEU  33           HG       LEU  33   8.748  -3.036  -1.594
  271   HD11  LEU  33          1HD1      LEU  33   6.537  -4.909  -2.485
  272   HD12  LEU  33          2HD1      LEU  33   6.365  -3.198  -2.093
  273   HD13  LEU  33          3HD1      LEU  33   6.827  -4.340  -0.837
  274   HD21  LEU  33          3HD2      LEU  33   8.975  -5.947  -2.428
  275   HD22  LEU  33          1HD2      LEU  33   9.125  -5.314  -0.785
  276   HD23  LEU  33          2HD2      LEU  33  10.315  -4.877  -2.006
  277    H    LYS  34           H        LYS  34   7.628  -3.092  -6.957
  278    HA   LYS  34           HA       LYS  34   5.108  -2.052  -6.479
  279    HB2  LYS  34           2HB      LYS  34   6.434  -2.703  -9.137
  280    HB3  LYS  34           3HB      LYS  34   4.845  -1.957  -9.054
  281    HG2  LYS  34           2HG      LYS  34   5.943  -0.082  -7.688
  282    HG3  LYS  34           3HG      LYS  34   7.494  -0.786  -8.167
  283    HD2  LYS  34           2HD      LYS  34   6.887   1.033  -9.720
  284    HD3  LYS  34           3HD      LYS  34   6.868  -0.516 -10.567
  285    HE2  LYS  34           2HE      LYS  34   4.361  -0.582 -10.223
  286    HE3  LYS  34           3HE      LYS  34   4.458   1.057  -9.582
  287    HZ1  LYS  34           3HZ      LYS  34   3.841   1.058 -11.916
  288    HZ2  LYS  34           1HZ      LYS  34   5.250   0.218 -12.326
  289    HZ3  LYS  34           2HZ      LYS  34   5.344   1.788 -11.712
  290    H    GLU  35           H        GLU  35   5.808  -4.956  -8.461
  291    HA   GLU  35           HA       GLU  35   3.163  -5.569  -9.097
  292    HB2  GLU  35           2HB      GLU  35   4.053  -7.798  -9.824
  293    HB3  GLU  35           3HB      GLU  35   4.951  -6.427 -10.443
  294    HG2  GLU  35           2HG      GLU  35   6.675  -7.850  -9.915
  295    HG3  GLU  35           3HG      GLU  35   6.579  -6.916  -8.425
  296    H    LYS  36           H        LYS  36   5.052  -6.454  -6.291
  297    HA   LYS  36           HA       LYS  36   3.341  -8.456  -5.213
  298    HB2  LYS  36           2HB      LYS  36   5.181  -6.599  -3.637
  299    HB3  LYS  36           3HB      LYS  36   4.596  -8.185  -3.136
  300    HG2  LYS  36           2HG      LYS  36   5.897  -9.231  -4.953
  301    HG3  LYS  36           3HG      LYS  36   6.479  -7.638  -5.440
  302    HD2  LYS  36           2HD      LYS  36   7.512  -7.403  -3.136
  303    HD3  LYS  36           3HD      LYS  36   7.074  -9.092  -2.834
  304    HE2  LYS  36           2HE      LYS  36   8.925  -8.055  -5.001
  305    HE3  LYS  36           3HE      LYS  36   9.388  -8.965  -3.569
  306    HZ1  LYS  36           3HZ      LYS  36   7.687  -9.982  -5.777
  307    HZ2  LYS  36           1HZ      LYS  36   8.156 -10.857  -4.408
  308    HZ3  LYS  36           2HZ      LYS  36   9.317 -10.361  -5.530
  309    H    LEU  37           H        LEU  37   3.686  -4.964  -4.635
  310    HA   LEU  37           HA       LEU  37   1.701  -4.548  -2.704
  311    HB2  LEU  37           2HB      LEU  37   2.732  -2.694  -4.892
  312    HB3  LEU  37           3HB      LEU  37   1.704  -2.158  -3.572
  313    HG   LEU  37           HG       LEU  37   4.438  -3.412  -3.138
  314   HD11  LEU  37          1HD1      LEU  37   4.722  -1.355  -4.421
  315   HD12  LEU  37          2HD1      LEU  37   5.308  -1.147  -2.773
  316   HD13  LEU  37          3HD1      LEU  37   3.752  -0.462  -3.248
  317   HD21  LEU  37          3HD2      LEU  37   2.940  -3.579  -1.206
  318   HD22  LEU  37          1HD2      LEU  37   2.636  -1.839  -1.263
  319   HD23  LEU  37          2HD2      LEU  37   4.249  -2.449  -0.880
  320    H    LYS  38           H        LYS  38   1.518  -4.516  -6.271
  321    HA   LYS  38           HA       LYS  38  -1.156  -3.720  -6.591
  322    HB2  LYS  38           2HB      LYS  38   0.613  -5.457  -8.383
  323    HB3  LYS  38           3HB      LYS  38  -0.923  -4.752  -8.883
  324    HG2  LYS  38           2HG      LYS  38  -0.022  -2.497  -8.628
  325    HG3  LYS  38           3HG      LYS  38   1.484  -3.151  -7.988
  326    HD2  LYS  38           2HD      LYS  38   1.932  -2.567 -10.254
  327    HD3  LYS  38           3HD      LYS  38   1.814  -4.325 -10.221
  328    HE2  LYS  38           2HE      LYS  38  -0.448  -2.486 -11.070
  329    HE3  LYS  38           3HE      LYS  38   0.702  -3.218 -12.181
  330    HZ1  LYS  38           3HZ      LYS  38  -1.346  -4.459 -12.104
  331    HZ2  LYS  38           1HZ      LYS  38  -1.192  -4.696 -10.441
  332    HZ3  LYS  38           2HZ      LYS  38  -0.083  -5.397 -11.500
  333    H    LYS  39           H        LYS  39   0.317  -6.973  -6.283
  334    HA   LYS  39           HA       LYS  39  -2.061  -8.472  -6.566
  335    HB2  LYS  39           2HB      LYS  39   0.442  -9.169  -4.975
  336    HB3  LYS  39           3HB      LYS  39  -0.843 -10.306  -5.366
  337    HG2  LYS  39           2HG      LYS  39   1.020  -8.928  -7.308
  338    HG3  LYS  39           3HG      LYS  39   1.010 -10.637  -6.878
  339    HD2  LYS  39           2HD      LYS  39  -1.255 -10.852  -7.914
  340    HD3  LYS  39           3HD      LYS  39  -1.179  -9.149  -8.380
  341    HE2  LYS  39           2HE      LYS  39   0.827  -9.638  -9.765
  342    HE3  LYS  39           3HE      LYS  39   0.688 -11.348  -9.334
  343    HZ1  LYS  39           3HZ      LYS  39  -0.336 -10.928 -11.462
  344    HZ2  LYS  39           1HZ      LYS  39  -1.329  -9.739 -10.795
  345    HZ3  LYS  39           2HZ      LYS  39  -1.530 -11.351 -10.342
  346    H    VAL  40           H        VAL  40  -0.418  -7.298  -3.615
  347    HA   VAL  40           HA       VAL  40  -2.171  -8.358  -1.700
  348    HB   VAL  40           HB       VAL  40  -0.337  -5.915  -1.513
  349   HG11  VAL  40          1HG1      VAL  40  -1.676  -7.438   0.754
  350   HG12  VAL  40          2HG1      VAL  40  -2.022  -5.778   0.261
  351   HG13  VAL  40          3HG1      VAL  40  -0.449  -6.182   0.945
  352   HG21  VAL  40          3HG2      VAL  40   1.254  -7.438  -0.394
  353   HG22  VAL  40          1HG2      VAL  40   0.863  -8.019  -2.013
  354   HG23  VAL  40          2HG2      VAL  40   0.132  -8.786  -0.604
  355    H    LEU  41           H        LEU  41  -2.238  -5.262  -3.442
  356    HA   LEU  41           HA       LEU  41  -4.374  -4.084  -1.968
  357    HB2  LEU  41           2HB      LEU  41  -3.176  -3.435  -4.689
  358    HB3  LEU  41           3HB      LEU  41  -4.542  -2.538  -4.045
  359    HG   LEU  41           HG       LEU  41  -1.789  -2.721  -2.751
  360   HD11  LEU  41          1HD1      LEU  41  -3.106  -0.374  -4.154
  361   HD12  LEU  41          2HD1      LEU  41  -1.766  -1.342  -4.771
  362   HD13  LEU  41          3HD1      LEU  41  -1.541  -0.354  -3.332
  363   HD21  LEU  41          3HD2      LEU  41  -2.603  -1.045  -1.147
  364   HD22  LEU  41          1HD2      LEU  41  -3.538  -2.535  -1.042
  365   HD23  LEU  41          2HD2      LEU  41  -4.218  -1.124  -1.856
  366    H    ASN  42           H        ASN  42  -4.284  -5.733  -5.166
  367    HA   ASN  42           HA       ASN  42  -7.062  -5.661  -5.670
  368    HB2  ASN  42           2HB      ASN  42  -4.896  -7.539  -6.716
  369    HB3  ASN  42           3HB      ASN  42  -6.569  -7.620  -7.263
  370   HD21  ASN  42          1HD2      ASN  42  -6.073  -7.080  -9.376
  371   HD22  ASN  42          2HD2      ASN  42  -5.547  -5.505  -9.852
  372    H    GLU  43           H        GLU  43  -5.123  -7.897  -3.774
  373    HA   GLU  43           HA       GLU  43  -7.083  -9.907  -3.354
  374    HB2  GLU  43           2HB      GLU  43  -4.578  -9.082  -1.844
  375    HB3  GLU  43           3HB      GLU  43  -5.621 -10.354  -1.229
  376    HG2  GLU  43           2HG      GLU  43  -4.252 -10.386  -3.930
  377    HG3  GLU  43           3HG      GLU  43  -3.667 -11.209  -2.489
  378    H    ARG  44           H        ARG  44  -6.085  -7.088  -1.376
  379    HA   ARG  44           HA       ARG  44  -7.993  -7.660   0.682
  380    HB2  ARG  44           2HB      ARG  44  -5.643  -6.385   0.811
  381    HB3  ARG  44           3HB      ARG  44  -6.629  -4.962   0.513
  382    HG2  ARG  44           2HG      ARG  44  -6.445  -5.066   2.854
  383    HG3  ARG  44           3HG      ARG  44  -8.047  -5.725   2.531
  384    HD2  ARG  44           2HD      ARG  44  -5.534  -7.332   3.137
  385    HD3  ARG  44           3HD      ARG  44  -6.867  -7.026   4.248
  386    HE   ARG  44           HE       ARG  44  -8.274  -8.455   2.918
  387   HH11  ARG  44          1HH1      ARG  44  -4.847  -8.709   2.102
  388   HH12  ARG  44          2HH1      ARG  44  -5.032 -10.255   1.347
  389   HH21  ARG  44          1HH2      ARG  44  -8.468 -10.465   1.876
  390   HH22  ARG  44          2HH2      ARG  44  -7.064 -11.240   1.217
  391    H    MET  45           H        MET  45  -8.029  -5.704  -2.173
  392    HA   MET  45           HA       MET  45 -10.296  -4.073  -1.417
  393    HB2  MET  45           2HB      MET  45  -8.717  -4.384  -3.997
  394    HB3  MET  45           3HB      MET  45 -10.165  -3.396  -3.915
  395    HG2  MET  45           2HG      MET  45  -8.117  -2.759  -1.864
  396    HG3  MET  45           3HG      MET  45  -7.652  -2.448  -3.531
  397    HE1  MET  45           3HE      MET  45 -11.206  -0.395  -1.412
  398    HE2  MET  45           1HE      MET  45 -10.127  -1.559  -0.646
  399    HE3  MET  45           2HE      MET  45 -11.284  -2.097  -1.862
  400    H    ASP  46           H        ASP  46  -9.819  -7.140  -3.044
  401    HA   ASP  46           HA       ASP  46 -12.008  -7.161  -4.773
  402    HB2  ASP  46           2HB      ASP  46 -10.219  -8.790  -5.010
  403    HB3  ASP  46           3HB      ASP  46 -10.603  -9.527  -3.463
  404    HA   PRO  47           HA       PRO  47 -14.805  -9.280  -1.319
  405    HB2  PRO  47           2HB      PRO  47 -14.064  -8.847   1.315
  406    HB3  PRO  47           3HB      PRO  47 -13.591 -10.292   0.398
  407    HG2  PRO  47           2HG      PRO  47 -12.004  -7.786   0.884
  408    HG3  PRO  47           3HG      PRO  47 -11.489  -9.482   1.038
  409    HD2  PRO  47           2HD      PRO  47 -10.864  -8.052  -1.131
  410    HD3  PRO  47           3HD      PRO  47 -11.311  -9.770  -1.276
  411    H    ILE  48           H        ILE  48 -13.080  -6.254  -0.804
  412    HA   ILE  48           HA       ILE  48 -15.133  -4.899   0.703
  413    HB   ILE  48           HB       ILE  48 -12.608  -3.845  -0.660
  414   HG12  ILE  48          2HG1      ILE  48 -12.147  -5.526   1.105
  415   HG13  ILE  48          3HG1      ILE  48 -11.566  -3.937   1.572
  416   HG21  ILE  48          1HG2      ILE  48 -12.799  -1.860   0.789
  417   HG22  ILE  48          2HG2      ILE  48 -14.351  -2.439   1.392
  418   HG23  ILE  48          3HG2      ILE  48 -14.176  -1.997  -0.307
  419   HD11  ILE  48          3HD1      ILE  48 -12.554  -5.105   3.445
  420   HD12  ILE  48          1HD1      ILE  48 -14.080  -5.272   2.579
  421   HD13  ILE  48          2HD1      ILE  48 -13.504  -3.672   3.057
  422    H    LYS  49           H        LYS  49 -14.148  -5.068  -2.690
  423    HA   LYS  49           HA       LYS  49 -15.838  -2.987  -3.701
  424    HB2  LYS  49           2HB      LYS  49 -14.521  -5.367  -5.079
  425    HB3  LYS  49           3HB      LYS  49 -15.408  -4.110  -5.940
  426    HG2  LYS  49           2HG      LYS  49 -13.787  -2.421  -5.257
  427    HG3  LYS  49           3HG      LYS  49 -12.931  -3.598  -4.256
  428    HD2  LYS  49           2HD      LYS  49 -12.394  -4.918  -6.310
  429    HD3  LYS  49           3HD      LYS  49 -13.202  -3.692  -7.291
  430    HE2  LYS  49           2HE      LYS  49 -11.551  -2.012  -6.560
  431    HE3  LYS  49           3HE      LYS  49 -10.756  -3.223  -5.549
  432    HZ1  LYS  49           3HZ      LYS  49 -10.289  -4.513  -7.577
  433    HZ2  LYS  49           1HZ      LYS  49  -9.589  -2.974  -7.625
  434    HZ3  LYS  49           2HZ      LYS  49 -10.987  -3.289  -8.517
  435    H    LYS  50           H        LYS  50 -16.144  -6.449  -3.139
  436    HA   LYS  50           HA       LYS  50 -18.750  -6.803  -4.261
  437    HB2  LYS  50           2HB      LYS  50 -17.193  -8.667  -4.013
  438    HB3  LYS  50           3HB      LYS  50 -17.122  -8.430  -2.270
  439    HG2  LYS  50           2HG      LYS  50 -19.506  -9.094  -2.086
  440    HG3  LYS  50           3HG      LYS  50 -19.565  -9.331  -3.838
  441    HD2  LYS  50           2HD      LYS  50 -19.275 -11.468  -2.611
  442    HD3  LYS  50           3HD      LYS  50 -17.916 -11.134  -3.687
  443    HE2  LYS  50           2HE      LYS  50 -16.649 -10.251  -1.696
  444    HE3  LYS  50           3HE      LYS  50 -17.984 -10.776  -0.668
  445    HZ1  LYS  50           3HZ      LYS  50 -16.194 -12.397  -0.746
  446    HZ2  LYS  50           1HZ      LYS  50 -16.366 -12.549  -2.419
  447    HZ3  LYS  50           2HZ      LYS  50 -17.612 -13.040  -1.389
  448    H    LEU  51           H        LEU  51 -17.519  -5.790  -1.127
  449    HA   LEU  51           HA       LEU  51 -20.022  -5.915   0.298
  450    HB2  LEU  51           2HB      LEU  51 -17.468  -4.347   0.888
  451    HB3  LEU  51           3HB      LEU  51 -18.871  -4.331   1.946
  452    HG   LEU  51           HG       LEU  51 -17.118  -6.738   1.317
  453   HD11  LEU  51          1HD1      LEU  51 -16.491  -6.658   3.692
  454   HD12  LEU  51          2HD1      LEU  51 -17.458  -5.196   3.908
  455   HD13  LEU  51          3HD1      LEU  51 -16.044  -5.174   2.851
  456   HD21  LEU  51          3HD2      LEU  51 -19.422  -7.483   1.552
  457   HD22  LEU  51          1HD2      LEU  51 -19.578  -6.616   3.083
  458   HD23  LEU  51          2HD2      LEU  51 -18.473  -7.987   2.946
  459    H    GLY  52           H        GLY  52 -18.372  -3.617  -1.774
  460    HA2  GLY  52           2HA      GLY  52 -19.171  -1.835  -2.978
  461    HA3  GLY  52           3HA      GLY  52 -20.785  -2.196  -2.382
  462    H    CYS  53           H        CYS  53 -17.711  -1.190  -0.895
  463    HA   CYS  53           HA       CYS  53 -18.977   0.489   1.045
  464    HB2  CYS  53           2HB      CYS  53 -16.043   0.481   0.271
  465    HB3  CYS  53           3HB      CYS  53 -16.750   0.937   1.821
  466    H    LYS  54           H        LYS  54 -19.700   2.513   0.717
  467    HA   LYS  54           HA       LYS  54 -19.321   4.027  -1.665
  468    HB2  LYS  54           2HB      LYS  54 -20.450   4.873   1.046
  469    HB3  LYS  54           3HB      LYS  54 -20.587   5.815  -0.439
  470    HG2  LYS  54           2HG      LYS  54 -21.924   4.050  -1.480
  471    HG3  LYS  54           3HG      LYS  54 -21.736   3.032  -0.049
  472    HD2  LYS  54           2HD      LYS  54 -22.993   4.689   1.295
  473    HD3  LYS  54           3HD      LYS  54 -23.169   5.718  -0.131
  474    HE2  LYS  54           2HE      LYS  54 -24.507   4.008  -1.247
  475    HE3  LYS  54           3HE      LYS  54 -24.246   2.887   0.093
  476    HZ1  LYS  54           3HZ      LYS  54 -25.486   4.332   1.541
  477    HZ2  LYS  54           1HZ      LYS  54 -26.416   3.982   0.171
  478    HZ3  LYS  54           2HZ      LYS  54 -25.665   5.490   0.317
  479    H    ARG  55           H        ARG  55 -17.643   3.858   1.356
  480    HA   ARG  55           HA       ARG  55 -15.557   5.681   0.366
  481    HB2  ARG  55           2HB      ARG  55 -16.941   6.999   1.984
  482    HB3  ARG  55           3HB      ARG  55 -16.706   5.752   3.202
  483    HG2  ARG  55           2HG      ARG  55 -15.249   7.657   3.644
  484    HG3  ARG  55           3HG      ARG  55 -14.275   6.240   3.237
  485    HD2  ARG  55           2HD      ARG  55 -13.404   8.257   2.145
  486    HD3  ARG  55           3HD      ARG  55 -13.991   7.101   0.943
  487    HE   ARG  55           HE       ARG  55 -15.827   9.207   1.819
  488   HH11  ARG  55          1HH1      ARG  55 -13.672   8.055  -0.699
  489   HH12  ARG  55          2HH1      ARG  55 -14.328   9.105  -1.911
  490   HH21  ARG  55          1HH2      ARG  55 -16.674  10.601   0.223
  491   HH22  ARG  55          2HH2      ARG  55 -16.034  10.551  -1.390
  492    H    VAL  56           H        VAL  56 -13.646   4.628   0.447
  493    HA   VAL  56           HA       VAL  56 -13.163   2.613   2.576
  494    HB   VAL  56           HB       VAL  56 -11.395   1.632   1.090
  495   HG11  VAL  56          1HG1      VAL  56 -14.188   1.633  -0.107
  496   HG12  VAL  56          2HG1      VAL  56 -13.618   0.612   1.214
  497   HG13  VAL  56          3HG1      VAL  56 -12.937   0.419  -0.400
  498   HG21  VAL  56          3HG2      VAL  56 -10.938   3.575  -0.375
  499   HG22  VAL  56          1HG2      VAL  56 -12.550   3.440  -1.085
  500   HG23  VAL  56          2HG2      VAL  56 -11.361   2.160  -1.338
  501    H    ARG  57           H        ARG  57 -11.393   2.849   3.810
  502    HA   ARG  57           HA       ARG  57  -9.352   4.877   3.111
  503    HB2  ARG  57           2HB      ARG  57 -10.886   5.699   4.914
  504    HB3  ARG  57           3HB      ARG  57 -10.448   4.309   5.904
  505    HG2  ARG  57           2HG      ARG  57  -8.173   5.082   6.117
  506    HG3  ARG  57           3HG      ARG  57  -8.432   6.348   4.915
  507    HD2  ARG  57           2HD      ARG  57 -10.120   7.379   6.483
  508    HD3  ARG  57           3HD      ARG  57  -9.643   6.193   7.698
  509    HE   ARG  57           HE       ARG  57  -7.953   8.354   6.602
  510   HH11  ARG  57          1HH1      ARG  57  -8.524   5.986   9.136
  511   HH12  ARG  57          2HH1      ARG  57  -7.264   6.602  10.154
  512   HH21  ARG  57          1HH2      ARG  57  -6.307   9.137   7.940
  513   HH22  ARG  57          2HH2      ARG  57  -6.016   8.383   9.467
  514    H    ILE  58           H        ILE  58  -7.701   3.682   2.549
  515    HA   ILE  58           HA       ILE  58  -6.946   1.189   3.923
  516    HB   ILE  58           HB       ILE  58  -5.800   2.386   1.334
  517   HG12  ILE  58          2HG1      ILE  58  -7.966   0.236   1.568
  518   HG13  ILE  58          3HG1      ILE  58  -8.240   1.895   1.059
  519   HG21  ILE  58          1HG2      ILE  58  -4.917   0.107   0.933
  520   HG22  ILE  58          2HG2      ILE  58  -5.590  -0.433   2.472
  521   HG23  ILE  58          3HG2      ILE  58  -4.305   0.776   2.448
  522   HD11  ILE  58          3HD1      ILE  58  -6.585  -0.151  -0.416
  523   HD12  ILE  58          1HD1      ILE  58  -6.850   1.522  -0.922
  524   HD13  ILE  58          2HD1      ILE  58  -8.206   0.399  -0.833
  525    H    SER  59           H        SER  59  -5.167   1.269   5.251
  526    HA   SER  59           HA       SER  59  -3.363   3.622   5.216
  527    HB2  SER  59           2HB      SER  59  -4.247   1.978   7.645
  528    HB3  SER  59           3HB      SER  59  -3.197   3.398   7.665
  529    HG   SER  59           HG       SER  59  -5.948   3.277   6.988
  530    H    ILE  60           H        ILE  60  -1.626   2.811   4.170
  531    HA   ILE  60           HA       ILE  60  -0.692   0.054   4.646
  532    HB   ILE  60           HB       ILE  60   0.104   2.078   2.500
  533   HG12  ILE  60          2HG1      ILE  60  -1.648  -0.413   2.248
  534   HG13  ILE  60          3HG1      ILE  60  -2.247   1.240   2.277
  535   HG21  ILE  60          1HG2      ILE  60   1.956   0.550   2.978
  536   HG22  ILE  60          2HG2      ILE  60   1.270   0.200   1.392
  537   HG23  ILE  60          3HG2      ILE  60   0.889  -0.841   2.766
  538   HD11  ILE  60          3HD1      ILE  60  -2.214   0.382   0.034
  539   HD12  ILE  60          1HD1      ILE  60  -0.492   0.025   0.146
  540   HD13  ILE  60          2HD1      ILE  60  -1.054   1.699   0.183
  541    H    ARG  61           H        ARG  61   0.630  -0.005   6.368
  542    HA   ARG  61           HA       ARG  61   2.419   2.230   7.011
  543    HB2  ARG  61           2HB      ARG  61   0.722   0.622   8.580
  544    HB3  ARG  61           3HB      ARG  61   2.301  -0.068   8.908
  545    HG2  ARG  61           2HG      ARG  61   1.519   2.840   9.279
  546    HG3  ARG  61           3HG      ARG  61   1.656   1.636  10.557
  547    HD2  ARG  61           2HD      ARG  61   4.055   1.427  10.168
  548    HD3  ARG  61           3HD      ARG  61   3.956   2.527   8.787
  549    HE   ARG  61           HE       ARG  61   3.110   4.201  10.505
  550   HH11  ARG  61          1HH1      ARG  61   5.526   1.754  11.299
  551   HH12  ARG  61          2HH1      ARG  61   6.237   2.717  12.553
  552   HH21  ARG  61          1HH2      ARG  61   4.052   5.421  12.147
  553   HH22  ARG  61          2HH2      ARG  61   5.405   4.784  13.027
  554    H    VAL  62           H        VAL  62   4.360   2.079   6.135
  555    HA   VAL  62           HA       VAL  62   5.487  -0.468   5.219
  556    HB   VAL  62           HB       VAL  62   5.980   2.462   4.532
  557   HG11  VAL  62          1HG1      VAL  62   7.767   1.800   2.969
  558   HG12  VAL  62          2HG1      VAL  62   7.704   0.150   3.585
  559   HG13  VAL  62          3HG1      VAL  62   8.222   1.465   4.641
  560   HG21  VAL  62          3HG2      VAL  62   5.330   1.753   2.282
  561   HG22  VAL  62          1HG2      VAL  62   4.093   1.272   3.446
  562   HG23  VAL  62          2HG2      VAL  62   5.230   0.072   2.812
  563    H    LYS  63           H        LYS  63   7.111  -1.420   6.272
  564    HA   LYS  63           HA       LYS  63   8.442  -0.154   8.536
  565    HB2  LYS  63           2HB      LYS  63   7.545  -2.546   8.530
  566    HB3  LYS  63           3HB      LYS  63   8.803  -2.944   7.379
  567    HG2  LYS  63           2HG      LYS  63   9.554  -3.697   9.514
  568    HG3  LYS  63           3HG      LYS  63  10.509  -2.268   9.111
  569    HD2  LYS  63           2HD      LYS  63   9.840  -2.238  11.472
  570    HD3  LYS  63           3HD      LYS  63   9.101  -0.895  10.603
  571    HE2  LYS  63           2HE      LYS  63   7.451  -1.840  12.095
  572    HE3  LYS  63           3HE      LYS  63   6.977  -2.251  10.447
  573    HZ1  LYS  63           3HZ      LYS  63   6.703  -4.181  11.761
  574    HZ2  LYS  63           1HZ      LYS  63   8.226  -4.014  12.477
  575    HZ3  LYS  63           2HZ      LYS  63   8.102  -4.444  10.852
  576    H    HIS  64           H        HIS  64   9.998   1.278   7.826
  577    HA   HIS  64           HA       HIS  64  11.638   0.849   5.505
  578    HB2  HIS  64           2HB      HIS  64  11.858   2.868   7.779
  579    HB3  HIS  64           3HB      HIS  64  12.896   2.882   6.353
  580    HD1  HIS  64           HD1      HIS  64  10.159   4.705   7.523
  581    HD2  HIS  64           HD2      HIS  64  10.898   2.781   3.909
  582    HE1  HIS  64           HE1      HIS  64   8.658   5.822   5.842
  583    HE2  HIS  64           HE2      HIS  64   9.242   4.743   3.648
  584    H    SER  65           H        SER  65  13.853   0.323   5.423
  585    HA   SER  65           HA       SER  65  14.388  -2.023   6.879
  586    HB2  SER  65           2HB      SER  65  16.287  -0.480   5.056
  587    HB3  SER  65           3HB      SER  65  16.410  -2.189   5.490
  588    HG   SER  65           HG       SER  65  14.119  -1.112   4.194
  589    H    ASP  66           H        ASP  66  15.917   1.187   7.025
  590    HA   ASP  66           HA       ASP  66  17.239   0.479   9.553
  591    HB2  ASP  66           2HB      ASP  66  18.823  -0.061   7.685
  592    HB3  ASP  66           3HB      ASP  66  18.750   1.612   7.157
  593    H    ALA  67           H        ALA  67  17.988   2.329  10.785
  594    HA   ALA  67           HA       ALA  67  16.085   4.484  10.733
  595    HB1  ALA  67           3HB      ALA  67  16.810   3.417  12.823
  596    HB2  ALA  67           1HB      ALA  67  17.107   5.154  12.857
  597    HB3  ALA  67           2HB      ALA  67  18.446   4.031  12.588
  598    H    ALA  68           H        ALA  68  19.276   4.132   9.466
  599    HA   ALA  68           HA       ALA  68  19.722   6.998   9.155
  600    HB1  ALA  68           3HB      ALA  68  21.255   4.646   7.981
  601    HB2  ALA  68           1HB      ALA  68  21.660   5.524   9.456
  602    HB3  ALA  68           2HB      ALA  68  21.736   6.346   7.898
  603    H    GLU  69           H        GLU  69  18.819   4.195   7.157
  604    HA   GLU  69           HA       GLU  69  18.702   5.510   4.651
  605    HB2  GLU  69           2HB      GLU  69  17.343   2.949   5.590
  606    HB3  GLU  69           3HB      GLU  69  17.335   3.519   3.926
  607    HG2  GLU  69           2HG      GLU  69  19.894   3.412   4.027
  608    HG3  GLU  69           3HG      GLU  69  19.687   2.529   5.540
  609    H    GLU  70           H        GLU  70  16.351   5.137   7.217
  610    HA   GLU  70           HA       GLU  70  13.925   4.978   6.044
  611    HB2  GLU  70           2HB      GLU  70  12.986   6.039   8.079
  612    HB3  GLU  70           3HB      GLU  70  14.228   4.850   8.455
  613    HG2  GLU  70           2HG      GLU  70  15.824   6.519   9.010
  614    HG3  GLU  70           3HG      GLU  70  14.867   7.798   8.268
  615    H    LYS  71           H        LYS  71  15.703   8.032   6.424
  616    HA   LYS  71           HA       LYS  71  13.563   9.793   5.797
  617    HB2  LYS  71           2HB      LYS  71  15.342  11.533   5.592
  618    HB3  LYS  71           3HB      LYS  71  15.499  10.572   7.060
  619    HG2  LYS  71           2HG      LYS  71  17.294   9.226   5.965
  620    HG3  LYS  71           3HG      LYS  71  17.160  10.259   4.542
  621    HD2  LYS  71           2HD      LYS  71  19.066  10.973   5.860
  622    HD3  LYS  71           3HD      LYS  71  17.824  12.226   5.942
  623    HE2  LYS  71           2HE      LYS  71  18.866  11.844   8.142
  624    HE3  LYS  71           3HE      LYS  71  17.155  11.408   8.175
  625    HZ1  LYS  71           3HZ      LYS  71  19.399   9.487   7.845
  626    HZ2  LYS  71           1HZ      LYS  71  17.765   9.095   7.976
  627    HZ3  LYS  71           2HZ      LYS  71  18.575   9.774   9.293
  628    H    LYS  72           H        LYS  72  16.158   8.366   3.828
  629    HA   LYS  72           HA       LYS  72  15.280   9.513   1.326
  630    HB2  LYS  72           2HB      LYS  72  17.648   8.961   1.628
  631    HB3  LYS  72           3HB      LYS  72  17.260   7.293   2.027
  632    HG2  LYS  72           2HG      LYS  72  18.167   7.392  -0.218
  633    HG3  LYS  72           3HG      LYS  72  16.466   6.933  -0.303
  634    HD2  LYS  72           2HD      LYS  72  16.949   8.517  -2.073
  635    HD3  LYS  72           3HD      LYS  72  15.897   9.296  -0.892
  636    HE2  LYS  72           2HE      LYS  72  17.839  10.470   0.072
  637    HE3  LYS  72           3HE      LYS  72  18.909   9.664  -1.077
  638    HZ1  LYS  72           3HZ      LYS  72  16.728  11.568  -1.759
  639    HZ2  LYS  72           1HZ      LYS  72  17.699  10.760  -2.881
  640    HZ3  LYS  72           2HZ      LYS  72  18.388  11.882  -1.823
  641    H    GLU  73           H        GLU  73  14.791   6.546   3.155
  642    HA   GLU  73           HA       GLU  73  13.683   5.005   1.015
  643    HB2  GLU  73           2HB      GLU  73  14.926   4.092   3.075
  644    HB3  GLU  73           3HB      GLU  73  13.426   4.327   3.972
  645    HG2  GLU  73           2HG      GLU  73  12.246   2.804   2.467
  646    HG3  GLU  73           3HG      GLU  73  13.682   2.633   1.460
  647    H    ALA  74           H        ALA  74  12.436   7.342   3.172
  648    HA   ALA  74           HA       ALA  74   9.683   6.671   3.117
  649    HB1  ALA  74           3HB      ALA  74  11.015   9.399   3.335
  650    HB2  ALA  74           1HB      ALA  74  10.584   8.339   4.679
  651    HB3  ALA  74           2HB      ALA  74   9.318   9.049   3.676
  652    H    LYS  75           H        LYS  75  11.515   9.115   1.180
  653    HA   LYS  75           HA       LYS  75   9.474   9.506  -0.738
  654    HB2  LYS  75           2HB      LYS  75  11.339  11.135  -0.241
  655    HB3  LYS  75           3HB      LYS  75  12.453  10.078  -1.105
  656    HG2  LYS  75           2HG      LYS  75  11.131  10.387  -3.179
  657    HG3  LYS  75           3HG      LYS  75  10.017  11.443  -2.310
  658    HD2  LYS  75           2HD      LYS  75  11.853  13.060  -1.909
  659    HD3  LYS  75           3HD      LYS  75  12.980  11.991  -2.752
  660    HE2  LYS  75           2HE      LYS  75  10.571  13.381  -3.972
  661    HE3  LYS  75           3HE      LYS  75  12.268  13.782  -4.244
  662    HZ1  LYS  75           3HZ      LYS  75  12.576  11.586  -5.235
  663    HZ2  LYS  75           1HZ      LYS  75  11.394  12.472  -6.058
  664    HZ3  LYS  75           2HZ      LYS  75  10.939  11.238  -4.999
  665    H    LYS  76           H        LYS  76  12.024   7.151  -0.513
  666    HA   LYS  76           HA       LYS  76  12.124   6.085  -3.107
  667    HB2  LYS  76           2HB      LYS  76  13.739   5.343  -1.467
  668    HB3  LYS  76           3HB      LYS  76  12.477   4.798  -0.375
  669    HG2  LYS  76           2HG      LYS  76  11.902   2.971  -1.913
  670    HG3  LYS  76           3HG      LYS  76  13.137   3.511  -3.043
  671    HD2  LYS  76           2HD      LYS  76  13.745   2.591  -0.205
  672    HD3  LYS  76           3HD      LYS  76  13.758   1.513  -1.595
  673    HE2  LYS  76           2HE      LYS  76  16.029   2.110  -1.201
  674    HE3  LYS  76           3HE      LYS  76  15.529   3.046  -2.611
  675    HZ1  LYS  76           3HZ      LYS  76  16.812   4.341  -1.016
  676    HZ2  LYS  76           1HZ      LYS  76  15.642   4.081   0.172
  677    HZ3  LYS  76           2HZ      LYS  76  15.266   4.979  -1.216
  678    H    PHE  77           H        PHE  77  10.171   4.974  -0.315
  679    HA   PHE  77           HA       PHE  77   8.686   3.096  -1.934
  680    HB2  PHE  77           2HB      PHE  77   9.401   3.061   0.711
  681    HB3  PHE  77           3HB      PHE  77   7.764   3.681   0.879
  682    HD1  PHE  77           HD2      PHE  77   5.872   2.305  -0.332
  683    HD2  PHE  77           HD1      PHE  77   9.751   0.713   0.513
  684    HE1  PHE  77           HE2      PHE  77   4.991   0.020  -0.568
  685    HE2  PHE  77           HE1      PHE  77   8.856  -1.566   0.260
  686    HZ   PHE  77           HZ       PHE  77   6.480  -1.911  -0.277
  687    H    ALA  78           H        ALA  78   8.312   6.347  -0.852
  688    HA   ALA  78           HA       ALA  78   5.544   6.725  -1.229
  689    HB1  ALA  78           3HB      ALA  78   6.964   8.377  -0.079
  690    HB2  ALA  78           1HB      ALA  78   6.071   9.115  -1.411
  691    HB3  ALA  78           2HB      ALA  78   7.787   8.737  -1.598
  692    H    ALA  79           H        ALA  79   8.339   7.016  -3.399
  693    HA   ALA  79           HA       ALA  79   7.001   7.734  -5.767
  694    HB1  ALA  79           3HB      ALA  79   9.581   6.163  -5.422
  695    HB2  ALA  79           1HB      ALA  79   9.437   7.920  -5.445
  696    HB3  ALA  79           2HB      ALA  79   9.059   6.990  -6.894
  697    H    ILE  80           H        ILE  80   7.921   4.560  -4.429
  698    HA   ILE  80           HA       ILE  80   7.178   2.976  -6.640
  699    HB   ILE  80           HB       ILE  80   7.559   2.224  -3.707
  700   HG12  ILE  80          2HG1      ILE  80   9.597   3.054  -4.741
  701   HG13  ILE  80          3HG1      ILE  80   9.756   1.314  -4.556
  702   HG21  ILE  80          1HG2      ILE  80   6.131   0.506  -4.739
  703   HG22  ILE  80          2HG2      ILE  80   7.740  -0.134  -4.411
  704   HG23  ILE  80          3HG2      ILE  80   7.289   0.315  -6.056
  705   HD11  ILE  80          3HD1      ILE  80  10.652   2.046  -6.685
  706   HD12  ILE  80          1HD1      ILE  80   9.115   2.783  -7.129
  707   HD13  ILE  80          2HD1      ILE  80   9.240   1.030  -6.959
  708    H    LEU  81           H        LEU  81   5.403   3.675  -3.593
  709    HA   LEU  81           HA       LEU  81   3.124   2.116  -4.275
  710    HB2  LEU  81           2HB      LEU  81   3.826   4.024  -2.068
  711    HB3  LEU  81           3HB      LEU  81   2.111   3.823  -2.380
  712    HG   LEU  81           HG       LEU  81   4.000   1.508  -1.774
  713   HD11  LEU  81          1HD1      LEU  81   2.045   2.878   0.096
  714   HD12  LEU  81          2HD1      LEU  81   3.805   2.971   0.181
  715   HD13  LEU  81          3HD1      LEU  81   2.992   1.432   0.457
  716   HD21  LEU  81          3HD2      LEU  81   1.939   0.195  -1.464
  717   HD22  LEU  81          1HD2      LEU  81   2.050   0.833  -3.104
  718   HD23  LEU  81          2HD2      LEU  81   0.963   1.589  -1.935
  719    H    ASN  82           H        ASN  82   3.958   5.554  -4.716
  720    HA   ASN  82           HA       ASN  82   1.399   6.513  -5.476
  721    HB2  ASN  82           2HB      ASN  82   3.246   8.039  -4.849
  722    HB3  ASN  82           3HB      ASN  82   4.158   7.568  -6.280
  723   HD21  ASN  82          1HD2      ASN  82   3.639   8.523  -8.246
  724   HD22  ASN  82          2HD2      ASN  82   2.460   9.773  -8.417
  725    H    LYS  83           H        LYS  83   4.020   5.028  -7.320
  726    HA   LYS  83           HA       LYS  83   2.804   5.278  -9.897
  727    HB2  LYS  83           2HB      LYS  83   4.980   3.371  -8.928
  728    HB3  LYS  83           3HB      LYS  83   4.499   3.564 -10.611
  729    HG2  LYS  83           2HG      LYS  83   5.693   5.731  -8.863
  730    HG3  LYS  83           3HG      LYS  83   6.551   4.817 -10.103
  731    HD2  LYS  83           2HD      LYS  83   5.173   5.797 -11.859
  732    HD3  LYS  83           3HD      LYS  83   4.139   6.591 -10.668
  733    HE2  LYS  83           2HE      LYS  83   5.718   8.181 -11.671
  734    HE3  LYS  83           3HE      LYS  83   6.037   7.989  -9.949
  735    HZ1  LYS  83           3HZ      LYS  83   7.538   6.660 -12.136
  736    HZ2  LYS  83           1HZ      LYS  83   7.854   6.501 -10.486
  737    HZ3  LYS  83           2HZ      LYS  83   8.066   7.992 -11.246
  738    H    VAL  84           H        VAL  84   2.689   2.793  -7.350
  739    HA   VAL  84           HA       VAL  84   1.380   0.738  -8.832
  740    HB   VAL  84           HB       VAL  84   1.534   1.285  -5.825
  741   HG11  VAL  84          1HG1      VAL  84   0.718  -1.041  -5.461
  742   HG12  VAL  84          2HG1      VAL  84   0.355  -1.169  -7.184
  743   HG13  VAL  84          3HG1      VAL  84  -0.509  -0.001  -6.185
  744   HG21  VAL  84          3HG2      VAL  84   3.670   0.689  -6.892
  745   HG22  VAL  84          1HG2      VAL  84   2.951  -0.778  -7.557
  746   HG23  VAL  84          2HG2      VAL  84   3.137  -0.594  -5.810
  747    H    PHE  85           H        PHE  85   0.253   3.399  -6.839
  748    HA   PHE  85           HA       PHE  85  -2.539   2.970  -6.984
  749    HB2  PHE  85           2HB      PHE  85  -1.003   5.584  -6.631
  750    HB3  PHE  85           3HB      PHE  85  -2.725   5.387  -6.327
  751    HD1  PHE  85           HD1      PHE  85  -2.551   2.605  -4.973
  752    HD2  PHE  85           HD2      PHE  85  -0.339   6.226  -4.404
  753    HE1  PHE  85           HE1      PHE  85  -2.034   1.938  -2.661
  754    HE2  PHE  85           HE2      PHE  85   0.170   5.545  -2.098
  755    HZ   PHE  85           HZ       PHE  85  -0.669   3.403  -1.229
  756    H    ALA  86           H        ALA  86  -0.270   4.632  -9.106
  757    HA   ALA  86           HA       ALA  86  -2.192   5.630 -10.994
  758    HB1  ALA  86           3HB      ALA  86   0.010   6.677 -10.735
  759    HB2  ALA  86           1HB      ALA  86  -0.209   6.121 -12.394
  760    HB3  ALA  86           2HB      ALA  86   0.808   5.201 -11.279
  761    H    GLU  87           H        GLU  87  -0.557   2.551 -10.562
  762    HA   GLU  87           HA       GLU  87  -1.035   1.481 -13.182
  763    HB2  GLU  87           2HB      GLU  87  -0.611  -0.058 -10.579
  764    HB3  GLU  87           3HB      GLU  87  -0.508  -0.724 -12.201
  765    HG2  GLU  87           2HG      GLU  87   1.392   1.199 -10.875
  766    HG3  GLU  87           3HG      GLU  87   1.699  -0.463 -11.348
  767    H    LEU  88           H        LEU  88  -3.036   1.849 -10.340
  768    HA   LEU  88           HA       LEU  88  -4.870  -0.321 -11.194
  769    HB2  LEU  88           2HB      LEU  88  -4.414   0.766  -8.389
  770    HB3  LEU  88           3HB      LEU  88  -5.564  -0.489  -8.817
  771    HG   LEU  88           HG       LEU  88  -2.530  -0.706  -8.980
  772   HD11  LEU  88          1HD1      LEU  88  -2.742  -2.376  -7.201
  773   HD12  LEU  88          2HD1      LEU  88  -4.489  -2.125  -7.146
  774   HD13  LEU  88          3HD1      LEU  88  -3.393  -0.820  -6.687
  775   HD21  LEU  88          3HD2      LEU  88  -4.609  -2.793  -9.718
  776   HD22  LEU  88          1HD2      LEU  88  -2.866  -3.064  -9.620
  777   HD23  LEU  88          2HD2      LEU  88  -3.517  -1.960 -10.828
  778    H    GLY  89           H        GLY  89  -4.583   3.072 -10.565
  779    HA2  GLY  89           2HA      GLY  89  -6.098   4.532 -11.713
  780    HA3  GLY  89           3HA      GLY  89  -7.418   3.430 -11.370
  781    H    TYR  90           H        TYR  90  -5.433   3.884  -8.620
  782    HA   TYR  90           HA       TYR  90  -7.309   5.549  -7.220
  783    HB2  TYR  90           2HB      TYR  90  -4.428   4.876  -6.474
  784    HB3  TYR  90           3HB      TYR  90  -5.617   5.593  -5.400
  785    HD1  TYR  90           HD2      TYR  90  -7.518   4.200  -4.541
  786    HD2  TYR  90           HD1      TYR  90  -4.375   2.485  -6.877
  787    HE1  TYR  90           HE2      TYR  90  -8.158   1.952  -3.769
  788    HE2  TYR  90           HE1      TYR  90  -5.018   0.247  -6.099
  789    HH   TYR  90           HH       TYR  90  -7.926  -0.354  -4.410
  790    H    ASN  91           H        ASN  91  -7.421   7.711  -7.309
  791    HA   ASN  91           HA       ASN  91  -5.691   9.209  -9.096
  792    HB2  ASN  91           2HB      ASN  91  -8.084  10.135  -7.437
  793    HB3  ASN  91           3HB      ASN  91  -7.311  11.054  -8.726
  794   HD21  ASN  91          1HD2      ASN  91  -9.448   8.389  -7.991
  795   HD22  ASN  91          2HD2      ASN  91  -9.993   8.122  -9.604
  796    H    ASP  92           H        ASP  92  -4.768  11.325  -8.464
  797    HA   ASP  92           HA       ASP  92  -3.105  11.422  -6.275
  798    HB2  ASP  92           2HB      ASP  92  -2.747  12.932  -8.100
  799    HB3  ASP  92           3HB      ASP  92  -4.354  13.628  -7.953
  800    H    SER  93           H        SER  93  -6.371  12.762  -6.558
  801    HA   SER  93           HA       SER  93  -6.587  13.955  -4.000
  802    HB2  SER  93           2HB      SER  93  -8.027  14.562  -5.924
  803    HB3  SER  93           3HB      SER  93  -8.786  12.973  -5.875
  804    HG   SER  93           HG       SER  93  -8.876  14.306  -3.472
  805    H    ASN  94           H        ASN  94  -6.442  10.683  -4.777
  806    HA   ASN  94           HA       ASN  94  -8.025   9.814  -2.441
  807    HB2  ASN  94           2HB      ASN  94  -6.947   8.141  -4.748
  808    HB3  ASN  94           3HB      ASN  94  -7.943   7.550  -3.422
  809   HD21  ASN  94          1HD2      ASN  94  -9.749   9.902  -3.448
  810   HD22  ASN  94          2HD2      ASN  94 -10.709   9.730  -4.874
  811    H    VAL  95           H        VAL  95  -4.845  10.488  -3.350
  812    HA   VAL  95           HA       VAL  95  -3.667   8.461  -1.526
  813    HB   VAL  95           HB       VAL  95  -2.302  10.013  -3.799
  814   HG11  VAL  95          1HG1      VAL  95  -0.370   8.522  -3.444
  815   HG12  VAL  95          2HG1      VAL  95  -1.185   7.758  -2.080
  816   HG13  VAL  95          3HG1      VAL  95  -0.713   9.455  -1.985
  817   HG21  VAL  95          3HG2      VAL  95  -3.919   8.357  -4.654
  818   HG22  VAL  95          1HG2      VAL  95  -3.136   7.088  -3.713
  819   HG23  VAL  95          2HG2      VAL  95  -2.264   7.879  -5.029
  820    H    THR  96           H        THR  96  -3.353   9.354   0.449
  821    HA   THR  96           HA       THR  96  -2.036  12.012   0.639
  822    HB   THR  96           HB       THR  96  -3.784  10.777   2.817
  823    HG1  THR  96           HG1      THR  96  -5.343  11.232   1.452
  824   HG21  THR  96          3HG2      THR  96  -3.863  13.068   3.707
  825   HG22  THR  96          1HG2      THR  96  -2.848  13.639   2.383
  826   HG23  THR  96          2HG2      THR  96  -2.191  12.520   3.579
  827    H    TRP  97           H        TRP  97   0.105  11.337   0.762
  828    HA   TRP  97           HA       TRP  97   0.973   9.124   2.384
  829    HB2  TRP  97           2HB      TRP  97   2.238  10.970   0.435
  830    HB3  TRP  97           3HB      TRP  97   3.293  10.658   1.805
  831    HD1  TRP  97           HD1      TRP  97   2.344   9.155  -1.458
  832    HE1  TRP  97           HE1      TRP  97   3.279   6.765  -1.645
  833    HE3  TRP  97           HE3      TRP  97   3.643   8.387   3.442
  834    HZ2  TRP  97           HZ2      TRP  97   4.417   4.817   0.052
  835    HZ3  TRP  97           HZ3      TRP  97   4.643   6.229   4.074
  836    HH2  TRP  97           HH2      TRP  97   5.030   4.480   2.415
  837    H    ASP  98           H        ASP  98   2.281   9.197   4.268
  838    HA   ASP  98           HA       ASP  98   2.714  11.640   5.750
  839    HB2  ASP  98           2HB      ASP  98   0.262  11.169   6.153
  840    HB3  ASP  98           3HB      ASP  98   0.704   9.625   6.868
  841    H    GLY  99           H        GLY  99   4.825  10.761   5.450
  842    HA2  GLY  99           2HA      GLY  99   6.754  10.031   6.433
  843    HA3  GLY  99           3HA      GLY  99   5.806   9.533   7.824
  844    H    ASP 100           H        ASP 100   5.363   7.394   8.109
  845    HA   ASP 100           HA       ASP 100   6.566   5.419   6.297
  846    HB2  ASP 100           2HB      ASP 100   5.358   5.180   9.088
  847    HB3  ASP 100           3HB      ASP 100   5.886   3.778   8.164
  848    H    THR 101           H        THR 101   3.466   6.765   6.893
  849    HA   THR 101           HA       THR 101   2.041   4.337   5.952
  850    HB   THR 101           HB       THR 101   0.886   6.576   7.689
  851    HG1  THR 101           HG1      THR 101   2.060   5.652   9.180
  852   HG21  THR 101          3HG2      THR 101  -0.799   5.269   6.413
  853   HG22  THR 101          1HG2      THR 101  -0.911   4.954   8.146
  854   HG23  THR 101          2HG2      THR 101  -0.145   3.772   7.084
  855    H    VAL 102           H        VAL 102   1.051   4.583   3.968
  856    HA   VAL 102           HA       VAL 102   0.215   7.303   3.138
  857    HB   VAL 102           HB       VAL 102   1.440   6.039   1.398
  858   HG11  VAL 102          1HG1      VAL 102  -0.840   4.057   1.428
  859   HG12  VAL 102          2HG1      VAL 102   0.816   3.748   1.950
  860   HG13  VAL 102          3HG1      VAL 102   0.479   4.099   0.254
  861   HG21  VAL 102          3HG2      VAL 102  -0.130   6.437  -0.469
  862   HG22  VAL 102          1HG2      VAL 102  -0.202   7.740   0.721
  863   HG23  VAL 102          2HG2      VAL 102  -1.473   6.517   0.674
  864    H    THR 103           H        THR 103  -1.845   7.833   3.222
  865    HA   THR 103           HA       THR 103  -3.871   5.864   4.036
  866    HB   THR 103           HB       THR 103  -3.944   8.899   4.374
  867    HG1  THR 103           HG1      THR 103  -2.228   7.476   5.535
  868   HG21  THR 103          3HG2      THR 103  -5.523   6.668   5.723
  869   HG22  THR 103          1HG2      THR 103  -6.148   7.780   4.501
  870   HG23  THR 103          2HG2      THR 103  -5.656   8.391   6.079
  871    H    VAL 104           H        VAL 104  -4.768   5.184   2.197
  872    HA   VAL 104           HA       VAL 104  -5.327   6.955  -0.050
  873    HB   VAL 104           HB       VAL 104  -5.749   3.925   0.202
  874   HG11  VAL 104          1HG1      VAL 104  -5.656   5.708  -2.261
  875   HG12  VAL 104          2HG1      VAL 104  -7.094   4.942  -1.581
  876   HG13  VAL 104          3HG1      VAL 104  -5.809   3.949  -2.270
  877   HG21  VAL 104          3HG2      VAL 104  -3.360   5.388  -0.988
  878   HG22  VAL 104          1HG2      VAL 104  -3.629   3.642  -1.026
  879   HG23  VAL 104          2HG2      VAL 104  -3.366   4.463   0.513
  880    H    GLU 105           H        GLU 105  -7.208   8.035   0.155
  881    HA   GLU 105           HA       GLU 105  -9.600   6.745   1.349
  882    HB2  GLU 105           2HB      GLU 105  -8.775   9.692   1.466
  883    HB3  GLU 105           3HB      GLU 105 -10.234   8.999   2.171
  884    HG2  GLU 105           2HG      GLU 105  -8.868   7.671   3.726
  885    HG3  GLU 105           3HG      GLU 105  -7.401   8.319   2.997
  886    H    GLY 106           H        GLY 106 -11.015   6.390  -0.307
  887    HA2  GLY 106           2HA      GLY 106 -11.593   8.399  -2.286
  888    HA3  GLY 106           3HA      GLY 106 -10.622   7.073  -2.921
  889    H    GLN 107           H        GLN 107 -12.477   6.938  -4.310
  890    HA   GLN 107           HA       GLN 107 -14.851   5.576  -3.213
  891    HB2  GLN 107           2HB      GLN 107 -15.925   6.204  -5.377
  892    HB3  GLN 107           3HB      GLN 107 -15.316   7.611  -4.518
  893    HG2  GLN 107           2HG      GLN 107 -13.275   7.539  -6.015
  894    HG3  GLN 107           3HG      GLN 107 -14.081   6.283  -6.951
  895   HE21  GLN 107          1HE2      GLN 107 -13.197   8.938  -7.822
  896   HE22  GLN 107          2HE2      GLN 107 -14.612   9.737  -8.416
  897    H    LEU 108           H        LEU 108 -15.458   3.597  -3.986
  898    HA   LEU 108           HA       LEU 108 -13.544   1.912  -5.330
  899    HB2  LEU 108           2HB      LEU 108 -16.374   1.424  -4.334
  900    HB3  LEU 108           3HB      LEU 108 -15.436   0.187  -5.161
  901    HG   LEU 108           HG       LEU 108 -14.722   1.490  -2.509
  902   HD11  LEU 108          1HD1      LEU 108 -15.101  -0.728  -1.550
  903   HD12  LEU 108          2HD1      LEU 108 -15.603  -1.341  -3.125
  904   HD13  LEU 108          3HD1      LEU 108 -16.562  -0.104  -2.313
  905   HD21  LEU 108          3HD2      LEU 108 -12.846  -0.096  -2.427
  906   HD22  LEU 108          1HD2      LEU 108 -12.695   1.020  -3.781
  907   HD23  LEU 108          2HD2      LEU 108 -13.224  -0.640  -4.064
  908    H    GLU 109           H        GLU 109 -13.977   0.756  -7.201
  909    HA   GLU 109           HA       GLU 109 -15.230   2.111  -9.406
  910    HB2  GLU 109           2HB      GLU 109 -14.394   0.009 -10.649
  911    HB3  GLU 109           3HB      GLU 109 -13.161   0.986  -9.857
  912    HG2  GLU 109           2HG      GLU 109 -13.178  -0.599  -7.929
  913    HG3  GLU 109           3HG      GLU 109 -14.355  -1.585  -8.783
  914    H    GLY 110           H        GLY 110 -17.434   2.133  -8.502
  915    HA2  GLY 110           2HA      GLY 110 -18.930  -0.434  -8.804
  916    HA3  GLY 110           3HA      GLY 110 -19.251   0.705  -7.504
  917    H    VAL 111           H        VAL 111 -19.521   3.086  -8.453
  918    HA   VAL 111           HA       VAL 111 -21.914   3.085 -10.012
  919    HB   VAL 111           HB       VAL 111 -20.073   5.451  -9.399
  920   HG11  VAL 111          1HG1      VAL 111 -22.049   6.884  -9.766
  921   HG12  VAL 111          2HG1      VAL 111 -23.004   5.477 -10.231
  922   HG13  VAL 111          3HG1      VAL 111 -21.636   5.983 -11.224
  923   HG21  VAL 111          3HG2      VAL 111 -21.536   5.930  -7.482
  924   HG22  VAL 111          1HG2      VAL 111 -20.791   4.338  -7.333
  925   HG23  VAL 111          2HG2      VAL 111 -22.481   4.477  -7.823
  926    H    ASP 112           H        ASP 112 -18.559   3.991 -10.635
  927    HA   ASP 112           HA       ASP 112 -18.886   4.349 -13.492
  928    HB2  ASP 112           2HB      ASP 112 -17.191   5.642 -12.082
  929    HB3  ASP 112           3HB      ASP 112 -16.275   4.146 -11.905
  930    H    LEU 113           H        LEU 113 -18.981   2.704 -14.836
  931    HA   LEU 113           HA       LEU 113 -18.436  -0.021 -13.955
  932    HB2  LEU 113           2HB      LEU 113 -19.625   0.960 -16.575
  933    HB3  LEU 113           3HB      LEU 113 -19.641  -0.695 -15.983
  934    HG   LEU 113           HG       LEU 113 -21.121   1.648 -14.717
  935   HD11  LEU 113          1HD1      LEU 113 -22.124   0.979 -16.846
  936   HD12  LEU 113          2HD1      LEU 113 -23.173   0.563 -15.496
  937   HD13  LEU 113          3HD1      LEU 113 -22.228  -0.697 -16.294
  938   HD21  LEU 113          3HD2      LEU 113 -20.440   0.049 -13.001
  939   HD22  LEU 113          1HD2      LEU 113 -21.149  -1.283 -13.920
  940   HD23  LEU 113          2HD2      LEU 113 -22.181  -0.019 -13.248
  941    H    GLU 114           H        GLU 114 -16.740   2.375 -15.645
  942    HA   GLU 114           HA       GLU 114 -15.350   0.608 -17.504
  943    HB2  GLU 114           2HB      GLU 114 -14.891   3.572 -16.956
  944    HB3  GLU 114           3HB      GLU 114 -14.271   2.651 -18.320
  945    HG2  GLU 114           2HG      GLU 114 -17.162   3.357 -17.767
  946    HG3  GLU 114           3HG      GLU 114 -16.139   4.015 -19.040
  947    H    HIS 115           H        HIS 115 -14.778  -0.553 -15.327
  948    HA   HIS 115           HA       HIS 115 -12.376   0.179 -13.996
  949    HB2  HIS 115           2HB      HIS 115 -13.820  -1.637 -13.142
  950    HB3  HIS 115           3HB      HIS 115 -13.569  -2.571 -14.612
  951    HD1  HIS 115           HD1      HIS 115 -12.570  -4.581 -13.323
  952    HD2  HIS 115           HD2      HIS 115 -10.491  -1.045 -12.700
  953    HE1  HIS 115           HE1      HIS 115 -10.479  -5.230 -12.097
  954    HE2  HIS 115           HE2      HIS 115  -9.380  -3.052 -11.534
  955    H    HIS 116           H        HIS 116 -10.283   0.018 -14.696
  956    HA   HIS 116           HA       HIS 116  -9.735  -0.105 -17.456
  957    HB2  HIS 116           2HB      HIS 116  -7.916  -0.026 -15.036
  958    HB3  HIS 116           3HB      HIS 116  -7.269  -0.105 -16.670
  959    HD1  HIS 116           HD1      HIS 116  -8.465   2.264 -14.158
  960    HD2  HIS 116           HD2      HIS 116  -7.992   2.222 -18.288
  961    HE1  HIS 116           HE1      HIS 116  -8.506   4.671 -14.864
  962    HE2  HIS 116           HE2      HIS 116  -8.076   4.618 -17.339
  963    H    HIS 117           H        HIS 117 -10.358  -1.988 -18.334
  964    HA   HIS 117           HA       HIS 117  -9.340  -4.594 -17.574
  965    HB2  HIS 117           2HB      HIS 117 -10.784  -3.662 -20.103
  966    HB3  HIS 117           3HB      HIS 117 -10.463  -5.345 -19.686
  967    HD1  HIS 117           HD1      HIS 117 -12.971  -2.710 -19.265
  968    HD2  HIS 117           HD2      HIS 117 -11.888  -6.177 -17.238
  969    HE1  HIS 117           HE1      HIS 117 -14.935  -3.283 -17.803
  970    HE2  HIS 117           HE2      HIS 117 -14.302  -5.449 -16.696
  971    H    HIS 118           H        HIS 118  -7.727  -5.762 -18.753
  972    HA   HIS 118           HA       HIS 118  -5.633  -4.115 -19.893
  973    HB2  HIS 118           2HB      HIS 118  -4.258  -6.117 -19.891
  974    HB3  HIS 118           3HB      HIS 118  -5.115  -6.029 -18.365
  975    HD1  HIS 118           HD1      HIS 118  -6.906  -7.853 -17.908
  976    HD2  HIS 118           HD2      HIS 118  -4.835  -8.349 -21.474
  977    HE1  HIS 118           HE1      HIS 118  -7.379 -10.201 -18.636
  978    HE2  HIS 118           HE2      HIS 118  -6.298 -10.395 -20.894
  979    H    HIS 119           H        HIS 119  -4.573  -4.767 -21.972
  980    HA   HIS 119           HA       HIS 119  -6.273  -4.088 -24.037
  981    HB2  HIS 119           2HB      HIS 119  -3.855  -3.676 -24.171
  982    HB3  HIS 119           3HB      HIS 119  -3.529  -5.403 -24.234
  983    HD1  HIS 119           HD1      HIS 119  -4.642  -2.529 -26.370
  984    HD2  HIS 119           HD2      HIS 119  -3.973  -6.608 -26.770
  985    HE1  HIS 119           HE1      HIS 119  -4.626  -2.976 -28.838
  986    HE2  HIS 119           HE2      HIS 119  -4.419  -5.469 -29.038
  987    H    HIS 120           H        HIS 120  -7.777  -5.144 -25.049
  988    HA   HIS 120           HA       HIS 120  -7.886  -8.050 -25.279
  989    HB2  HIS 120           2HB      HIS 120  -9.781  -5.865 -26.261
  990    HB3  HIS 120           3HB      HIS 120 -10.068  -7.589 -26.485
  991    HD1  HIS 120           HD1      HIS 120 -11.245  -8.776 -24.628
  992    HD2  HIS 120           HD2      HIS 120  -9.773  -5.075 -23.438
  993    HE1  HIS 120           HE1      HIS 120 -12.144  -8.400 -22.317
  994    HE2  HIS 120           HE2      HIS 120 -11.405  -6.074 -21.714
  Start of MODEL   14
    1    H1   MET   1           1H       MET   1  21.559  -1.330   1.017
    2    H2   MET   1           2H       MET   1  21.973  -1.069  -0.596
    3    H3   MET   1           3H       MET   1  22.788  -2.243   0.301
    4    HA   MET   1           HA       MET   1  21.221  -3.239  -1.207
    5    HB2  MET   1           2HB      MET   1  20.440  -3.428   1.734
    6    HB3  MET   1           3HB      MET   1  19.913  -4.565   0.502
    7    HG2  MET   1           2HG      MET   1  22.240  -5.254   0.130
    8    HG3  MET   1           3HG      MET   1  22.780  -4.093   1.348
    9    HE1  MET   1           3HE      MET   1  23.309  -7.508   3.214
   10    HE2  MET   1           1HE      MET   1  24.048  -5.963   2.799
   11    HE3  MET   1           2HE      MET   1  23.642  -7.118   1.527
   12    H    SER   2           H        SER   2  19.709  -2.406  -2.525
   13    HA   SER   2           HA       SER   2  17.835  -0.372  -1.686
   14    HB2  SER   2           2HB      SER   2  18.886  -0.232  -3.900
   15    HB3  SER   2           3HB      SER   2  18.189  -1.781  -4.367
   16    HG   SER   2           HG       SER   2  16.281  -0.872  -4.640
   17    H    GLY   3           H        GLY   3  17.550  -3.709  -2.958
   18    HA2  GLY   3           2HA      GLY   3  14.678  -3.855  -2.523
   19    HA3  GLY   3           3HA      GLY   3  15.727  -5.128  -3.130
   20    H    LYS   4           H        LYS   4  14.234  -3.767  -0.347
   21    HA   LYS   4           HA       LYS   4  15.518  -5.732   1.462
   22    HB2  LYS   4           2HB      LYS   4  14.455  -2.935   2.009
   23    HB3  LYS   4           3HB      LYS   4  14.866  -4.057   3.295
   24    HG2  LYS   4           2HG      LYS   4  16.910  -3.224   1.215
   25    HG3  LYS   4           3HG      LYS   4  16.586  -2.245   2.641
   26    HD2  LYS   4           2HD      LYS   4  18.507  -3.566   3.162
   27    HD3  LYS   4           3HD      LYS   4  17.170  -4.269   4.064
   28    HE2  LYS   4           2HE      LYS   4  17.001  -6.084   2.399
   29    HE3  LYS   4           3HE      LYS   4  18.303  -5.354   1.460
   30    HZ1  LYS   4           3HZ      LYS   4  19.162  -7.137   2.777
   31    HZ2  LYS   4           1HZ      LYS   4  18.517  -6.482   4.196
   32    HZ3  LYS   4           2HZ      LYS   4  19.766  -5.680   3.389
   33    H    LYS   5           H        LYS   5  14.133  -6.227   3.410
   34    HA   LYS   5           HA       LYS   5  11.512  -7.123   2.513
   35    HB2  LYS   5           2HB      LYS   5  13.158  -8.658   3.673
   36    HB3  LYS   5           3HB      LYS   5  12.937  -7.721   5.140
   37    HG2  LYS   5           2HG      LYS   5  10.497  -8.900   3.819
   38    HG3  LYS   5           3HG      LYS   5  11.579  -9.990   4.677
   39    HD2  LYS   5           2HD      LYS   5  10.162  -7.573   5.881
   40    HD3  LYS   5           3HD      LYS   5   9.710  -9.266   6.111
   41    HE2  LYS   5           2HE      LYS   5  11.975  -9.663   7.148
   42    HE3  LYS   5           3HE      LYS   5  12.269  -7.924   7.053
   43    HZ1  LYS   5           3HZ      LYS   5  10.317  -7.586   8.466
   44    HZ2  LYS   5           1HZ      LYS   5  11.480  -8.544   9.230
   45    HZ3  LYS   5           2HZ      LYS   5  10.095  -9.252   8.577
   46    H    VAL   6           H        VAL   6  10.210  -5.463   2.527
   47    HA   VAL   6           HA       VAL   6   9.877  -3.678   4.850
   48    HB   VAL   6           HB       VAL   6   9.937  -2.247   2.963
   49   HG11  VAL   6          1HG1      VAL   6   8.953  -2.718   0.742
   50   HG12  VAL   6          2HG1      VAL   6   8.340  -4.267   1.330
   51   HG13  VAL   6          3HG1      VAL   6  10.078  -3.995   1.215
   52   HG21  VAL   6          3HG2      VAL   6   6.984  -2.948   3.101
   53   HG22  VAL   6          1HG2      VAL   6   7.672  -1.453   2.455
   54   HG23  VAL   6          2HG2      VAL   6   7.833  -1.833   4.171
   55    H    GLU   7           H        GLU   7   8.010  -3.767   6.048
   56    HA   GLU   7           HA       GLU   7   6.030  -5.855   5.346
   57    HB2  GLU   7           2HB      GLU   7   6.937  -4.824   8.054
   58    HB3  GLU   7           3HB      GLU   7   5.447  -5.738   7.849
   59    HG2  GLU   7           2HG      GLU   7   6.750  -7.622   6.884
   60    HG3  GLU   7           3HG      GLU   7   8.234  -6.710   7.146
   61    H    VAL   8           H        VAL   8   4.279  -5.131   4.580
   62    HA   VAL   8           HA       VAL   8   3.529  -2.293   4.677
   63    HB   VAL   8           HB       VAL   8   2.749  -4.551   2.759
   64   HG11  VAL   8          1HG1      VAL   8   0.941  -2.879   2.866
   65   HG12  VAL   8          2HG1      VAL   8   1.754  -2.837   1.300
   66   HG13  VAL   8          3HG1      VAL   8   2.099  -1.596   2.504
   67   HG21  VAL   8          3HG2      VAL   8   4.214  -3.452   1.119
   68   HG22  VAL   8          1HG2      VAL   8   5.126  -3.895   2.565
   69   HG23  VAL   8          2HG2      VAL   8   4.644  -2.215   2.303
   70    H    GLN   9           H        GLN   9   2.022  -1.873   6.229
   71    HA   GLN   9           HA       GLN   9   0.185  -3.997   7.142
   72    HB2  GLN   9           2HB      GLN   9   0.721  -1.273   8.414
   73    HB3  GLN   9           3HB      GLN   9  -0.136  -2.630   9.144
   74    HG2  GLN   9           2HG      GLN   9   1.982  -3.931   9.156
   75    HG3  GLN   9           3HG      GLN   9   2.819  -2.549   8.451
   76   HE21  GLN   9          1HE2      GLN   9   4.239  -2.373  10.228
   77   HE22  GLN   9          2HE2      GLN   9   3.713  -1.791  11.769
   78    H    VAL  10           H        VAL  10  -1.535  -4.004   5.814
   79    HA   VAL  10           HA       VAL  10  -2.651  -1.525   4.709
   80    HB   VAL  10           HB       VAL  10  -3.274  -4.456   4.090
   81   HG11  VAL  10          1HG1      VAL  10  -4.513  -3.622   2.116
   82   HG12  VAL  10          2HG1      VAL  10  -4.251  -1.962   2.654
   83   HG13  VAL  10          3HG1      VAL  10  -5.238  -3.056   3.624
   84   HG21  VAL  10          3HG2      VAL  10  -0.997  -3.810   3.382
   85   HG22  VAL  10          1HG2      VAL  10  -1.655  -2.440   2.478
   86   HG23  VAL  10          2HG2      VAL  10  -2.036  -4.092   1.983
   87    H    LYS  11           H        LYS  11  -3.984  -0.548   6.108
   88    HA   LYS  11           HA       LYS  11  -5.951  -2.050   7.737
   89    HB2  LYS  11           2HB      LYS  11  -4.497  -0.555   9.037
   90    HB3  LYS  11           3HB      LYS  11  -4.795   0.775   7.923
   91    HG2  LYS  11           2HG      LYS  11  -7.253   0.666   8.672
   92    HG3  LYS  11           3HG      LYS  11  -6.712  -0.403   9.968
   93    HD2  LYS  11           2HD      LYS  11  -5.638   2.408   9.499
   94    HD3  LYS  11           3HD      LYS  11  -6.941   2.027  10.623
   95    HE2  LYS  11           2HE      LYS  11  -4.173   0.796  10.839
   96    HE3  LYS  11           3HE      LYS  11  -4.639   2.288  11.656
   97    HZ1  LYS  11           3HZ      LYS  11  -6.413   1.062  12.770
   98    HZ2  LYS  11           1HZ      LYS  11  -4.896   0.416  13.125
   99    HZ3  LYS  11           2HZ      LYS  11  -5.909  -0.369  12.029
  100    H    ILE  12           H        ILE  12  -7.757  -2.298   6.405
  101    HA   ILE  12           HA       ILE  12  -8.631   0.029   4.807
  102    HB   ILE  12           HB       ILE  12  -7.903  -1.670   3.283
  103   HG12  ILE  12          2HG1      ILE  12 -10.953  -1.641   3.365
  104   HG13  ILE  12          3HG1      ILE  12  -9.940  -0.380   2.672
  105   HG21  ILE  12          1HG2      ILE  12  -8.822  -3.953   3.174
  106   HG22  ILE  12          2HG2      ILE  12  -9.761  -3.650   4.637
  107   HG23  ILE  12          3HG2      ILE  12  -7.999  -3.661   4.710
  108   HD11  ILE  12          3HD1      ILE  12 -10.860  -1.748   0.943
  109   HD12  ILE  12          1HD1      ILE  12 -10.205  -3.210   1.682
  110   HD13  ILE  12          2HD1      ILE  12  -9.117  -1.991   1.014
  111    H    THR  13           H        THR  13 -10.419   0.945   5.484
  112    HA   THR  13           HA       THR  13 -12.327  -0.513   7.171
  113    HB   THR  13           HB       THR  13 -12.209   2.489   6.612
  114    HG1  THR  13           HG1      THR  13 -11.191   2.485   8.766
  115   HG21  THR  13          3HG2      THR  13 -13.535   2.678   8.690
  116   HG22  THR  13          1HG2      THR  13 -13.549   0.921   8.857
  117   HG23  THR  13          2HG2      THR  13 -14.388   1.686   7.505
  118    H    CYS  14           H        CYS  14 -13.680  -1.612   5.874
  119    HA   CYS  14           HA       CYS  14 -15.148  -0.254   3.687
  120    HB2  CYS  14           2HB      CYS  14 -13.728  -2.054   2.811
  121    HB3  CYS  14           3HB      CYS  14 -14.392  -3.188   3.982
  122    H    ASN  15           H        ASN  15 -17.269  -0.076   4.015
  123    HA   ASN  15           HA       ASN  15 -19.327  -0.083   4.928
  124    HB2  ASN  15           2HB      ASN  15 -18.665  -3.013   5.439
  125    HB3  ASN  15           3HB      ASN  15 -20.273  -2.325   5.641
  126   HD21  ASN  15          1HD2      ASN  15 -19.328  -4.424   3.807
  127   HD22  ASN  15          2HD2      ASN  15 -19.764  -3.885   2.227
  128    H    GLY  16           H        GLY  16 -17.030   0.637   6.599
  129    HA2  GLY  16           2HA      GLY  16 -16.782   1.514   8.712
  130    HA3  GLY  16           3HA      GLY  16 -18.348   0.862   9.161
  131    H    LYS  17           H        LYS  17 -16.324  -1.502   7.806
  132    HA   LYS  17           HA       LYS  17 -15.480  -2.563  10.446
  133    HB2  LYS  17           2HB      LYS  17 -15.953  -3.972   7.774
  134    HB3  LYS  17           3HB      LYS  17 -15.219  -4.750   9.175
  135    HG2  LYS  17           2HG      LYS  17 -17.329  -4.360  10.462
  136    HG3  LYS  17           3HG      LYS  17 -18.053  -3.667   9.006
  137    HD2  LYS  17           2HD      LYS  17 -18.708  -6.042   9.330
  138    HD3  LYS  17           3HD      LYS  17 -17.823  -5.797   7.824
  139    HE2  LYS  17           2HE      LYS  17 -17.056  -7.844   8.905
  140    HE3  LYS  17           3HE      LYS  17 -15.753  -6.651   8.939
  141    HZ1  LYS  17           3HZ      LYS  17 -16.321  -6.168  11.237
  142    HZ2  LYS  17           1HZ      LYS  17 -15.968  -7.811  11.041
  143    HZ3  LYS  17           2HZ      LYS  17 -17.572  -7.300  11.199
  144    H    THR  18           H        THR  18 -13.310  -2.910  10.789
  145    HA   THR  18           HA       THR  18 -11.458  -1.796   8.754
  146    HB   THR  18           HB       THR  18 -11.118  -1.940  11.787
  147    HG1  THR  18           HG1      THR  18 -11.634   0.324  10.127
  148   HG21  THR  18          3HG2      THR  18  -9.223  -0.373  11.418
  149   HG22  THR  18          1HG2      THR  18  -9.421  -0.551   9.676
  150   HG23  THR  18          2HG2      THR  18  -8.929  -1.938  10.656
  151    H    TYR  19           H        TYR  19 -10.226  -3.255   7.787
  152    HA   TYR  19           HA       TYR  19  -9.486  -5.815   9.084
  153    HB2  TYR  19           2HB      TYR  19  -9.491  -5.228   6.078
  154    HB3  TYR  19           3HB      TYR  19  -9.345  -6.795   6.859
  155    HD1  TYR  19           HD2      TYR  19 -11.701  -4.140   5.809
  156    HD2  TYR  19           HD1      TYR  19 -11.366  -7.974   7.684
  157    HE1  TYR  19           HE2      TYR  19 -14.127  -4.469   5.564
  158    HE2  TYR  19           HE1      TYR  19 -13.792  -8.299   7.430
  159    HH   TYR  19           HH       TYR  19 -15.723  -6.391   5.437
  160    H    GLU  20           H        GLU  20  -7.480  -5.291   9.990
  161    HA   GLU  20           HA       GLU  20  -5.458  -4.066   8.198
  162    HB2  GLU  20           2HB      GLU  20  -4.327  -3.121  10.137
  163    HB3  GLU  20           3HB      GLU  20  -5.989  -2.558  10.053
  164    HG2  GLU  20           2HG      GLU  20  -6.600  -4.165  11.846
  165    HG3  GLU  20           3HG      GLU  20  -4.912  -4.667  11.947
  166    H    ARG  21           H        ARG  21  -3.591  -5.085   7.874
  167    HA   ARG  21           HA       ARG  21  -2.677  -7.297   9.512
  168    HB2  ARG  21           2HB      ARG  21  -4.317  -8.481   8.128
  169    HB3  ARG  21           3HB      ARG  21  -3.664  -7.765   6.657
  170    HG2  ARG  21           2HG      ARG  21  -1.553  -9.017   6.987
  171    HG3  ARG  21           3HG      ARG  21  -2.208  -9.733   8.460
  172    HD2  ARG  21           2HD      ARG  21  -3.882 -10.940   7.209
  173    HD3  ARG  21           3HD      ARG  21  -3.475 -10.066   5.726
  174    HE   ARG  21           HE       ARG  21  -1.292 -11.578   6.891
  175   HH11  ARG  21          1HH1      ARG  21  -3.999 -11.728   4.634
  176   HH12  ARG  21          2HH1      ARG  21  -3.325 -13.049   3.732
  177   HH21  ARG  21          1HH2      ARG  21  -0.391 -13.240   5.661
  178   HH22  ARG  21          2HH2      ARG  21  -1.268 -13.907   4.319
  179    H    THR  22           H        THR  22  -0.542  -7.658   9.280
  180    HA   THR  22           HA       THR  22   1.053  -5.820   7.671
  181    HB   THR  22           HB       THR  22   1.863  -7.811   9.844
  182    HG1  THR  22           HG1      THR  22   2.122  -5.371  10.746
  183   HG21  THR  22          3HG2      THR  22   3.408  -5.482   8.653
  184   HG22  THR  22          1HG2      THR  22   3.750  -7.193   8.371
  185   HG23  THR  22          2HG2      THR  22   3.944  -6.507   9.984
  186    H    TYR  23           H        TYR  23   1.777  -6.489   5.724
  187    HA   TYR  23           HA       TYR  23   2.045  -9.365   5.078
  188    HB2  TYR  23           2HB      TYR  23   1.835  -6.933   3.234
  189    HB3  TYR  23           3HB      TYR  23   1.991  -8.600   2.690
  190    HD1  TYR  23           HD1      TYR  23  -0.294  -6.157   4.296
  191    HD2  TYR  23           HD2      TYR  23   0.066 -10.114   2.711
  192    HE1  TYR  23           HE1      TYR  23  -2.734  -6.391   4.339
  193    HE2  TYR  23           HE2      TYR  23  -2.384 -10.349   2.760
  194    HH   TYR  23           HH       TYR  23  -4.479  -7.709   3.285
  195    H    GLN  24           H        GLN  24   4.003 -10.211   4.574
  196    HA   GLN  24           HA       GLN  24   6.399  -8.504   4.892
  197    HB2  GLN  24           2HB      GLN  24   6.077 -11.545   4.884
  198    HB3  GLN  24           3HB      GLN  24   7.640 -10.741   4.926
  199    HG2  GLN  24           2HG      GLN  24   7.076 -11.454   7.162
  200    HG3  GLN  24           3HG      GLN  24   7.029  -9.699   7.101
  201   HE21  GLN  24          1HE2      GLN  24   5.066  -8.655   7.497
  202   HE22  GLN  24          2HE2      GLN  24   3.641  -9.480   8.014
  203    H    LEU  25           H        LEU  25   7.095  -7.599   3.030
  204    HA   LEU  25           HA       LEU  25   7.074  -9.161   0.501
  205    HB2  LEU  25           2HB      LEU  25   6.744  -6.151   0.882
  206    HB3  LEU  25           3HB      LEU  25   6.966  -6.926  -0.679
  207    HG   LEU  25           HG       LEU  25   4.579  -7.271   1.177
  208   HD11  LEU  25          1HD1      LEU  25   4.593  -5.121   0.021
  209   HD12  LEU  25          2HD1      LEU  25   3.302  -6.151  -0.590
  210   HD13  LEU  25          3HD1      LEU  25   4.776  -5.931  -1.537
  211   HD21  LEU  25          3HD2      LEU  25   3.573  -8.650  -0.611
  212   HD22  LEU  25          1HD2      LEU  25   5.026  -9.395   0.052
  213   HD23  LEU  25          2HD2      LEU  25   5.086  -8.589  -1.518
  214    H    TYR  26           H        TYR  26   9.100  -9.836   0.148
  215    HA   TYR  26           HA       TYR  26  11.368  -7.946   0.450
  216    HB2  TYR  26           2HB      TYR  26  11.667 -10.065   1.713
  217    HB3  TYR  26           3HB      TYR  26  11.399 -11.001   0.247
  218    HD1  TYR  26           HD1      TYR  26  13.702  -8.457   1.753
  219    HD2  TYR  26           HD2      TYR  26  13.280 -11.551  -1.166
  220    HE1  TYR  26           HE1      TYR  26  16.097  -8.302   1.253
  221    HE2  TYR  26           HE2      TYR  26  15.683 -11.397  -1.660
  222    HH   TYR  26           HH       TYR  26  17.497  -9.648  -1.472
  223    H    ALA  27           H        ALA  27  12.536  -7.398  -1.344
  224    HA   ALA  27           HA       ALA  27  12.023  -8.720  -3.941
  225    HB1  ALA  27           3HB      ALA  27  11.923  -6.507  -5.047
  226    HB2  ALA  27           1HB      ALA  27  12.022  -5.712  -3.474
  227    HB3  ALA  27           2HB      ALA  27  10.613  -6.694  -3.879
  228    H    VAL  28           H        VAL  28  13.726  -8.047  -5.571
  229    HA   VAL  28           HA       VAL  28  16.372  -7.556  -4.349
  230    HB   VAL  28           HB       VAL  28  15.786  -8.180  -7.285
  231   HG11  VAL  28          1HG1      VAL  28  18.177  -8.816  -7.392
  232   HG12  VAL  28          2HG1      VAL  28  18.380  -8.370  -5.696
  233   HG13  VAL  28          3HG1      VAL  28  17.985  -7.134  -6.893
  234   HG21  VAL  28          3HG2      VAL  28  16.388 -10.524  -6.836
  235   HG22  VAL  28          1HG2      VAL  28  14.965 -10.050  -5.903
  236   HG23  VAL  28          2HG2      VAL  28  16.540 -10.170  -5.113
  237    H    ARG  29           H        ARG  29  14.145  -6.305  -6.825
  238    HA   ARG  29           HA       ARG  29  15.514  -3.676  -6.777
  239    HB2  ARG  29           2HB      ARG  29  13.897  -4.914  -9.058
  240    HB3  ARG  29           3HB      ARG  29  14.649  -3.322  -9.081
  241    HG2  ARG  29           2HG      ARG  29  16.879  -4.380  -8.884
  242    HG3  ARG  29           3HG      ARG  29  16.118  -5.969  -8.869
  243    HD2  ARG  29           2HD      ARG  29  15.264  -5.563 -11.170
  244    HD3  ARG  29           3HD      ARG  29  16.077  -3.990 -11.182
  245    HE   ARG  29           HE       ARG  29  18.107  -5.636 -10.587
  246   HH11  ARG  29          1HH1      ARG  29  15.703  -5.891 -13.152
  247   HH12  ARG  29          2HH1      ARG  29  16.766  -6.748 -14.221
  248   HH21  ARG  29          1HH2      ARG  29  19.461  -6.778 -11.960
  249   HH22  ARG  29          2HH2      ARG  29  18.914  -7.255 -13.536
  250    H    ASP  30           H        ASP  30  14.147  -1.819  -7.027
  251    HA   ASP  30           HA       ASP  30  11.845  -1.814  -5.357
  252    HB2  ASP  30           2HB      ASP  30  11.788   0.580  -5.773
  253    HB3  ASP  30           3HB      ASP  30  13.456   0.086  -5.546
  254    H    GLU  31           H        GLU  31  12.343  -1.906  -8.848
  255    HA   GLU  31           HA       GLU  31   9.710  -1.582  -9.766
  256    HB2  GLU  31           2HB      GLU  31  11.974  -3.289 -10.874
  257    HB3  GLU  31           3HB      GLU  31  10.456  -3.029 -11.728
  258    HG2  GLU  31           2HG      GLU  31  12.446  -0.880 -10.953
  259    HG3  GLU  31           3HG      GLU  31  12.243  -1.570 -12.560
  260    H    GLU  32           H        GLU  32  11.396  -4.453  -8.529
  261    HA   GLU  32           HA       GLU  32   9.341  -6.337  -9.019
  262    HB2  GLU  32           2HB      GLU  32  11.428  -6.515  -6.801
  263    HB3  GLU  32           3HB      GLU  32  10.536  -7.848  -7.523
  264    HG2  GLU  32           2HG      GLU  32  12.737  -6.200  -8.768
  265    HG3  GLU  32           3HG      GLU  32  12.790  -7.904  -8.342
  266    H    LEU  33           H        LEU  33   9.837  -3.985  -6.454
  267    HA   LEU  33           HA       LEU  33   8.015  -5.167  -4.561
  268    HB2  LEU  33           2HB      LEU  33  10.027  -3.333  -4.308
  269    HB3  LEU  33           3HB      LEU  33   8.668  -2.235  -4.365
  270    HG   LEU  33           HG       LEU  33   9.306  -2.702  -2.040
  271   HD11  LEU  33          1HD1      LEU  33   6.925  -2.291  -2.418
  272   HD12  LEU  33          2HD1      LEU  33   7.189  -3.378  -1.058
  273   HD13  LEU  33          3HD1      LEU  33   6.644  -4.023  -2.609
  274   HD21  LEU  33          3HD2      LEU  33   8.753  -5.634  -2.608
  275   HD22  LEU  33          1HD2      LEU  33   9.124  -4.939  -1.025
  276   HD23  LEU  33          2HD2      LEU  33  10.330  -4.903  -2.308
  277    H    LYS  34           H        LYS  34   7.761  -2.784  -7.165
  278    HA   LYS  34           HA       LYS  34   5.328  -1.528  -6.661
  279    HB2  LYS  34           2HB      LYS  34   6.596  -2.333  -9.308
  280    HB3  LYS  34           3HB      LYS  34   5.164  -1.310  -9.208
  281    HG2  LYS  34           2HG      LYS  34   6.381   0.448  -8.127
  282    HG3  LYS  34           3HG      LYS  34   7.785  -0.591  -7.872
  283    HD2  LYS  34           2HD      LYS  34   8.098   1.043  -9.737
  284    HD3  LYS  34           3HD      LYS  34   8.269  -0.635 -10.242
  285    HE2  LYS  34           2HE      LYS  34   5.977  -0.582 -11.169
  286    HE3  LYS  34           3HE      LYS  34   5.822   1.103 -10.673
  287    HZ1  LYS  34           3HZ      LYS  34   7.862   0.082 -12.574
  288    HZ2  LYS  34           1HZ      LYS  34   7.592   1.695 -12.160
  289    HZ3  LYS  34           2HZ      LYS  34   6.420   0.842 -13.024
  290    H    GLU  35           H        GLU  35   5.842  -4.443  -8.670
  291    HA   GLU  35           HA       GLU  35   3.157  -5.020  -9.224
  292    HB2  GLU  35           2HB      GLU  35   3.971  -7.282  -9.886
  293    HB3  GLU  35           3HB      GLU  35   4.957  -5.986 -10.559
  294    HG2  GLU  35           2HG      GLU  35   6.675  -6.369  -8.857
  295    HG3  GLU  35           3HG      GLU  35   5.682  -7.616  -8.107
  296    H    LYS  36           H        LYS  36   5.195  -5.946  -6.466
  297    HA   LYS  36           HA       LYS  36   3.521  -7.982  -5.397
  298    HB2  LYS  36           2HB      LYS  36   5.612  -6.250  -4.000
  299    HB3  LYS  36           3HB      LYS  36   4.861  -7.685  -3.294
  300    HG2  LYS  36           2HG      LYS  36   5.824  -9.092  -5.044
  301    HG3  LYS  36           3HG      LYS  36   6.515  -7.673  -5.832
  302    HD2  LYS  36           2HD      LYS  36   7.854  -7.284  -3.687
  303    HD3  LYS  36           3HD      LYS  36   7.297  -8.874  -3.149
  304    HE2  LYS  36           2HE      LYS  36   8.960  -8.276  -5.622
  305    HE3  LYS  36           3HE      LYS  36   9.514  -9.076  -4.152
  306    HZ1  LYS  36           3HZ      LYS  36   8.011 -10.906  -4.624
  307    HZ2  LYS  36           1HZ      LYS  36   9.064 -10.655  -5.921
  308    HZ3  LYS  36           2HZ      LYS  36   7.463 -10.132  -6.022
  309    H    LEU  37           H        LEU  37   3.811  -4.501  -4.710
  310    HA   LEU  37           HA       LEU  37   1.823  -4.286  -2.730
  311    HB2  LEU  37           2HB      LEU  37   2.792  -2.266  -4.779
  312    HB3  LEU  37           3HB      LEU  37   1.688  -1.856  -3.472
  313    HG   LEU  37           HG       LEU  37   4.496  -2.949  -3.043
  314   HD11  LEU  37          1HD1      LEU  37   3.529  -0.090  -2.870
  315   HD12  LEU  37          2HD1      LEU  37   4.592  -0.758  -4.106
  316   HD13  LEU  37          3HD1      LEU  37   5.137  -0.675  -2.434
  317   HD21  LEU  37          3HD2      LEU  37   4.175  -2.229  -0.714
  318   HD22  LEU  37          1HD2      LEU  37   2.975  -3.433  -1.179
  319   HD23  LEU  37          2HD2      LEU  37   2.522  -1.727  -1.081
  320    H    LYS  38           H        LYS  38   1.602  -4.057  -6.305
  321    HA   LYS  38           HA       LYS  38  -1.148  -3.539  -6.497
  322    HB2  LYS  38           2HB      LYS  38   0.698  -5.028  -8.407
  323    HB3  LYS  38           3HB      LYS  38  -0.945  -4.527  -8.814
  324    HG2  LYS  38           2HG      LYS  38  -0.335  -2.177  -8.524
  325    HG3  LYS  38           3HG      LYS  38   1.299  -2.641  -8.033
  326    HD2  LYS  38           2HD      LYS  38   1.688  -3.625 -10.275
  327    HD3  LYS  38           3HD      LYS  38   0.052  -3.168 -10.762
  328    HE2  LYS  38           2HE      LYS  38   0.625  -0.793 -10.494
  329    HE3  LYS  38           3HE      LYS  38   2.246  -1.232  -9.947
  330    HZ1  LYS  38           3HZ      LYS  38   2.220  -0.604 -12.275
  331    HZ2  LYS  38           1HZ      LYS  38   1.109  -1.828 -12.624
  332    HZ3  LYS  38           2HZ      LYS  38   2.666  -2.224 -12.104
  333    H    LYS  39           H        LYS  39   0.624  -6.652  -6.288
  334    HA   LYS  39           HA       LYS  39  -1.612  -8.352  -6.620
  335    HB2  LYS  39           2HB      LYS  39   0.943  -8.968  -5.066
  336    HB3  LYS  39           3HB      LYS  39  -0.243 -10.155  -5.599
  337    HG2  LYS  39           2HG      LYS  39   1.587  -8.491  -7.339
  338    HG3  LYS  39           3HG      LYS  39   1.666 -10.230  -7.076
  339    HD2  LYS  39           2HD      LYS  39  -0.471 -10.525  -8.279
  340    HD3  LYS  39           3HD      LYS  39  -0.624  -8.775  -8.468
  341    HE2  LYS  39           2HE      LYS  39   1.496  -8.792  -9.817
  342    HE3  LYS  39           3HE      LYS  39   1.493 -10.558  -9.728
  343    HZ1  LYS  39           3HZ      LYS  39  -0.657 -10.560 -10.838
  344    HZ2  LYS  39           1HZ      LYS  39   0.499  -9.766 -11.783
  345    HZ3  LYS  39           2HZ      LYS  39  -0.643  -8.874 -10.916
  346    H    VAL  40           H        VAL  40   0.042  -7.303  -3.618
  347    HA   VAL  40           HA       VAL  40  -1.573  -8.520  -1.707
  348    HB   VAL  40           HB       VAL  40   0.082  -5.960  -1.551
  349   HG11  VAL  40          1HG1      VAL  40  -1.251  -7.387   0.778
  350   HG12  VAL  40          2HG1      VAL  40  -1.626  -5.764   0.198
  351   HG13  VAL  40          3HG1      VAL  40  -0.053  -6.098   0.924
  352   HG21  VAL  40          3HG2      VAL  40   1.692  -7.372  -0.315
  353   HG22  VAL  40          1HG2      VAL  40   1.361  -8.036  -1.917
  354   HG23  VAL  40          2HG2      VAL  40   0.612  -8.759  -0.491
  355    H    LEU  41           H        LEU  41  -1.878  -5.266  -3.131
  356    HA   LEU  41           HA       LEU  41  -4.171  -4.513  -1.635
  357    HB2  LEU  41           2HB      LEU  41  -2.870  -3.361  -4.120
  358    HB3  LEU  41           3HB      LEU  41  -4.363  -2.688  -3.479
  359    HG   LEU  41           HG       LEU  41  -1.778  -2.900  -1.880
  360   HD11  LEU  41          1HD1      LEU  41  -2.922  -0.453  -3.247
  361   HD12  LEU  41          2HD1      LEU  41  -1.475  -1.338  -3.735
  362   HD13  LEU  41          3HD1      LEU  41  -1.508  -0.496  -2.188
  363   HD21  LEU  41          3HD2      LEU  41  -2.882  -1.381  -0.295
  364   HD22  LEU  41          1HD2      LEU  41  -3.776  -2.891  -0.466
  365   HD23  LEU  41          2HD2      LEU  41  -4.360  -1.423  -1.264
  366    H    ASN  42           H        ASN  42  -3.808  -5.921  -4.950
  367    HA   ASN  42           HA       ASN  42  -6.536  -5.931  -5.634
  368    HB2  ASN  42           2HB      ASN  42  -4.185  -7.604  -6.542
  369    HB3  ASN  42           3HB      ASN  42  -5.803  -8.008  -7.096
  370   HD21  ASN  42          1HD2      ASN  42  -4.709  -4.663  -6.584
  371   HD22  ASN  42          2HD2      ASN  42  -4.724  -4.249  -8.256
  372    H    GLU  43           H        GLU  43  -4.630  -8.386  -3.902
  373    HA   GLU  43           HA       GLU  43  -6.621 -10.352  -3.618
  374    HB2  GLU  43           2HB      GLU  43  -4.333  -9.719  -1.694
  375    HB3  GLU  43           3HB      GLU  43  -5.277 -11.203  -1.705
  376    HG2  GLU  43           2HG      GLU  43  -3.319 -10.268  -3.814
  377    HG3  GLU  43           3HG      GLU  43  -3.118 -11.608  -2.696
  378    H    ARG  44           H        ARG  44  -5.665  -7.614  -1.592
  379    HA   ARG  44           HA       ARG  44  -7.423  -8.081   0.574
  380    HB2  ARG  44           2HB      ARG  44  -5.268  -6.698   0.571
  381    HB3  ARG  44           3HB      ARG  44  -6.167  -5.420  -0.231
  382    HG2  ARG  44           2HG      ARG  44  -5.931  -5.019   2.186
  383    HG3  ARG  44           3HG      ARG  44  -7.624  -5.168   1.715
  384    HD2  ARG  44           2HD      ARG  44  -7.907  -7.171   2.859
  385    HD3  ARG  44           3HD      ARG  44  -6.218  -7.653   2.671
  386    HE   ARG  44           HE       ARG  44  -6.480  -5.381   4.390
  387   HH11  ARG  44          1HH1      ARG  44  -6.920  -8.878   4.373
  388   HH12  ARG  44          2HH1      ARG  44  -6.640  -9.042   6.072
  389   HH21  ARG  44          1HH2      ARG  44  -5.993  -5.641   6.599
  390   HH22  ARG  44          2HH2      ARG  44  -6.117  -7.216   7.327
  391    H    MET  45           H        MET  45  -7.705  -6.095  -2.371
  392    HA   MET  45           HA       MET  45 -10.122  -4.756  -1.520
  393    HB2  MET  45           2HB      MET  45  -8.703  -4.752  -4.221
  394    HB3  MET  45           3HB      MET  45 -10.136  -3.802  -3.856
  395    HG2  MET  45           2HG      MET  45  -7.388  -3.485  -2.634
  396    HG3  MET  45           3HG      MET  45  -8.212  -2.373  -3.724
  397    HE1  MET  45           3HE      MET  45 -11.115  -1.073  -1.367
  398    HE2  MET  45           1HE      MET  45 -11.196  -2.423  -2.497
  399    HE3  MET  45           2HE      MET  45 -10.393  -0.924  -2.969
  400    H    ASP  46           H        ASP  46  -9.374  -7.732  -3.090
  401    HA   ASP  46           HA       ASP  46 -11.393  -7.897  -5.005
  402    HB2  ASP  46           2HB      ASP  46  -9.357  -9.390  -4.856
  403    HB3  ASP  46           3HB      ASP  46 -10.167 -10.293  -3.579
  404    HA   PRO  47           HA       PRO  47 -14.413 -10.050  -1.815
  405    HB2  PRO  47           2HB      PRO  47 -13.884  -9.933   0.863
  406    HB3  PRO  47           3HB      PRO  47 -13.241 -11.235  -0.163
  407    HG2  PRO  47           2HG      PRO  47 -11.862  -8.713   0.739
  408    HG3  PRO  47           3HG      PRO  47 -11.269 -10.392   0.791
  409    HD2  PRO  47           2HD      PRO  47 -10.538  -8.717  -1.194
  410    HD3  PRO  47           3HD      PRO  47 -10.803 -10.446  -1.496
  411    H    ILE  48           H        ILE  48 -12.723  -7.094  -1.143
  412    HA   ILE  48           HA       ILE  48 -14.712  -5.770   0.463
  413    HB   ILE  48           HB       ILE  48 -12.221  -4.777  -0.976
  414   HG12  ILE  48          2HG1      ILE  48 -11.720  -6.378   0.815
  415   HG13  ILE  48          3HG1      ILE  48 -11.170  -4.775   1.273
  416   HG21  ILE  48          1HG2      ILE  48 -12.332  -2.725   0.350
  417   HG22  ILE  48          2HG2      ILE  48 -13.871  -3.237   1.031
  418   HG23  ILE  48          3HG2      ILE  48 -13.744  -2.890  -0.689
  419   HD11  ILE  48          3HD1      ILE  48 -12.115  -5.935   3.152
  420   HD12  ILE  48          1HD1      ILE  48 -13.633  -6.182   2.293
  421   HD13  ILE  48          2HD1      ILE  48 -13.129  -4.552   2.746
  422    H    LYS  49           H        LYS  49 -13.900  -5.917  -2.967
  423    HA   LYS  49           HA       LYS  49 -15.687  -3.850  -3.859
  424    HB2  LYS  49           2HB      LYS  49 -14.443  -6.171  -5.383
  425    HB3  LYS  49           3HB      LYS  49 -15.291  -4.813  -6.111
  426    HG2  LYS  49           2HG      LYS  49 -13.571  -3.278  -5.311
  427    HG3  LYS  49           3HG      LYS  49 -12.708  -4.608  -4.545
  428    HD2  LYS  49           2HD      LYS  49 -13.200  -4.256  -7.530
  429    HD3  LYS  49           3HD      LYS  49 -11.661  -4.028  -6.694
  430    HE2  LYS  49           2HE      LYS  49 -11.641  -6.425  -6.084
  431    HE3  LYS  49           3HE      LYS  49 -13.180  -6.651  -6.914
  432    HZ1  LYS  49           3HZ      LYS  49 -10.561  -5.980  -8.113
  433    HZ2  LYS  49           1HZ      LYS  49 -12.013  -5.852  -8.960
  434    HZ3  LYS  49           2HZ      LYS  49 -11.512  -7.350  -8.376
  435    H    LYS  50           H        LYS  50 -15.838  -7.343  -3.416
  436    HA   LYS  50           HA       LYS  50 -18.432  -7.853  -4.417
  437    HB2  LYS  50           2HB      LYS  50 -16.534  -9.495  -3.925
  438    HB3  LYS  50           3HB      LYS  50 -16.923  -9.356  -2.224
  439    HG2  LYS  50           2HG      LYS  50 -18.935 -10.333  -4.270
  440    HG3  LYS  50           3HG      LYS  50 -17.773 -11.420  -3.520
  441    HD2  LYS  50           2HD      LYS  50 -19.948  -9.834  -2.094
  442    HD3  LYS  50           3HD      LYS  50 -19.934 -11.574  -2.387
  443    HE2  LYS  50           2HE      LYS  50 -17.918 -11.783  -0.943
  444    HE3  LYS  50           3HE      LYS  50 -17.992 -10.048  -0.616
  445    HZ1  LYS  50           3HZ      LYS  50 -20.126 -10.348   0.426
  446    HZ2  LYS  50           1HZ      LYS  50 -19.010 -11.390   1.144
  447    HZ3  LYS  50           2HZ      LYS  50 -20.140 -11.992   0.041
  448    H    LEU  51           H        LEU  51 -17.242  -6.506  -1.409
  449    HA   LEU  51           HA       LEU  51 -19.746  -6.584   0.054
  450    HB2  LEU  51           2HB      LEU  51 -17.272  -4.863   0.506
  451    HB3  LEU  51           3HB      LEU  51 -18.639  -4.962   1.601
  452    HG   LEU  51           HG       LEU  51 -16.658  -7.175   0.974
  453   HD11  LEU  51          1HD1      LEU  51 -17.144  -5.647   3.546
  454   HD12  LEU  51          2HD1      LEU  51 -15.771  -5.449   2.454
  455   HD13  LEU  51          3HD1      LEU  51 -15.992  -6.968   3.316
  456   HD21  LEU  51          3HD2      LEU  51 -19.095  -7.313   2.780
  457   HD22  LEU  51          1HD2      LEU  51 -17.836  -8.545   2.645
  458   HD23  LEU  51          2HD2      LEU  51 -18.859  -8.182   1.260
  459    H    GLY  52           H        GLY  52 -17.958  -4.252  -1.920
  460    HA2  GLY  52           2HA      GLY  52 -18.719  -2.631  -3.341
  461    HA3  GLY  52           3HA      GLY  52 -20.366  -3.014  -2.880
  462    H    CYS  53           H        CYS  53 -17.799  -2.069  -0.632
  463    HA   CYS  53           HA       CYS  53 -19.224   0.218   0.333
  464    HB2  CYS  53           2HB      CYS  53 -16.924   0.659   1.485
  465    HB3  CYS  53           3HB      CYS  53 -17.836  -0.773   1.948
  466    H    LYS  54           H        LYS  54 -19.261   2.188  -0.504
  467    HA   LYS  54           HA       LYS  54 -18.169   2.654  -3.114
  468    HB2  LYS  54           2HB      LYS  54 -19.747   4.563  -1.315
  469    HB3  LYS  54           3HB      LYS  54 -19.351   4.862  -3.001
  470    HG2  LYS  54           2HG      LYS  54 -21.628   4.188  -2.962
  471    HG3  LYS  54           3HG      LYS  54 -20.723   2.812  -3.599
  472    HD2  LYS  54           2HD      LYS  54 -20.820   1.737  -1.352
  473    HD3  LYS  54           3HD      LYS  54 -21.748   3.108  -0.741
  474    HE2  LYS  54           2HE      LYS  54 -23.642   2.540  -2.067
  475    HE3  LYS  54           3HE      LYS  54 -22.705   1.433  -3.074
  476    HZ1  LYS  54           3HZ      LYS  54 -24.091   0.259  -1.485
  477    HZ2  LYS  54           1HZ      LYS  54 -23.317   1.028  -0.195
  478    HZ3  LYS  54           2HZ      LYS  54 -22.454  -0.036  -1.186
  479    H    ARG  55           H        ARG  55 -17.260   3.518   0.105
  480    HA   ARG  55           HA       ARG  55 -14.929   5.065  -0.893
  481    HB2  ARG  55           2HB      ARG  55 -16.602   6.567   0.201
  482    HB3  ARG  55           3HB      ARG  55 -16.548   5.573   1.649
  483    HG2  ARG  55           2HG      ARG  55 -14.012   6.181   1.728
  484    HG3  ARG  55           3HG      ARG  55 -14.423   7.442   0.560
  485    HD2  ARG  55           2HD      ARG  55 -14.472   8.418   2.787
  486    HD3  ARG  55           3HD      ARG  55 -16.136   8.313   2.203
  487    HE   ARG  55           HE       ARG  55 -14.888   6.492   4.178
  488   HH11  ARG  55          1HH1      ARG  55 -17.833   7.951   2.887
  489   HH12  ARG  55          2HH1      ARG  55 -18.843   7.253   4.113
  490   HH21  ARG  55          1HH2      ARG  55 -16.235   5.588   5.751
  491   HH22  ARG  55          2HH2      ARG  55 -17.939   5.917   5.732
  492    H    VAL  56           H        VAL  56 -13.076   4.087  -0.286
  493    HA   VAL  56           HA       VAL  56 -13.014   2.336   2.117
  494    HB   VAL  56           HB       VAL  56 -11.196   1.021   0.933
  495   HG11  VAL  56          1HG1      VAL  56 -13.920   0.978  -0.414
  496   HG12  VAL  56          2HG1      VAL  56 -13.480   0.140   1.076
  497   HG13  VAL  56          3HG1      VAL  56 -12.728  -0.327  -0.449
  498   HG21  VAL  56          3HG2      VAL  56 -10.540   2.684  -0.773
  499   HG22  VAL  56          1HG2      VAL  56 -12.117   2.529  -1.553
  500   HG23  VAL  56          2HG2      VAL  56 -10.999   1.160  -1.535
  501    H    ARG  57           H        ARG  57 -11.424   2.769   3.558
  502    HA   ARG  57           HA       ARG  57  -9.298   4.707   2.848
  503    HB2  ARG  57           2HB      ARG  57 -10.699   5.533   4.668
  504    HB3  ARG  57           3HB      ARG  57 -10.525   4.023   5.557
  505    HG2  ARG  57           2HG      ARG  57  -8.170   4.476   5.978
  506    HG3  ARG  57           3HG      ARG  57  -8.213   5.897   4.931
  507    HD2  ARG  57           2HD      ARG  57  -9.789   5.596   7.510
  508    HD3  ARG  57           3HD      ARG  57  -8.260   6.469   7.349
  509    HE   ARG  57           HE       ARG  57 -10.532   7.256   5.664
  510   HH11  ARG  57          1HH1      ARG  57  -8.431   8.091   8.370
  511   HH12  ARG  57          2HH1      ARG  57  -8.931   9.751   8.384
  512   HH21  ARG  57          1HH2      ARG  57 -11.158   9.402   5.676
  513   HH22  ARG  57          2HH2      ARG  57 -10.485  10.498   6.848
  514    H    ILE  58           H        ILE  58  -7.681   3.450   2.143
  515    HA   ILE  58           HA       ILE  58  -6.740   1.108   3.650
  516    HB   ILE  58           HB       ILE  58  -5.779   2.246   0.974
  517   HG12  ILE  58          2HG1      ILE  58  -7.588  -0.162   1.478
  518   HG13  ILE  58          3HG1      ILE  58  -8.099   1.377   0.793
  519   HG21  ILE  58          1HG2      ILE  58  -4.015   0.993   2.143
  520   HG22  ILE  58          2HG2      ILE  58  -4.551   0.117   0.711
  521   HG23  ILE  58          3HG2      ILE  58  -5.092  -0.395   2.309
  522   HD11  ILE  58          3HD1      ILE  58  -6.607   0.971  -1.137
  523   HD12  ILE  58          1HD1      ILE  58  -7.868  -0.244  -0.946
  524   HD13  ILE  58          2HD1      ILE  58  -6.214  -0.616  -0.465
  525    H    SER  59           H        SER  59  -5.510   1.831   5.353
  526    HA   SER  59           HA       SER  59  -3.630   4.073   5.044
  527    HB2  SER  59           2HB      SER  59  -4.640   2.688   7.579
  528    HB3  SER  59           3HB      SER  59  -3.631   4.137   7.514
  529    HG   SER  59           HG       SER  59  -6.211   3.956   6.350
  530    H    ILE  60           H        ILE  60  -1.783   3.251   4.245
  531    HA   ILE  60           HA       ILE  60  -0.810   0.591   5.007
  532    HB   ILE  60           HB       ILE  60  -0.035   2.517   2.773
  533   HG12  ILE  60          2HG1      ILE  60  -1.283  -0.269   2.766
  534   HG13  ILE  60          3HG1      ILE  60  -2.096   1.241   2.378
  535   HG21  ILE  60          1HG2      ILE  60   1.341  -0.116   3.421
  536   HG22  ILE  60          2HG2      ILE  60   2.055   1.491   3.561
  537   HG23  ILE  60          3HG2      ILE  60   1.619   0.857   1.974
  538   HD11  ILE  60          3HD1      ILE  60  -0.617   1.462   0.397
  539   HD12  ILE  60          1HD1      ILE  60  -1.660   0.042   0.371
  540   HD13  ILE  60          2HD1      ILE  60   0.050  -0.131   0.765
  541    H    ARG  61           H        ARG  61   0.492   0.493   6.699
  542    HA   ARG  61           HA       ARG  61   2.325   2.703   7.377
  543    HB2  ARG  61           2HB      ARG  61   1.476   0.249   9.002
  544    HB3  ARG  61           3HB      ARG  61   2.569   1.514   9.562
  545    HG2  ARG  61           2HG      ARG  61   0.719   3.166   9.355
  546    HG3  ARG  61           3HG      ARG  61  -0.367   1.862   8.871
  547    HD2  ARG  61           2HD      ARG  61   1.086   2.016  11.537
  548    HD3  ARG  61           3HD      ARG  61  -0.590   2.501  11.268
  549    HE   ARG  61           HE       ARG  61   0.195  -0.267  10.644
  550   HH11  ARG  61          1HH1      ARG  61  -1.541   1.905  12.830
  551   HH12  ARG  61          2HH1      ARG  61  -2.430   0.616  13.582
  552   HH21  ARG  61          1HH2      ARG  61  -0.985  -1.930  11.652
  553   HH22  ARG  61          2HH2      ARG  61  -2.119  -1.556  12.912
  554    H    VAL  62           H        VAL  62   4.276   2.475   6.487
  555    HA   VAL  62           HA       VAL  62   5.257  -0.159   5.620
  556    HB   VAL  62           HB       VAL  62   5.425   1.556   3.900
  557   HG11  VAL  62          1HG1      VAL  62   7.014   3.223   5.854
  558   HG12  VAL  62          2HG1      VAL  62   5.380   3.571   5.279
  559   HG13  VAL  62          3HG1      VAL  62   6.742   3.618   4.152
  560   HG21  VAL  62          3HG2      VAL  62   7.312   0.005   3.953
  561   HG22  VAL  62          1HG2      VAL  62   8.199   1.065   5.039
  562   HG23  VAL  62          2HG2      VAL  62   7.846   1.579   3.386
  563    H    LYS  63           H        LYS  63   6.787  -1.217   6.728
  564    HA   LYS  63           HA       LYS  63   7.695  -0.196   9.282
  565    HB2  LYS  63           2HB      LYS  63   6.903  -2.544   9.012
  566    HB3  LYS  63           3HB      LYS  63   8.246  -2.852   7.922
  567    HG2  LYS  63           2HG      LYS  63   9.765  -2.115   9.933
  568    HG3  LYS  63           3HG      LYS  63   8.319  -2.360  10.914
  569    HD2  LYS  63           2HD      LYS  63   9.747  -4.347  10.964
  570    HD3  LYS  63           3HD      LYS  63   8.214  -4.718  10.166
  571    HE2  LYS  63           2HE      LYS  63  10.142  -5.723   8.975
  572    HE3  LYS  63           3HE      LYS  63   9.312  -4.543   7.959
  573    HZ1  LYS  63           3HZ      LYS  63  11.038  -2.926   8.581
  574    HZ2  LYS  63           1HZ      LYS  63  11.681  -4.276   7.792
  575    HZ3  LYS  63           2HZ      LYS  63  11.830  -4.126   9.463
  576    H    HIS  64           H        HIS  64   9.393   1.100   9.275
  577    HA   HIS  64           HA       HIS  64  11.445   1.045   7.212
  578    HB2  HIS  64           2HB      HIS  64  10.765   2.922   9.508
  579    HB3  HIS  64           3HB      HIS  64  12.223   3.116   8.536
  580    HD1  HIS  64           HD1      HIS  64  10.878   5.490   8.062
  581    HD2  HIS  64           HD2      HIS  64   9.423   2.079   6.211
  582    HE1  HIS  64           HE1      HIS  64   9.618   6.295   6.052
  583    HE2  HIS  64           HE2      HIS  64   9.049   4.194   4.810
  584    H    SER  65           H        SER  65  13.032  -0.325   7.444
  585    HA   SER  65           HA       SER  65  13.466  -1.816   9.848
  586    HB2  SER  65           2HB      SER  65  15.036  -1.901   7.241
  587    HB3  SER  65           3HB      SER  65  14.935  -3.172   8.464
  588    HG   SER  65           HG       SER  65  13.547  -3.560   6.691
  589    H    ASP  66           H        ASP  66  15.049   0.937   8.392
  590    HA   ASP  66           HA       ASP  66  17.103   0.993  10.497
  591    HB2  ASP  66           2HB      ASP  66  18.137  -0.253   8.578
  592    HB3  ASP  66           3HB      ASP  66  17.809   1.115   7.521
  593    H    ALA  67           H        ALA  67  17.396   3.039  11.213
  594    HA   ALA  67           HA       ALA  67  15.583   5.063  10.445
  595    HB1  ALA  67           3HB      ALA  67  17.969   5.279  12.304
  596    HB2  ALA  67           1HB      ALA  67  16.347   4.750  12.754
  597    HB3  ALA  67           2HB      ALA  67  16.611   6.408  12.215
  598    H    ALA  68           H        ALA  68  18.924   4.536   9.474
  599    HA   ALA  68           HA       ALA  68  19.286   7.246   8.442
  600    HB1  ALA  68           3HB      ALA  68  21.510   6.448   7.734
  601    HB2  ALA  68           1HB      ALA  68  21.072   4.802   8.203
  602    HB3  ALA  68           2HB      ALA  68  21.204   6.063   9.428
  603    H    GLU  69           H        GLU  69  18.583   4.009   7.206
  604    HA   GLU  69           HA       GLU  69  18.821   4.728   4.422
  605    HB2  GLU  69           2HB      GLU  69  17.649   2.239   5.735
  606    HB3  GLU  69           3HB      GLU  69  17.867   2.437   3.998
  607    HG2  GLU  69           2HG      GLU  69  20.047   2.342   6.099
  608    HG3  GLU  69           3HG      GLU  69  19.672   1.098   4.910
  609    H    GLU  70           H        GLU  70  16.240   4.842   6.780
  610    HA   GLU  70           HA       GLU  70  14.093   4.362   4.972
  611    HB2  GLU  70           2HB      GLU  70  12.605   4.908   6.839
  612    HB3  GLU  70           3HB      GLU  70  13.842   3.746   7.265
  613    HG2  GLU  70           2HG      GLU  70  13.694   5.089   9.152
  614    HG3  GLU  70           3HG      GLU  70  15.105   5.722   8.318
  615    H    LYS  71           H        LYS  71  15.870   7.199   5.560
  616    HA   LYS  71           HA       LYS  71  13.975   9.177   4.769
  617    HB2  LYS  71           2HB      LYS  71  17.000   9.149   4.333
  618    HB3  LYS  71           3HB      LYS  71  15.961  10.572   4.259
  619    HG2  LYS  71           2HG      LYS  71  15.462  10.348   6.661
  620    HG3  LYS  71           3HG      LYS  71  16.469   8.900   6.747
  621    HD2  LYS  71           2HD      LYS  71  17.457  11.693   6.021
  622    HD3  LYS  71           3HD      LYS  71  17.643  10.928   7.599
  623    HE2  LYS  71           2HE      LYS  71  19.061   9.177   6.600
  624    HE3  LYS  71           3HE      LYS  71  18.843   9.894   5.002
  625    HZ1  LYS  71           3HZ      LYS  71  19.978  11.876   5.757
  626    HZ2  LYS  71           1HZ      LYS  71  20.955  10.524   6.017
  627    HZ3  LYS  71           2HZ      LYS  71  20.146  11.238   7.313
  628    H    LYS  72           H        LYS  72  16.448   7.364   3.041
  629    HA   LYS  72           HA       LYS  72  15.820   8.247   0.385
  630    HB2  LYS  72           2HB      LYS  72  18.100   7.687   1.029
  631    HB3  LYS  72           3HB      LYS  72  17.610   6.086   1.558
  632    HG2  LYS  72           2HG      LYS  72  17.145   5.472  -0.819
  633    HG3  LYS  72           3HG      LYS  72  17.708   7.072  -1.314
  634    HD2  LYS  72           2HD      LYS  72  19.472   5.329  -1.588
  635    HD3  LYS  72           3HD      LYS  72  19.963   6.590  -0.453
  636    HE2  LYS  72           2HE      LYS  72  19.332   5.080   1.438
  637    HE3  LYS  72           3HE      LYS  72  18.912   3.824   0.272
  638    HZ1  LYS  72           3HZ      LYS  72  21.120   3.498   1.193
  639    HZ2  LYS  72           1HZ      LYS  72  21.610   5.018   0.631
  640    HZ3  LYS  72           2HZ      LYS  72  21.210   3.800  -0.470
  641    H    GLU  73           H        GLU  73  14.930   5.538   2.423
  642    HA   GLU  73           HA       GLU  73  13.946   3.792   0.365
  643    HB2  GLU  73           2HB      GLU  73  14.777   2.802   2.393
  644    HB3  GLU  73           3HB      GLU  73  13.706   3.761   3.386
  645    HG2  GLU  73           2HG      GLU  73  12.254   2.011   1.490
  646    HG3  GLU  73           3HG      GLU  73  13.275   1.123   2.617
  647    H    ALA  74           H        ALA  74  12.340   5.859   2.841
  648    HA   ALA  74           HA       ALA  74   9.678   5.453   1.966
  649    HB1  ALA  74           3HB      ALA  74  10.251   6.378   4.163
  650    HB2  ALA  74           1HB      ALA  74   9.135   7.434   3.300
  651    HB3  ALA  74           2HB      ALA  74  10.851   7.853   3.406
  652    H    LYS  75           H        LYS  75  12.153   7.744   1.031
  653    HA   LYS  75           HA       LYS  75  10.738   9.482  -0.654
  654    HB2  LYS  75           2HB      LYS  75  13.154   9.740   0.103
  655    HB3  LYS  75           3HB      LYS  75  13.597   8.496  -1.059
  656    HG2  LYS  75           2HG      LYS  75  14.095  10.669  -2.004
  657    HG3  LYS  75           3HG      LYS  75  12.750   9.954  -2.902
  658    HD2  LYS  75           2HD      LYS  75  11.151  11.343  -1.627
  659    HD3  LYS  75           3HD      LYS  75  12.477  12.036  -0.691
  660    HE2  LYS  75           2HE      LYS  75  13.400  13.020  -2.782
  661    HE3  LYS  75           3HE      LYS  75  12.027  12.357  -3.678
  662    HZ1  LYS  75           3HZ      LYS  75  11.679  14.674  -3.090
  663    HZ2  LYS  75           1HZ      LYS  75  11.847  14.313  -1.446
  664    HZ3  LYS  75           2HZ      LYS  75  10.542  13.688  -2.322
  665    H    LYS  76           H        LYS  76  12.450   6.469  -1.333
  666    HA   LYS  76           HA       LYS  76  11.885   6.281  -4.112
  667    HB2  LYS  76           2HB      LYS  76  13.830   5.222  -3.013
  668    HB3  LYS  76           3HB      LYS  76  12.761   4.182  -2.081
  669    HG2  LYS  76           2HG      LYS  76  12.043   3.041  -4.139
  670    HG3  LYS  76           3HG      LYS  76  13.049   4.121  -5.109
  671    HD2  LYS  76           2HD      LYS  76  14.047   2.142  -3.019
  672    HD3  LYS  76           3HD      LYS  76  14.153   1.937  -4.767
  673    HE2  LYS  76           2HE      LYS  76  15.660   3.896  -4.905
  674    HE3  LYS  76           3HE      LYS  76  15.544   4.112  -3.156
  675    HZ1  LYS  76           3HZ      LYS  76  16.567   1.961  -2.844
  676    HZ2  LYS  76           1HZ      LYS  76  17.560   2.930  -3.807
  677    HZ3  LYS  76           2HZ      LYS  76  16.635   1.704  -4.513
  678    H    PHE  77           H        PHE  77  10.303   5.098  -1.182
  679    HA   PHE  77           HA       PHE  77   8.695   3.070  -2.462
  680    HB2  PHE  77           2HB      PHE  77   9.614   2.902  -0.102
  681    HB3  PHE  77           3HB      PHE  77   8.494   4.162   0.386
  682    HD1  PHE  77           HD1      PHE  77   8.591   0.725  -1.141
  683    HD2  PHE  77           HD2      PHE  77   6.328   3.532   1.176
  684    HE1  PHE  77           HE1      PHE  77   6.905  -1.005  -0.672
  685    HE2  PHE  77           HE2      PHE  77   4.651   1.790   1.630
  686    HZ   PHE  77           HZ       PHE  77   4.934  -0.476   0.707
  687    H    ALA  78           H        ALA  78   8.391   6.426  -1.637
  688    HA   ALA  78           HA       ALA  78   5.580   6.751  -1.888
  689    HB1  ALA  78           3HB      ALA  78   7.824   8.724  -2.432
  690    HB2  ALA  78           1HB      ALA  78   7.032   8.450  -0.879
  691    HB3  ALA  78           2HB      ALA  78   6.116   9.137  -2.222
  692    H    ALA  79           H        ALA  79   8.271   6.969  -4.213
  693    HA   ALA  79           HA       ALA  79   6.745   7.539  -6.532
  694    HB1  ALA  79           3HB      ALA  79   9.170   7.927  -6.399
  695    HB2  ALA  79           1HB      ALA  79   8.779   6.884  -7.768
  696    HB3  ALA  79           2HB      ALA  79   9.458   6.190  -6.290
  697    H    ILE  80           H        ILE  80   7.751   4.525  -4.975
  698    HA   ILE  80           HA       ILE  80   6.921   2.663  -6.928
  699    HB   ILE  80           HB       ILE  80   7.150   2.329  -3.896
  700   HG12  ILE  80          2HG1      ILE  80   9.296   2.972  -4.839
  701   HG13  ILE  80          3HG1      ILE  80   9.377   1.266  -4.439
  702   HG21  ILE  80          1HG2      ILE  80   5.767   0.525  -4.859
  703   HG22  ILE  80          2HG2      ILE  80   7.307  -0.086  -4.254
  704   HG23  ILE  80          3HG2      ILE  80   7.066   0.133  -5.986
  705   HD11  ILE  80          3HD1      ILE  80  10.468   1.753  -6.539
  706   HD12  ILE  80          1HD1      ILE  80   8.978   2.422  -7.197
  707   HD13  ILE  80          2HD1      ILE  80   9.077   0.703  -6.798
  708    H    LEU  81           H        LEU  81   5.234   4.027  -4.079
  709    HA   LEU  81           HA       LEU  81   2.796   2.594  -4.396
  710    HB2  LEU  81           2HB      LEU  81   3.604   5.038  -2.798
  711    HB3  LEU  81           3HB      LEU  81   1.930   4.515  -2.834
  712    HG   LEU  81           HG       LEU  81   4.267   2.864  -1.783
  713   HD11  LEU  81          1HD1      LEU  81   2.029   4.263  -0.286
  714   HD12  LEU  81          2HD1      LEU  81   3.728   4.742  -0.317
  715   HD13  LEU  81          3HD1      LEU  81   3.262   3.216   0.428
  716   HD21  LEU  81          3HD2      LEU  81   2.559   1.280  -0.982
  717   HD22  LEU  81          1HD2      LEU  81   2.542   1.410  -2.740
  718   HD23  LEU  81          2HD2      LEU  81   1.298   2.219  -1.785
  719    H    ASN  82           H        ASN  82   3.989   5.684  -5.636
  720    HA   ASN  82           HA       ASN  82   1.549   6.868  -6.429
  721    HB2  ASN  82           2HB      ASN  82   3.721   8.110  -6.336
  722    HB3  ASN  82           3HB      ASN  82   4.295   7.207  -7.735
  723   HD21  ASN  82          1HD2      ASN  82   4.489   8.930  -9.157
  724   HD22  ASN  82          2HD2      ASN  82   3.166   9.905  -9.682
  725    H    LYS  83           H        LYS  83   3.769   4.665  -8.110
  726    HA   LYS  83           HA       LYS  83   2.422   4.503 -10.599
  727    HB2  LYS  83           2HB      LYS  83   4.262   2.520  -9.198
  728    HB3  LYS  83           3HB      LYS  83   3.688   2.310 -10.849
  729    HG2  LYS  83           2HG      LYS  83   5.391   4.630  -9.877
  730    HG3  LYS  83           3HG      LYS  83   5.990   3.207 -10.736
  731    HD2  LYS  83           2HD      LYS  83   4.527   3.815 -12.681
  732    HD3  LYS  83           3HD      LYS  83   4.049   5.286 -11.828
  733    HE2  LYS  83           2HE      LYS  83   6.883   4.581 -12.683
  734    HE3  LYS  83           3HE      LYS  83   5.815   5.724 -13.497
  735    HZ1  LYS  83           3HZ      LYS  83   7.390   6.843 -12.066
  736    HZ2  LYS  83           1HZ      LYS  83   6.828   5.994 -10.720
  737    HZ3  LYS  83           2HZ      LYS  83   5.815   7.092 -11.512
  738    H    VAL  84           H        VAL  84   2.119   2.670  -7.572
  739    HA   VAL  84           HA       VAL  84   0.615   0.487  -8.617
  740    HB   VAL  84           HB       VAL  84   1.010   1.467  -5.749
  741   HG11  VAL  84          1HG1      VAL  84  -0.200  -1.165  -6.672
  742   HG12  VAL  84          2HG1      VAL  84  -1.051   0.132  -5.832
  743   HG13  VAL  84          3HG1      VAL  84   0.223  -0.767  -5.006
  744   HG21  VAL  84          3HG2      VAL  84   2.337  -0.815  -7.262
  745   HG22  VAL  84          1HG2      VAL  84   2.650  -0.374  -5.580
  746   HG23  VAL  84          2HG2      VAL  84   3.084   0.736  -6.880
  747    H    PHE  85           H        PHE  85  -0.333   3.188  -6.472
  748    HA   PHE  85           HA       PHE  85  -3.084   2.714  -6.395
  749    HB2  PHE  85           2HB      PHE  85  -1.538   5.306  -5.970
  750    HB3  PHE  85           3HB      PHE  85  -3.252   5.128  -5.610
  751    HD1  PHE  85           HD1      PHE  85  -3.542   2.584  -4.287
  752    HD2  PHE  85           HD2      PHE  85  -0.332   5.400  -3.942
  753    HE1  PHE  85           HE1      PHE  85  -3.010   1.719  -2.045
  754    HE2  PHE  85           HE2      PHE  85   0.186   4.519  -1.710
  755    HZ   PHE  85           HZ       PHE  85  -1.149   2.688  -0.763
  756    H    ALA  86           H        ALA  86  -1.228   4.808  -8.615
  757    HA   ALA  86           HA       ALA  86  -3.399   5.993  -9.985
  758    HB1  ALA  86           3HB      ALA  86  -1.107   6.876 -10.103
  759    HB2  ALA  86           1HB      ALA  86  -1.752   6.584 -11.720
  760    HB3  ALA  86           2HB      ALA  86  -0.591   5.454 -11.010
  761    H    GLU  87           H        GLU  87  -1.778   2.910 -10.365
  762    HA   GLU  87           HA       GLU  87  -3.130   2.247 -12.888
  763    HB2  GLU  87           2HB      GLU  87  -0.938   0.848 -11.294
  764    HB3  GLU  87           3HB      GLU  87  -1.676   0.154 -12.739
  765    HG2  GLU  87           2HG      GLU  87  -0.906   2.067 -14.083
  766    HG3  GLU  87           3HG      GLU  87  -0.209   2.814 -12.649
  767    H    LEU  88           H        LEU  88  -3.988   2.187  -9.719
  768    HA   LEU  88           HA       LEU  88  -5.645  -0.262  -9.971
  769    HB2  LEU  88           2HB      LEU  88  -4.986   1.359  -7.472
  770    HB3  LEU  88           3HB      LEU  88  -6.059  -0.030  -7.515
  771    HG   LEU  88           HG       LEU  88  -3.048   0.002  -7.866
  772   HD11  LEU  88          1HD1      LEU  88  -4.806  -1.468  -5.894
  773   HD12  LEU  88          2HD1      LEU  88  -3.838  -0.028  -5.567
  774   HD13  LEU  88          3HD1      LEU  88  -3.043  -1.543  -5.980
  775   HD21  LEU  88          3HD2      LEU  88  -4.853  -2.375  -8.399
  776   HD22  LEU  88          1HD2      LEU  88  -3.087  -2.403  -8.327
  777   HD23  LEU  88          2HD2      LEU  88  -3.899  -1.495  -9.597
  778    H    GLY  89           H        GLY  89  -5.738   3.219  -9.783
  779    HA2  GLY  89           2HA      GLY  89  -7.761   4.207 -10.845
  780    HA3  GLY  89           3HA      GLY  89  -8.720   3.212  -9.762
  781    H    TYR  90           H        TYR  90  -6.283   3.988  -7.807
  782    HA   TYR  90           HA       TYR  90  -7.673   6.184  -6.537
  783    HB2  TYR  90           2HB      TYR  90  -5.014   4.872  -5.822
  784    HB3  TYR  90           3HB      TYR  90  -5.883   6.021  -4.811
  785    HD1  TYR  90           HD2      TYR  90  -8.380   5.330  -4.203
  786    HD2  TYR  90           HD1      TYR  90  -5.351   2.558  -5.427
  787    HE1  TYR  90           HE2      TYR  90  -9.642   3.489  -3.172
  788    HE2  TYR  90           HE1      TYR  90  -6.614   0.717  -4.387
  789    HH   TYR  90           HH       TYR  90  -8.339   0.381  -2.686
  790    H    ASN  91           H        ASN  91  -7.224   8.289  -6.750
  791    HA   ASN  91           HA       ASN  91  -5.213   9.219  -8.653
  792    HB2  ASN  91           2HB      ASN  91  -7.455  10.646  -7.154
  793    HB3  ASN  91           3HB      ASN  91  -6.343  11.471  -8.237
  794   HD21  ASN  91          1HD2      ASN  91  -7.709   8.249  -8.899
  795   HD22  ASN  91          2HD2      ASN  91  -8.685   8.768 -10.220
  796    H    ASP  92           H        ASP  92  -4.018  11.300  -8.006
  797    HA   ASP  92           HA       ASP  92  -2.196  10.871  -5.956
  798    HB2  ASP  92           2HB      ASP  92  -1.831  12.346  -7.933
  799    HB3  ASP  92           3HB      ASP  92  -2.969  13.516  -7.278
  800    H    SER  93           H        SER  93  -5.087  12.926  -5.988
  801    HA   SER  93           HA       SER  93  -4.924  14.178  -3.530
  802    HB2  SER  93           2HB      SER  93  -6.567  14.736  -5.295
  803    HB3  SER  93           3HB      SER  93  -7.442  13.245  -4.959
  804    HG   SER  93           HG       SER  93  -7.699  15.612  -3.779
  805    H    ASN  94           H        ASN  94  -5.953  10.850  -4.199
  806    HA   ASN  94           HA       ASN  94  -7.220  10.307  -1.719
  807    HB2  ASN  94           2HB      ASN  94  -5.881   8.419  -3.701
  808    HB3  ASN  94           3HB      ASN  94  -6.823   7.871  -2.316
  809   HD21  ASN  94          1HD2      ASN  94  -8.846  10.007  -2.593
  810   HD22  ASN  94          2HD2      ASN  94  -9.794   9.558  -3.961
  811    H    VAL  95           H        VAL  95  -3.861  10.414  -2.648
  812    HA   VAL  95           HA       VAL  95  -2.903   8.753  -0.434
  813    HB   VAL  95           HB       VAL  95  -1.397  10.168  -2.691
  814   HG11  VAL  95          1HG1      VAL  95   0.499   8.697  -2.148
  815   HG12  VAL  95          2HG1      VAL  95  -0.406   8.010  -0.800
  816   HG13  VAL  95          3HG1      VAL  95   0.069   9.709  -0.766
  817   HG21  VAL  95          3HG2      VAL  95  -2.278   7.260  -2.512
  818   HG22  VAL  95          1HG2      VAL  95  -1.277   7.951  -3.794
  819   HG23  VAL  95          2HG2      VAL  95  -2.949   8.483  -3.594
  820    H    THR  96           H        THR  96  -2.323   9.688   1.499
  821    HA   THR  96           HA       THR  96  -0.896  12.276   1.507
  822    HB   THR  96           HB       THR  96  -3.160  11.604   3.448
  823    HG1  THR  96           HG1      THR  96  -3.009  13.157   1.117
  824   HG21  THR  96          3HG2      THR  96  -1.422  12.916   4.589
  825   HG22  THR  96          1HG2      THR  96  -2.831  13.939   4.281
  826   HG23  THR  96          2HG2      THR  96  -1.398  14.080   3.261
  827    H    TRP  97           H        TRP  97   1.003  12.009   2.517
  828    HA   TRP  97           HA       TRP  97   1.543   9.732   4.268
  829    HB2  TRP  97           2HB      TRP  97   3.329  11.922   3.117
  830    HB3  TRP  97           3HB      TRP  97   3.915  10.664   4.202
  831    HD1  TRP  97           HD1      TRP  97   2.448  11.038   0.621
  832    HE1  TRP  97           HE1      TRP  97   3.218   9.009  -0.769
  833    HE3  TRP  97           HE3      TRP  97   4.783   8.336   4.311
  834    HZ2  TRP  97           HZ2      TRP  97   4.625   6.605  -0.362
  835    HZ3  TRP  97           HZ3      TRP  97   5.818   6.175   3.718
  836    HH2  TRP  97           HH2      TRP  97   5.738   5.330   1.422
  837    H    ASP  98           H        ASP  98   1.309   9.876   6.422
  838    HA   ASP  98           HA       ASP  98   2.065  12.375   7.859
  839    HB2  ASP  98           2HB      ASP  98   0.038  10.239   8.718
  840    HB3  ASP  98           3HB      ASP  98   0.608  11.536   9.758
  841    H    GLY  99           H        GLY  99   4.221  11.831   8.014
  842    HA2  GLY  99           2HA      GLY  99   6.101  10.967   9.000
  843    HA3  GLY  99           3HA      GLY  99   5.061  10.043  10.075
  844    H    ASP 100           H        ASP 100   5.542   7.948   9.944
  845    HA   ASP 100           HA       ASP 100   6.687   6.702   7.576
  846    HB2  ASP 100           2HB      ASP 100   5.853   5.443  10.235
  847    HB3  ASP 100           3HB      ASP 100   6.809   4.660   8.981
  848    H    THR 101           H        THR 101   3.551   7.414   8.488
  849    HA   THR 101           HA       THR 101   2.324   5.018   7.270
  850    HB   THR 101           HB       THR 101   1.065   7.235   8.963
  851    HG1  THR 101           HG1      THR 101   1.830   6.078  10.547
  852   HG21  THR 101          3HG2      THR 101  -0.924   5.777   9.111
  853   HG22  THR 101          1HG2      THR 101  -0.168   4.614   8.026
  854   HG23  THR 101          2HG2      THR 101  -0.608   6.217   7.428
  855    H    VAL 102           H        VAL 102   0.917   5.271   5.520
  856    HA   VAL 102           HA       VAL 102   0.353   7.976   4.482
  857    HB   VAL 102           HB       VAL 102   2.026   7.075   2.964
  858   HG11  VAL 102          1HG1      VAL 102   1.853   4.682   3.456
  859   HG12  VAL 102          2HG1      VAL 102   1.774   4.971   1.717
  860   HG13  VAL 102          3HG1      VAL 102   0.301   4.605   2.617
  861   HG21  VAL 102          3HG2      VAL 102  -0.720   6.866   1.683
  862   HG22  VAL 102          1HG2      VAL 102   0.802   7.112   0.820
  863   HG23  VAL 102          2HG2      VAL 102   0.202   8.350   1.926
  864    H    THR 103           H        THR 103  -1.772   8.303   4.660
  865    HA   THR 103           HA       THR 103  -3.698   6.087   4.708
  866    HB   THR 103           HB       THR 103  -4.111   9.065   5.265
  867    HG1  THR 103           HG1      THR 103  -2.775   7.632   6.763
  868   HG21  THR 103          3HG2      THR 103  -5.970   6.725   5.858
  869   HG22  THR 103          1HG2      THR 103  -6.215   7.910   4.568
  870   HG23  THR 103          2HG2      THR 103  -6.266   8.417   6.256
  871    H    VAL 104           H        VAL 104  -4.537   5.549   2.813
  872    HA   VAL 104           HA       VAL 104  -4.976   7.539   0.660
  873    HB   VAL 104           HB       VAL 104  -4.542   4.512   0.440
  874   HG11  VAL 104          1HG1      VAL 104  -4.509   4.836  -2.012
  875   HG12  VAL 104          2HG1      VAL 104  -4.907   6.543  -1.797
  876   HG13  VAL 104          3HG1      VAL 104  -6.071   5.301  -1.328
  877   HG21  VAL 104          3HG2      VAL 104  -2.398   5.099  -0.653
  878   HG22  VAL 104          1HG2      VAL 104  -2.464   5.685   1.010
  879   HG23  VAL 104          2HG2      VAL 104  -2.703   6.804  -0.334
  880    H    GLU 105           H        GLU 105  -7.107   8.126   0.730
  881    HA   GLU 105           HA       GLU 105  -9.157   6.007   1.088
  882    HB2  GLU 105           2HB      GLU 105  -9.122   7.452   3.084
  883    HB3  GLU 105           3HB      GLU 105  -9.303   8.891   2.082
  884    HG2  GLU 105           2HG      GLU 105 -11.540   8.135   1.365
  885    HG3  GLU 105           3HG      GLU 105 -11.351   6.649   2.296
  886    H    GLY 106           H        GLY 106 -10.211   5.697  -0.748
  887    HA2  GLY 106           2HA      GLY 106 -10.893   7.960  -2.525
  888    HA3  GLY 106           3HA      GLY 106 -10.017   6.580  -3.178
  889    H    GLN 107           H        GLN 107 -12.323   7.159  -4.361
  890    HA   GLN 107           HA       GLN 107 -14.551   5.694  -3.254
  891    HB2  GLN 107           2HB      GLN 107 -14.948   7.652  -4.729
  892    HB3  GLN 107           3HB      GLN 107 -14.183   6.812  -6.076
  893    HG2  GLN 107           2HG      GLN 107 -15.969   5.092  -6.026
  894    HG3  GLN 107           3HG      GLN 107 -16.712   5.900  -4.647
  895   HE21  GLN 107          1HE2      GLN 107 -18.663   6.169  -5.745
  896   HE22  GLN 107          2HE2      GLN 107 -18.857   7.310  -7.028
  897    H    LEU 108           H        LEU 108 -14.563   3.524  -3.213
  898    HA   LEU 108           HA       LEU 108 -13.430   1.936  -5.404
  899    HB2  LEU 108           2HB      LEU 108 -13.242   1.145  -3.021
  900    HB3  LEU 108           3HB      LEU 108 -14.990   1.002  -2.966
  901    HG   LEU 108           HG       LEU 108 -14.857  -0.689  -4.832
  902   HD11  LEU 108          1HD1      LEU 108 -11.864  -0.519  -4.375
  903   HD12  LEU 108          2HD1      LEU 108 -12.741  -0.048  -5.833
  904   HD13  LEU 108          3HD1      LEU 108 -12.691  -1.734  -5.348
  905   HD21  LEU 108          3HD2      LEU 108 -13.380  -1.371  -2.279
  906   HD22  LEU 108          1HD2      LEU 108 -14.080  -2.533  -3.408
  907   HD23  LEU 108          2HD2      LEU 108 -15.126  -1.415  -2.541
  908    H    GLU 109           H        GLU 109 -14.703   0.670  -6.773
  909    HA   GLU 109           HA       GLU 109 -16.403  -0.031  -8.045
  910    HB2  GLU 109           2HB      GLU 109 -17.449  -0.598  -5.787
  911    HB3  GLU 109           3HB      GLU 109 -18.355   0.906  -5.893
  912    HG2  GLU 109           2HG      GLU 109 -19.549   0.129  -7.846
  913    HG3  GLU 109           3HG      GLU 109 -18.516  -1.292  -7.979
  914    H    GLY 110           H        GLY 110 -15.564   2.971  -7.696
  915    HA2  GLY 110           2HA      GLY 110 -17.706   4.489  -8.912
  916    HA3  GLY 110           3HA      GLY 110 -16.050   5.016  -8.643
  917    H    VAL 111           H        VAL 111 -14.501   3.360 -10.002
  918    HA   VAL 111           HA       VAL 111 -15.029   4.034 -12.786
  919    HB   VAL 111           HB       VAL 111 -12.746   3.265 -13.254
  920   HG11  VAL 111          1HG1      VAL 111 -13.022   5.545 -12.392
  921   HG12  VAL 111          2HG1      VAL 111 -11.486   4.862 -11.862
  922   HG13  VAL 111          3HG1      VAL 111 -12.841   4.964 -10.734
  923   HG21  VAL 111          3HG2      VAL 111 -11.247   2.388 -11.483
  924   HG22  VAL 111          1HG2      VAL 111 -12.612   1.305 -11.766
  925   HG23  VAL 111          2HG2      VAL 111 -12.600   2.354 -10.349
  926    H    ASP 112           H        ASP 112 -15.664   1.383 -10.811
  927    HA   ASP 112           HA       ASP 112 -16.166  -0.442 -13.058
  928    HB2  ASP 112           2HB      ASP 112 -13.901  -1.029 -12.321
  929    HB3  ASP 112           3HB      ASP 112 -14.417  -1.087 -10.643
  930    H    LEU 113           H        LEU 113 -18.323  -0.488 -12.796
  931    HA   LEU 113           HA       LEU 113 -19.604  -0.142 -10.234
  932    HB2  LEU 113           2HB      LEU 113 -20.844  -0.747 -12.953
  933    HB3  LEU 113           3HB      LEU 113 -21.703  -0.167 -11.533
  934    HG   LEU 113           HG       LEU 113 -19.602   1.403 -13.081
  935   HD11  LEU 113          1HD1      LEU 113 -22.609   1.771 -13.033
  936   HD12  LEU 113          2HD1      LEU 113 -21.650   1.144 -14.378
  937   HD13  LEU 113          3HD1      LEU 113 -21.442   2.815 -13.857
  938   HD21  LEU 113          3HD2      LEU 113 -20.263   3.338 -11.718
  939   HD22  LEU 113          1HD2      LEU 113 -19.587   2.049 -10.725
  940   HD23  LEU 113          2HD2      LEU 113 -21.333   2.313 -10.757
  941    H    GLU 114           H        GLU 114 -19.537  -2.743 -12.690
  942    HA   GLU 114           HA       GLU 114 -21.286  -4.456 -11.145
  943    HB2  GLU 114           2HB      GLU 114 -19.872  -4.943 -13.799
  944    HB3  GLU 114           3HB      GLU 114 -21.052  -6.031 -13.064
  945    HG2  GLU 114           2HG      GLU 114 -22.687  -4.062 -13.110
  946    HG3  GLU 114           3HG      GLU 114 -21.521  -3.242 -14.149
  947    H    HIS 115           H        HIS 115 -20.245  -5.068  -9.309
  948    HA   HIS 115           HA       HIS 115 -17.933  -6.907  -9.543
  949    HB2  HIS 115           2HB      HIS 115 -19.094  -5.454  -7.122
  950    HB3  HIS 115           3HB      HIS 115 -17.796  -6.642  -7.029
  951    HD1  HIS 115           HD1      HIS 115 -17.818  -3.370  -6.471
  952    HD2  HIS 115           HD2      HIS 115 -15.926  -5.503  -9.494
  953    HE1  HIS 115           HE1      HIS 115 -15.871  -1.955  -7.191
  954    HE2  HIS 115           HE2      HIS 115 -14.868  -3.187  -9.128
  955    H    HIS 116           H        HIS 116 -21.344  -6.832  -9.092
  956    HA   HIS 116           HA       HIS 116 -21.665  -9.372  -7.792
  957    HB2  HIS 116           2HB      HIS 116 -23.604  -7.813  -9.565
  958    HB3  HIS 116           3HB      HIS 116 -24.031  -9.262  -8.660
  959    HD1  HIS 116           HD1      HIS 116 -23.916  -9.036  -5.998
  960    HD2  HIS 116           HD2      HIS 116 -23.783  -5.471  -8.122
  961    HE1  HIS 116           HE1      HIS 116 -24.434  -7.235  -4.328
  962    HE2  HIS 116           HE2      HIS 116 -24.587  -5.137  -5.700
  963    H    HIS 117           H        HIS 117 -22.221  -8.375 -11.187
  964    HA   HIS 117           HA       HIS 117 -21.737 -11.047 -12.210
  965    HB2  HIS 117           2HB      HIS 117 -22.268  -8.382 -13.607
  966    HB3  HIS 117           3HB      HIS 117 -21.959  -9.880 -14.479
  967    HD1  HIS 117           HD1      HIS 117 -24.090 -10.784 -15.342
  968    HD2  HIS 117           HD2      HIS 117 -24.604  -9.037 -11.605
  969    HE1  HIS 117           HE1      HIS 117 -26.523 -11.066 -14.789
  970    HE2  HIS 117           HE2      HIS 117 -26.756 -10.176 -12.448
  971    H    HIS 118           H        HIS 118 -19.654 -11.399 -11.381
  972    HA   HIS 118           HA       HIS 118 -17.491 -10.434 -13.078
  973    HB2  HIS 118           2HB      HIS 118 -17.421  -8.843 -11.173
  974    HB3  HIS 118           3HB      HIS 118 -17.349 -10.185 -10.036
  975    HD1  HIS 118           HD1      HIS 118 -15.080 -11.497  -9.888
  976    HD2  HIS 118           HD2      HIS 118 -14.993  -8.237 -12.453
  977    HE1  HIS 118           HE1      HIS 118 -12.660 -11.124 -10.438
  978    HE2  HIS 118           HE2      HIS 118 -12.667  -9.293 -12.142
  979    H    HIS 119           H        HIS 119 -17.657 -12.578 -13.878
  980    HA   HIS 119           HA       HIS 119 -15.912 -14.430 -12.432
  981    HB2  HIS 119           2HB      HIS 119 -18.679 -15.243 -13.453
  982    HB3  HIS 119           3HB      HIS 119 -17.409 -16.417 -13.130
  983    HD1  HIS 119           HD1      HIS 119 -20.296 -15.118 -11.581
  984    HD2  HIS 119           HD2      HIS 119 -16.467 -15.977 -10.218
  985    HE1  HIS 119           HE1      HIS 119 -20.487 -15.271  -9.082
  986    HE2  HIS 119           HE2      HIS 119 -18.202 -16.002  -8.315
  987    H    HIS 120           H        HIS 120 -15.574 -12.614 -14.659
  988    HA   HIS 120           HA       HIS 120 -15.310 -14.238 -17.070
  989    HB2  HIS 120           2HB      HIS 120 -15.895 -11.807 -17.176
  990    HB3  HIS 120           3HB      HIS 120 -14.336 -11.404 -16.474
  991    HD1  HIS 120           HD1      HIS 120 -15.914 -12.635 -19.662
  992    HD2  HIS 120           HD2      HIS 120 -12.210 -11.330 -18.296
  993    HE1  HIS 120           HE1      HIS 120 -14.528 -12.245 -21.720
  994    HE2  HIS 120           HE2      HIS 120 -12.246 -11.635 -20.855
  Start of MODEL   15
    1    H1   MET   1           1H       MET   1  23.729  -8.042  -3.617
    2    H2   MET   1           2H       MET   1  25.220  -8.365  -2.895
    3    H3   MET   1           3H       MET   1  24.720  -6.770  -3.133
    4    HA   MET   1           HA       MET   1  23.369  -8.723  -1.374
    5    HB2  MET   1           2HB      MET   1  25.192  -6.385  -0.651
    6    HB3  MET   1           3HB      MET   1  24.318  -7.375   0.512
    7    HG2  MET   1           2HG      MET   1  25.634  -9.336  -0.148
    8    HG3  MET   1           3HG      MET   1  26.490  -8.365  -1.353
    9    HE1  MET   1           3HE      MET   1  28.019 -10.093   0.836
   10    HE2  MET   1           1HE      MET   1  29.229  -8.957   1.426
   11    HE3  MET   1           2HE      MET   1  28.894  -9.064  -0.302
   12    H    SER   2           H        SER   2  22.480  -6.663  -3.538
   13    HA   SER   2           HA       SER   2  20.912  -4.721  -2.066
   14    HB2  SER   2           2HB      SER   2  20.876  -5.489  -5.023
   15    HB3  SER   2           3HB      SER   2  20.076  -4.083  -4.317
   16    HG   SER   2           HG       SER   2  22.649  -4.110  -3.576
   17    H    GLY   3           H        GLY   3  19.106  -5.381  -0.990
   18    HA2  GLY   3           2HA      GLY   3  16.857  -6.527  -2.156
   19    HA3  GLY   3           3HA      GLY   3  17.766  -7.858  -1.448
   20    H    LYS   4           H        LYS   4  15.440  -5.518  -0.849
   21    HA   LYS   4           HA       LYS   4  15.790  -5.631   2.090
   22    HB2  LYS   4           2HB      LYS   4  14.186  -3.664   0.383
   23    HB3  LYS   4           3HB      LYS   4  14.178  -3.685   2.144
   24    HG2  LYS   4           2HG      LYS   4  16.532  -3.046   0.346
   25    HG3  LYS   4           3HG      LYS   4  15.633  -1.923   1.372
   26    HD2  LYS   4           2HD      LYS   4  16.380  -3.324   3.364
   27    HD3  LYS   4           3HD      LYS   4  17.445  -4.194   2.261
   28    HE2  LYS   4           2HE      LYS   4  18.712  -2.497   3.413
   29    HE3  LYS   4           3HE      LYS   4  18.563  -2.022   1.721
   30    HZ1  LYS   4           3HZ      LYS   4  16.830  -0.476   2.320
   31    HZ2  LYS   4           1HZ      LYS   4  18.188  -0.176   3.282
   32    HZ3  LYS   4           2HZ      LYS   4  16.860  -0.989   3.929
   33    H    LYS   5           H        LYS   5  14.467  -6.935   3.187
   34    HA   LYS   5           HA       LYS   5  11.860  -7.791   2.158
   35    HB2  LYS   5           2HB      LYS   5  13.397  -9.391   3.368
   36    HB3  LYS   5           3HB      LYS   5  13.234  -8.422   4.819
   37    HG2  LYS   5           2HG      LYS   5  10.770  -9.614   3.533
   38    HG3  LYS   5           3HG      LYS   5  11.820 -10.633   4.508
   39    HD2  LYS   5           2HD      LYS   5  10.404  -8.113   5.478
   40    HD3  LYS   5           3HD      LYS   5   9.911  -9.773   5.817
   41    HE2  LYS   5           2HE      LYS   5  12.082 -10.142   7.010
   42    HE3  LYS   5           3HE      LYS   5  12.493  -8.445   6.738
   43    HZ1  LYS   5           3HZ      LYS   5  10.152  -9.433   8.282
   44    HZ2  LYS   5           1HZ      LYS   5  10.549  -7.809   8.042
   45    HZ3  LYS   5           2HZ      LYS   5  11.570  -8.804   8.947
   46    H    VAL   6           H        VAL   6  10.436  -6.144   2.237
   47    HA   VAL   6           HA       VAL   6  10.219  -4.400   4.616
   48    HB   VAL   6           HB       VAL   6  10.293  -3.010   2.673
   49   HG11  VAL   6          1HG1      VAL   6   8.271  -4.837   1.317
   50   HG12  VAL   6          2HG1      VAL   6   9.992  -4.729   0.943
   51   HG13  VAL   6          3HG1      VAL   6   8.937  -3.350   0.632
   52   HG21  VAL   6          3HG2      VAL   6   8.467  -2.341   4.168
   53   HG22  VAL   6          1HG2      VAL   6   7.335  -3.367   3.283
   54   HG23  VAL   6          2HG2      VAL   6   8.065  -1.966   2.491
   55    H    GLU   7           H        GLU   7   8.365  -4.357   5.809
   56    HA   GLU   7           HA       GLU   7   6.265  -6.376   5.288
   57    HB2  GLU   7           2HB      GLU   7   7.067  -5.107   7.948
   58    HB3  GLU   7           3HB      GLU   7   5.848  -6.358   7.719
   59    HG2  GLU   7           2HG      GLU   7   7.550  -7.959   7.021
   60    HG3  GLU   7           3HG      GLU   7   8.789  -6.708   7.080
   61    H    VAL   8           H        VAL   8   4.486  -5.512   4.536
   62    HA   VAL   8           HA       VAL   8   4.008  -2.608   4.649
   63    HB   VAL   8           HB       VAL   8   2.899  -4.750   2.760
   64   HG11  VAL   8          1HG1      VAL   8   2.559  -1.733   2.610
   65   HG12  VAL   8          2HG1      VAL   8   1.292  -2.906   2.976
   66   HG13  VAL   8          3HG1      VAL   8   2.041  -2.887   1.379
   67   HG21  VAL   8          3HG2      VAL   8   4.382  -3.764   1.054
   68   HG22  VAL   8          1HG2      VAL   8   5.313  -4.360   2.433
   69   HG23  VAL   8          2HG2      VAL   8   5.017  -2.628   2.248
   70    H    GLN   9           H        GLN   9   2.571  -1.992   6.200
   71    HA   GLN   9           HA       GLN   9   0.580  -3.827   7.298
   72    HB2  GLN   9           2HB      GLN   9   1.152  -0.891   7.967
   73    HB3  GLN   9           3HB      GLN   9   0.026  -1.929   8.835
   74    HG2  GLN   9           2HG      GLN   9   1.927  -3.341   9.565
   75    HG3  GLN   9           3HG      GLN   9   3.033  -2.263   8.710
   76   HE21  GLN   9          1HE2      GLN   9   4.131  -1.720  10.650
   77   HE22  GLN   9          2HE2      GLN   9   3.428  -0.701  11.851
   78    H    VAL  10           H        VAL  10  -0.989  -4.076   5.670
   79    HA   VAL  10           HA       VAL  10  -2.226  -1.658   4.531
   80    HB   VAL  10           HB       VAL  10  -2.872  -4.601   3.972
   81   HG11  VAL  10          1HG1      VAL  10  -4.174  -3.747   2.039
   82   HG12  VAL  10          2HG1      VAL  10  -3.844  -2.088   2.544
   83   HG13  VAL  10          3HG1      VAL  10  -4.823  -3.142   3.567
   84   HG21  VAL  10          3HG2      VAL  10  -1.705  -4.250   1.817
   85   HG22  VAL  10          1HG2      VAL  10  -0.615  -4.009   3.186
   86   HG23  VAL  10          2HG2      VAL  10  -1.265  -2.616   2.317
   87    H    LYS  11           H        LYS  11  -3.676  -0.729   5.752
   88    HA   LYS  11           HA       LYS  11  -5.528  -2.318   7.446
   89    HB2  LYS  11           2HB      LYS  11  -3.843  -1.011   8.740
   90    HB3  LYS  11           3HB      LYS  11  -4.341   0.460   7.931
   91    HG2  LYS  11           2HG      LYS  11  -6.505   0.406   9.000
   92    HG3  LYS  11           3HG      LYS  11  -6.194  -1.196   9.670
   93    HD2  LYS  11           2HD      LYS  11  -5.936   0.449  11.433
   94    HD3  LYS  11           3HD      LYS  11  -4.354  -0.226  11.059
   95    HE2  LYS  11           2HE      LYS  11  -5.313   2.421   9.925
   96    HE3  LYS  11           3HE      LYS  11  -4.471   2.296  11.464
   97    HZ1  LYS  11           3HZ      LYS  11  -2.570   1.339  10.298
   98    HZ2  LYS  11           1HZ      LYS  11  -2.956   2.874   9.709
   99    HZ3  LYS  11           2HZ      LYS  11  -3.374   1.502   8.822
  100    H    ILE  12           H        ILE  12  -7.377  -2.336   6.277
  101    HA   ILE  12           HA       ILE  12  -8.277   0.166   4.958
  102    HB   ILE  12           HB       ILE  12  -7.527  -1.349   3.209
  103   HG12  ILE  12          2HG1      ILE  12 -10.580  -1.241   3.285
  104   HG13  ILE  12          3HG1      ILE  12  -9.528   0.072   2.771
  105   HG21  ILE  12          1HG2      ILE  12  -7.707  -3.511   4.365
  106   HG22  ILE  12          2HG2      ILE  12  -8.507  -3.568   2.794
  107   HG23  ILE  12          3HG2      ILE  12  -9.469  -3.430   4.268
  108   HD11  ILE  12          3HD1      ILE  12  -8.762  -1.295   0.888
  109   HD12  ILE  12          1HD1      ILE  12 -10.505  -1.036   0.876
  110   HD13  ILE  12          2HD1      ILE  12  -9.853  -2.591   1.393
  111    H    THR  13           H        THR  13 -10.171   0.877   5.624
  112    HA   THR  13           HA       THR  13 -12.017  -0.861   7.107
  113    HB   THR  13           HB       THR  13 -11.931   2.187   6.969
  114    HG1  THR  13           HG1      THR  13 -10.235   1.708   8.221
  115   HG21  THR  13          3HG2      THR  13 -13.480   2.117   8.885
  116   HG22  THR  13          1HG2      THR  13 -13.524   0.354   8.810
  117   HG23  THR  13          2HG2      THR  13 -14.198   1.312   7.489
  118    H    CYS  14           H        CYS  14 -13.585  -1.680   5.930
  119    HA   CYS  14           HA       CYS  14 -15.142  -0.006   4.076
  120    HB2  CYS  14           2HB      CYS  14 -13.635  -1.354   2.677
  121    HB3  CYS  14           3HB      CYS  14 -14.185  -2.827   3.469
  122    H    ASN  15           H        ASN  15 -17.266  -0.192   4.378
  123    HA   ASN  15           HA       ASN  15 -19.344  -0.881   4.950
  124    HB2  ASN  15           2HB      ASN  15 -18.602  -3.058   3.859
  125    HB3  ASN  15           3HB      ASN  15 -18.159  -3.656   5.454
  126   HD21  ASN  15          1HD2      ASN  15 -19.632  -5.329   5.499
  127   HD22  ASN  15          2HD2      ASN  15 -21.345  -5.097   5.524
  128    H    GLY  16           H        GLY  16 -17.497   0.262   6.860
  129    HA2  GLY  16           2HA      GLY  16 -17.728   0.977   9.054
  130    HA3  GLY  16           3HA      GLY  16 -18.918  -0.280   9.339
  131    H    LYS  17           H        LYS  17 -16.419  -1.865   7.940
  132    HA   LYS  17           HA       LYS  17 -15.444  -2.845  10.551
  133    HB2  LYS  17           2HB      LYS  17 -15.507  -4.220   7.826
  134    HB3  LYS  17           3HB      LYS  17 -14.939  -4.937   9.333
  135    HG2  LYS  17           2HG      LYS  17 -17.243  -4.768  10.263
  136    HG3  LYS  17           3HG      LYS  17 -17.796  -4.100   8.719
  137    HD2  LYS  17           2HD      LYS  17 -18.276  -6.522   8.833
  138    HD3  LYS  17           3HD      LYS  17 -17.100  -6.176   7.560
  139    HE2  LYS  17           2HE      LYS  17 -15.275  -6.792   9.238
  140    HE3  LYS  17           3HE      LYS  17 -16.558  -7.361  10.306
  141    HZ1  LYS  17           3HZ      LYS  17 -15.570  -9.145   9.003
  142    HZ2  LYS  17           1HZ      LYS  17 -16.030  -8.378   7.566
  143    HZ3  LYS  17           2HZ      LYS  17 -17.207  -8.955   8.627
  144    H    THR  18           H        THR  18 -13.308  -2.661  11.001
  145    HA   THR  18           HA       THR  18 -11.434  -1.689   8.943
  146    HB   THR  18           HB       THR  18 -11.061  -1.938  11.974
  147    HG1  THR  18           HG1      THR  18 -11.520   0.316  10.288
  148   HG21  THR  18          3HG2      THR  18  -9.012  -0.602  11.665
  149   HG22  THR  18          1HG2      THR  18  -9.252  -0.602   9.919
  150   HG23  THR  18          2HG2      THR  18  -8.892  -2.115  10.759
  151    H    TYR  19           H        TYR  19 -10.022  -3.043   8.080
  152    HA   TYR  19           HA       TYR  19  -9.328  -5.616   9.379
  153    HB2  TYR  19           2HB      TYR  19  -9.179  -4.884   6.399
  154    HB3  TYR  19           3HB      TYR  19  -8.785  -6.449   7.103
  155    HD1  TYR  19           HD1      TYR  19 -10.599  -7.955   7.913
  156    HD2  TYR  19           HD2      TYR  19 -11.515  -4.240   6.002
  157    HE1  TYR  19           HE1      TYR  19 -12.914  -8.701   7.569
  158    HE2  TYR  19           HE2      TYR  19 -13.835  -4.987   5.662
  159    HH   TYR  19           HH       TYR  19 -15.052  -7.160   5.470
  160    H    GLU  20           H        GLU  20  -7.108  -5.996   9.615
  161    HA   GLU  20           HA       GLU  20  -5.165  -4.255   8.330
  162    HB2  GLU  20           2HB      GLU  20  -3.994  -3.633  10.376
  163    HB3  GLU  20           3HB      GLU  20  -5.636  -3.025  10.407
  164    HG2  GLU  20           2HG      GLU  20  -4.655  -5.462  11.928
  165    HG3  GLU  20           3HG      GLU  20  -4.845  -3.849  12.608
  166    H    ARG  21           H        ARG  21  -3.429  -5.342   7.745
  167    HA   ARG  21           HA       ARG  21  -2.428  -7.678   9.129
  168    HB2  ARG  21           2HB      ARG  21  -4.156  -8.702   7.664
  169    HB3  ARG  21           3HB      ARG  21  -3.459  -7.907   6.256
  170    HG2  ARG  21           2HG      ARG  21  -1.393  -9.234   6.517
  171    HG3  ARG  21           3HG      ARG  21  -2.065 -10.014   7.951
  172    HD2  ARG  21           2HD      ARG  21  -3.796 -11.086   6.611
  173    HD3  ARG  21           3HD      ARG  21  -3.280 -10.198   5.169
  174    HE   ARG  21           HE       ARG  21  -1.208 -11.811   6.377
  175   HH11  ARG  21          1HH1      ARG  21  -3.865 -11.890   4.062
  176   HH12  ARG  21          2HH1      ARG  21  -3.208 -13.234   3.192
  177   HH21  ARG  21          1HH2      ARG  21  -0.335 -13.525   5.177
  178   HH22  ARG  21          2HH2      ARG  21  -1.213 -14.158   3.824
  179    H    THR  22           H        THR  22  -0.257  -7.782   8.879
  180    HA   THR  22           HA       THR  22   1.067  -5.861   7.077
  181    HB   THR  22           HB       THR  22   2.288  -7.384   9.428
  182    HG1  THR  22           HG1      THR  22   0.421  -5.763   9.793
  183   HG21  THR  22          3HG2      THR  22   3.951  -6.468   7.855
  184   HG22  THR  22          1HG2      THR  22   3.966  -5.544   9.360
  185   HG23  THR  22          2HG2      THR  22   3.172  -4.885   7.929
  186    H    TYR  23           H        TYR  23   1.920  -6.660   5.241
  187    HA   TYR  23           HA       TYR  23   2.206  -9.564   4.847
  188    HB2  TYR  23           2HB      TYR  23   2.121  -7.288   2.799
  189    HB3  TYR  23           3HB      TYR  23   2.164  -9.004   2.417
  190    HD1  TYR  23           HD1      TYR  23   0.073  -6.399   4.104
  191    HD2  TYR  23           HD2      TYR  23   0.116 -10.231   2.204
  192    HE1  TYR  23           HE1      TYR  23  -2.377  -6.433   4.121
  193    HE2  TYR  23           HE2      TYR  23  -2.345 -10.261   2.224
  194    HH   TYR  23           HH       TYR  23  -4.200  -9.229   3.422
  195    H    GLN  24           H        GLN  24   4.135 -10.486   4.518
  196    HA   GLN  24           HA       GLN  24   6.577  -8.838   4.715
  197    HB2  GLN  24           2HB      GLN  24   6.102 -11.837   5.057
  198    HB3  GLN  24           3HB      GLN  24   7.709 -11.121   5.031
  199    HG2  GLN  24           2HG      GLN  24   7.072 -11.472   7.330
  200    HG3  GLN  24           3HG      GLN  24   7.099  -9.740   7.016
  201   HE21  GLN  24          1HE2      GLN  24   5.705  -9.198   8.687
  202   HE22  GLN  24          2HE2      GLN  24   4.027  -9.612   8.695
  203    H    LEU  25           H        LEU  25   7.339  -8.172   2.845
  204    HA   LEU  25           HA       LEU  25   7.163  -9.823   0.390
  205    HB2  LEU  25           2HB      LEU  25   6.935  -6.784   0.639
  206    HB3  LEU  25           3HB      LEU  25   6.913  -7.681  -0.870
  207    HG   LEU  25           HG       LEU  25   4.775  -7.808   1.297
  208   HD11  LEU  25          1HD1      LEU  25   4.678  -6.494  -1.439
  209   HD12  LEU  25          2HD1      LEU  25   4.759  -5.665   0.118
  210   HD13  LEU  25          3HD1      LEU  25   3.338  -6.621  -0.292
  211   HD21  LEU  25          3HD2      LEU  25   4.842  -9.164  -1.423
  212   HD22  LEU  25          1HD2      LEU  25   3.455  -9.124  -0.327
  213   HD23  LEU  25          2HD2      LEU  25   4.931  -9.956   0.155
  214    H    TYR  26           H        TYR  26   9.251 -10.517   0.082
  215    HA   TYR  26           HA       TYR  26  11.518  -8.705   0.524
  216    HB2  TYR  26           2HB      TYR  26  11.782 -11.041   1.286
  217    HB3  TYR  26           3HB      TYR  26  11.459 -11.640  -0.340
  218    HD1  TYR  26           HD1      TYR  26  13.824  -9.428   1.554
  219    HD2  TYR  26           HD2      TYR  26  13.323 -11.996  -1.829
  220    HE1  TYR  26           HE1      TYR  26  16.201  -9.191   1.031
  221    HE2  TYR  26           HE2      TYR  26  15.724 -11.760  -2.351
  222    HH   TYR  26           HH       TYR  26  17.948 -10.359  -0.154
  223    H    ALA  27           H        ALA  27  12.608  -7.692  -1.108
  224    HA   ALA  27           HA       ALA  27  12.312  -8.533  -3.905
  225    HB1  ALA  27           3HB      ALA  27  10.509  -6.903  -3.657
  226    HB2  ALA  27           1HB      ALA  27  11.794  -6.212  -4.648
  227    HB3  ALA  27           2HB      ALA  27  11.621  -5.726  -2.957
  228    H    VAL  28           H        VAL  28  14.003  -7.914  -5.207
  229    HA   VAL  28           HA       VAL  28  16.517  -7.198  -3.998
  230    HB   VAL  28           HB       VAL  28  15.763  -7.551  -6.940
  231   HG11  VAL  28          1HG1      VAL  28  17.793  -6.179  -6.742
  232   HG12  VAL  28          2HG1      VAL  28  18.184  -7.771  -7.392
  233   HG13  VAL  28          3HG1      VAL  28  18.540  -7.399  -5.705
  234   HG21  VAL  28          3HG2      VAL  28  16.789  -9.791  -6.767
  235   HG22  VAL  28          1HG2      VAL  28  15.437  -9.623  -5.644
  236   HG23  VAL  28          2HG2      VAL  28  17.096  -9.530  -5.047
  237    H    ARG  29           H        ARG  29  14.528  -5.725  -6.581
  238    HA   ARG  29           HA       ARG  29  15.615  -3.039  -5.999
  239    HB2  ARG  29           2HB      ARG  29  13.875  -3.944  -8.342
  240    HB3  ARG  29           3HB      ARG  29  14.641  -2.370  -8.158
  241    HG2  ARG  29           2HG      ARG  29  16.862  -3.418  -8.390
  242    HG3  ARG  29           3HG      ARG  29  16.100  -5.006  -8.539
  243    HD2  ARG  29           2HD      ARG  29  14.919  -4.227 -10.582
  244    HD3  ARG  29           3HD      ARG  29  15.733  -2.664 -10.445
  245    HE   ARG  29           HE       ARG  29  17.586  -4.847 -10.547
  246   HH11  ARG  29          1HH1      ARG  29  15.578  -2.767 -12.583
  247   HH12  ARG  29          2HH1      ARG  29  16.559  -3.006 -13.994
  248   HH21  ARG  29          1HH2      ARG  29  18.810  -5.210 -12.445
  249   HH22  ARG  29          2HH2      ARG  29  18.385  -4.388 -13.914
  250    H    ASP  30           H        ASP  30  14.049  -1.240  -5.970
  251    HA   ASP  30           HA       ASP  30  11.637  -1.680  -4.507
  252    HB2  ASP  30           2HB      ASP  30  11.220   0.783  -4.958
  253    HB3  ASP  30           3HB      ASP  30  12.752   0.417  -4.178
  254    H    GLU  31           H        GLU  31  12.415  -1.486  -7.905
  255    HA   GLU  31           HA       GLU  31   9.886  -1.099  -9.084
  256    HB2  GLU  31           2HB      GLU  31  12.160  -2.801 -10.194
  257    HB3  GLU  31           3HB      GLU  31  10.847  -2.076 -11.120
  258    HG2  GLU  31           2HG      GLU  31  11.743   0.186 -10.469
  259    HG3  GLU  31           3HG      GLU  31  13.120  -0.635  -9.729
  260    H    GLU  32           H        GLU  32  11.473  -3.964  -7.822
  261    HA   GLU  32           HA       GLU  32   9.686  -5.906  -8.899
  262    HB2  GLU  32           2HB      GLU  32  11.404  -6.252  -6.413
  263    HB3  GLU  32           3HB      GLU  32  10.822  -7.505  -7.500
  264    HG2  GLU  32           2HG      GLU  32  12.952  -5.436  -8.055
  265    HG3  GLU  32           3HG      GLU  32  13.185  -7.166  -7.846
  266    H    LEU  33           H        LEU  33   9.702  -3.889  -6.040
  267    HA   LEU  33           HA       LEU  33   7.742  -5.386  -4.560
  268    HB2  LEU  33           2HB      LEU  33   9.624  -3.530  -3.824
  269    HB3  LEU  33           3HB      LEU  33   8.212  -2.500  -3.866
  270    HG   LEU  33           HG       LEU  33   8.661  -3.321  -1.583
  271   HD11  LEU  33          1HD1      LEU  33   6.484  -4.192  -0.938
  272   HD12  LEU  33          2HD1      LEU  33   6.105  -4.566  -2.622
  273   HD13  LEU  33          3HD1      LEU  33   6.316  -2.889  -2.114
  274   HD21  LEU  33          3HD2      LEU  33   8.426  -5.702  -0.978
  275   HD22  LEU  33          1HD2      LEU  33   9.772  -5.420  -2.078
  276   HD23  LEU  33          2HD2      LEU  33   8.272  -6.117  -2.686
  277    H    LYS  34           H        LYS  34   7.602  -2.962  -7.066
  278    HA   LYS  34           HA       LYS  34   5.147  -1.702  -6.593
  279    HB2  LYS  34           2HB      LYS  34   6.360  -2.447  -9.294
  280    HB3  LYS  34           3HB      LYS  34   5.035  -1.308  -9.062
  281    HG2  LYS  34           2HG      LYS  34   6.535   0.174  -7.772
  282    HG3  LYS  34           3HG      LYS  34   7.862  -0.968  -8.014
  283    HD2  LYS  34           2HD      LYS  34   8.042   0.878  -9.621
  284    HD3  LYS  34           3HD      LYS  34   7.697  -0.629 -10.472
  285    HE2  LYS  34           2HE      LYS  34   5.283   0.035 -10.577
  286    HE3  LYS  34           3HE      LYS  34   5.707   1.567  -9.811
  287    HZ1  LYS  34           3HZ      LYS  34   7.151   2.048 -11.711
  288    HZ2  LYS  34           1HZ      LYS  34   5.551   1.821 -12.190
  289    HZ3  LYS  34           2HZ      LYS  34   6.687   0.601 -12.447
  290    H    GLU  35           H        GLU  35   5.757  -4.553  -8.690
  291    HA   GLU  35           HA       GLU  35   3.076  -5.158  -9.211
  292    HB2  GLU  35           2HB      GLU  35   3.921  -7.385 -10.017
  293    HB3  GLU  35           3HB      GLU  35   4.765  -6.000 -10.687
  294    HG2  GLU  35           2HG      GLU  35   6.513  -7.446 -10.299
  295    HG3  GLU  35           3HG      GLU  35   6.546  -6.483  -8.825
  296    H    LYS  36           H        LYS  36   5.080  -6.014  -6.464
  297    HA   LYS  36           HA       LYS  36   3.445  -8.118  -5.433
  298    HB2  LYS  36           2HB      LYS  36   5.394  -6.327  -3.905
  299    HB3  LYS  36           3HB      LYS  36   4.751  -7.878  -3.353
  300    HG2  LYS  36           2HG      LYS  36   5.856  -8.988  -5.282
  301    HG3  LYS  36           3HG      LYS  36   6.545  -7.433  -5.751
  302    HD2  LYS  36           2HD      LYS  36   7.707  -7.366  -3.507
  303    HD3  LYS  36           3HD      LYS  36   7.128  -9.012  -3.218
  304    HE2  LYS  36           2HE      LYS  36   8.977  -8.098  -5.448
  305    HE3  LYS  36           3HE      LYS  36   9.409  -9.095  -4.061
  306    HZ1  LYS  36           3HZ      LYS  36   9.114 -10.451  -6.012
  307    HZ2  LYS  36           1HZ      LYS  36   7.547  -9.850  -6.247
  308    HZ3  LYS  36           2HZ      LYS  36   7.892 -10.805  -4.897
  309    H    LEU  37           H        LEU  37   3.646  -4.626  -4.788
  310    HA   LEU  37           HA       LEU  37   1.621  -4.423  -2.853
  311    HB2  LEU  37           2HB      LEU  37   2.568  -2.406  -4.923
  312    HB3  LEU  37           3HB      LEU  37   1.426  -2.009  -3.646
  313    HG   LEU  37           HG       LEU  37   4.284  -2.951  -3.198
  314   HD11  LEU  37          1HD1      LEU  37   4.227  -0.718  -4.174
  315   HD12  LEU  37          2HD1      LEU  37   4.750  -0.655  -2.494
  316   HD13  LEU  37          3HD1      LEU  37   3.105  -0.176  -2.924
  317   HD21  LEU  37          3HD2      LEU  37   2.219  -1.981  -1.187
  318   HD22  LEU  37          1HD2      LEU  37   3.911  -2.351  -0.836
  319   HD23  LEU  37          2HD2      LEU  37   2.821  -3.634  -1.354
  320    H    LYS  38           H        LYS  38   1.437  -4.308  -6.436
  321    HA   LYS  38           HA       LYS  38  -1.334  -3.898  -6.658
  322    HB2  LYS  38           2HB      LYS  38   0.578  -5.338  -8.547
  323    HB3  LYS  38           3HB      LYS  38  -1.052  -4.820  -8.979
  324    HG2  LYS  38           2HG      LYS  38  -0.438  -2.479  -8.632
  325    HG3  LYS  38           3HG      LYS  38   1.170  -2.955  -8.084
  326    HD2  LYS  38           2HD      LYS  38   1.618  -3.903 -10.365
  327    HD3  LYS  38           3HD      LYS  38   0.037  -3.313 -10.890
  328    HE2  LYS  38           2HE      LYS  38   0.734  -0.999 -10.442
  329    HE3  LYS  38           3HE      LYS  38   2.293  -1.566  -9.838
  330    HZ1  LYS  38           3HZ      LYS  38   2.510  -0.796 -12.089
  331    HZ2  LYS  38           1HZ      LYS  38   1.286  -1.835 -12.624
  332    HZ3  LYS  38           2HZ      LYS  38   2.745  -2.471 -12.063
  333    H    LYS  39           H        LYS  39   0.544  -6.940  -6.315
  334    HA   LYS  39           HA       LYS  39  -1.606  -8.767  -6.557
  335    HB2  LYS  39           2HB      LYS  39   0.856  -9.128  -4.780
  336    HB3  LYS  39           3HB      LYS  39  -0.227 -10.406  -5.315
  337    HG2  LYS  39           2HG      LYS  39   1.681  -8.798  -7.023
  338    HG3  LYS  39           3HG      LYS  39   1.836 -10.493  -6.573
  339    HD2  LYS  39           2HD      LYS  39  -0.184 -11.029  -7.916
  340    HD3  LYS  39           3HD      LYS  39  -0.345  -9.323  -8.354
  341    HE2  LYS  39           2HE      LYS  39   1.973 -11.153  -9.090
  342    HE3  LYS  39           3HE      LYS  39   0.716 -10.568 -10.181
  343    HZ1  LYS  39           3HZ      LYS  39   1.513  -8.292  -9.734
  344    HZ2  LYS  39           1HZ      LYS  39   2.690  -9.268 -10.463
  345    HZ3  LYS  39           2HZ      LYS  39   2.776  -8.924  -8.808
  346    H    VAL  40           H        VAL  40  -0.095  -7.394  -3.637
  347    HA   VAL  40           HA       VAL  40  -1.694  -8.470  -1.654
  348    HB   VAL  40           HB       VAL  40  -0.128  -5.847  -1.717
  349   HG11  VAL  40          1HG1      VAL  40  -1.409  -7.135   0.719
  350   HG12  VAL  40          2HG1      VAL  40  -1.858  -5.588  -0.002
  351   HG13  VAL  40          3HG1      VAL  40  -0.277  -5.780   0.754
  352   HG21  VAL  40          3HG2      VAL  40   1.233  -7.904  -1.895
  353   HG22  VAL  40          1HG2      VAL  40   0.513  -8.519  -0.406
  354   HG23  VAL  40          2HG2      VAL  40   1.536  -7.079  -0.363
  355    H    LEU  41           H        LEU  41  -2.090  -5.356  -3.352
  356    HA   LEU  41           HA       LEU  41  -4.321  -4.469  -1.847
  357    HB2  LEU  41           2HB      LEU  41  -3.078  -3.560  -4.458
  358    HB3  LEU  41           3HB      LEU  41  -4.583  -2.845  -3.904
  359    HG   LEU  41           HG       LEU  41  -2.045  -2.849  -2.220
  360   HD11  LEU  41          1HD1      LEU  41  -1.627  -1.588  -4.278
  361   HD12  LEU  41          2HD1      LEU  41  -1.697  -0.524  -2.877
  362   HD13  LEU  41          3HD1      LEU  41  -3.068  -0.609  -3.988
  363   HD21  LEU  41          3HD2      LEU  41  -4.612  -1.237  -1.964
  364   HD22  LEU  41          1HD2      LEU  41  -3.188  -1.099  -0.926
  365   HD23  LEU  41          2HD2      LEU  41  -4.125  -2.590  -0.934
  366    H    ASN  42           H        ASN  42  -4.124  -6.050  -5.093
  367    HA   ASN  42           HA       ASN  42  -6.913  -5.991  -5.584
  368    HB2  ASN  42           2HB      ASN  42  -4.689  -7.724  -6.735
  369    HB3  ASN  42           3HB      ASN  42  -6.353  -7.827  -7.308
  370   HD21  ASN  42          1HD2      ASN  42  -3.881  -6.941  -8.691
  371   HD22  ASN  42          2HD2      ASN  42  -4.231  -5.363  -9.296
  372    H    GLU  43           H        GLU  43  -4.886  -8.546  -4.097
  373    HA   GLU  43           HA       GLU  43  -6.902 -10.506  -3.746
  374    HB2  GLU  43           2HB      GLU  43  -4.366  -9.968  -2.141
  375    HB3  GLU  43           3HB      GLU  43  -5.382 -11.382  -1.892
  376    HG2  GLU  43           2HG      GLU  43  -3.905 -10.697  -4.448
  377    HG3  GLU  43           3HG      GLU  43  -3.393 -11.883  -3.252
  378    H    ARG  44           H        ARG  44  -5.663  -8.018  -1.563
  379    HA   ARG  44           HA       ARG  44  -7.274  -8.550   0.687
  380    HB2  ARG  44           2HB      ARG  44  -5.159  -7.303   0.809
  381    HB3  ARG  44           3HB      ARG  44  -5.816  -6.029  -0.209
  382    HG2  ARG  44           2HG      ARG  44  -5.732  -5.308   2.104
  383    HG3  ARG  44           3HG      ARG  44  -7.407  -5.416   1.561
  384    HD2  ARG  44           2HD      ARG  44  -7.765  -7.447   2.804
  385    HD3  ARG  44           3HD      ARG  44  -6.038  -7.619   3.157
  386    HE   ARG  44           HE       ARG  44  -7.948  -5.859   4.450
  387   HH11  ARG  44          1HH1      ARG  44  -4.546  -6.666   4.033
  388   HH12  ARG  44          2HH1      ARG  44  -4.058  -5.787   5.446
  389   HH21  ARG  44          1HH2      ARG  44  -7.252  -4.603   6.179
  390   HH22  ARG  44          2HH2      ARG  44  -5.592  -4.626   6.649
  391    H    MET  45           H        MET  45  -7.690  -6.358  -2.074
  392    HA   MET  45           HA       MET  45 -10.138  -5.227  -0.941
  393    HB2  MET  45           2HB      MET  45  -8.537  -4.420  -3.391
  394    HB3  MET  45           3HB      MET  45 -10.037  -3.648  -2.905
  395    HG2  MET  45           2HG      MET  45  -8.849  -3.179  -0.653
  396    HG3  MET  45           3HG      MET  45  -7.366  -3.595  -1.513
  397    HE1  MET  45           3HE      MET  45 -10.108  -0.059  -2.685
  398    HE2  MET  45           1HE      MET  45 -10.412  -1.093  -1.290
  399    HE3  MET  45           2HE      MET  45 -10.588  -1.738  -2.924
  400    H    ASP  46           H        ASP  46  -9.637  -7.994  -2.559
  401    HA   ASP  46           HA       ASP  46 -11.727  -7.811  -4.507
  402    HB2  ASP  46           2HB      ASP  46  -9.908  -9.519  -4.683
  403    HB3  ASP  46           3HB      ASP  46 -10.594 -10.372  -3.303
  404    HA   PRO  47           HA       PRO  47 -14.632  -9.788  -1.117
  405    HB2  PRO  47           2HB      PRO  47 -13.874  -9.708   1.515
  406    HB3  PRO  47           3HB      PRO  47 -13.462 -11.074   0.455
  407    HG2  PRO  47           2HG      PRO  47 -11.754  -8.713   1.211
  408    HG3  PRO  47           3HG      PRO  47 -11.332 -10.441   1.211
  409    HD2  PRO  47           2HD      PRO  47 -10.618  -8.817  -0.823
  410    HD3  PRO  47           3HD      PRO  47 -11.074 -10.514  -1.110
  411    H    ILE  48           H        ILE  48 -12.666  -6.982  -0.705
  412    HA   ILE  48           HA       ILE  48 -14.466  -5.331   0.792
  413    HB   ILE  48           HB       ILE  48 -12.094  -4.653  -0.993
  414   HG12  ILE  48          2HG1      ILE  48 -11.452  -6.023   0.944
  415   HG13  ILE  48          3HG1      ILE  48 -10.806  -4.400   1.111
  416   HG21  ILE  48          1HG2      ILE  48 -11.999  -2.447   0.089
  417   HG22  ILE  48          2HG2      ILE  48 -13.511  -2.797   0.924
  418   HG23  ILE  48          3HG2      ILE  48 -13.488  -2.671  -0.832
  419   HD11  ILE  48          3HD1      ILE  48 -12.573  -3.887   2.741
  420   HD12  ILE  48          1HD1      ILE  48 -11.576  -5.257   3.223
  421   HD13  ILE  48          2HD1      ILE  48 -13.190  -5.533   2.572
  422    H    LYS  49           H        LYS  49 -13.937  -5.983  -2.701
  423    HA   LYS  49           HA       LYS  49 -15.743  -4.093  -3.799
  424    HB2  LYS  49           2HB      LYS  49 -15.231  -6.914  -4.853
  425    HB3  LYS  49           3HB      LYS  49 -15.889  -5.556  -5.764
  426    HG2  LYS  49           2HG      LYS  49 -13.748  -4.415  -5.711
  427    HG3  LYS  49           3HG      LYS  49 -13.075  -5.655  -4.650
  428    HD2  LYS  49           2HD      LYS  49 -13.393  -7.352  -6.441
  429    HD3  LYS  49           3HD      LYS  49 -14.034  -6.096  -7.505
  430    HE2  LYS  49           2HE      LYS  49 -11.683  -6.596  -8.025
  431    HE3  LYS  49           3HE      LYS  49 -11.859  -4.942  -7.454
  432    HZ1  LYS  49           3HZ      LYS  49 -10.853  -7.248  -5.894
  433    HZ2  LYS  49           1HZ      LYS  49 -11.119  -5.702  -5.255
  434    HZ3  LYS  49           2HZ      LYS  49  -9.954  -5.934  -6.455
  435    H    LYS  50           H        LYS  50 -16.142  -7.372  -2.538
  436    HA   LYS  50           HA       LYS  50 -18.905  -7.724  -3.044
  437    HB2  LYS  50           2HB      LYS  50 -17.330  -9.575  -2.660
  438    HB3  LYS  50           3HB      LYS  50 -17.055  -9.055  -1.013
  439    HG2  LYS  50           2HG      LYS  50 -19.826  -9.897  -1.901
  440    HG3  LYS  50           3HG      LYS  50 -18.615 -11.117  -1.515
  441    HD2  LYS  50           2HD      LYS  50 -19.661  -8.970   0.373
  442    HD3  LYS  50           3HD      LYS  50 -20.083 -10.682   0.410
  443    HE2  LYS  50           2HE      LYS  50 -17.273  -9.597   0.848
  444    HE3  LYS  50           3HE      LYS  50 -18.393 -10.039   2.137
  445    HZ1  LYS  50           3HZ      LYS  50 -17.397 -11.904   0.053
  446    HZ2  LYS  50           1HZ      LYS  50 -18.391 -12.295   1.361
  447    HZ3  LYS  50           2HZ      LYS  50 -16.805 -11.797   1.629
  448    H    LEU  51           H        LEU  51 -17.149  -6.226  -0.368
  449    HA   LEU  51           HA       LEU  51 -19.414  -5.898   1.370
  450    HB2  LEU  51           2HB      LEU  51 -16.757  -4.420   1.275
  451    HB3  LEU  51           3HB      LEU  51 -17.964  -4.190   2.532
  452    HG   LEU  51           HG       LEU  51 -16.409  -6.749   1.982
  453   HD11  LEU  51          1HD1      LEU  51 -16.271  -4.844   4.337
  454   HD12  LEU  51          2HD1      LEU  51 -15.068  -5.015   3.055
  455   HD13  LEU  51          3HD1      LEU  51 -15.371  -6.355   4.157
  456   HD21  LEU  51          3HD2      LEU  51 -17.498  -7.680   3.985
  457   HD22  LEU  51          1HD2      LEU  51 -18.663  -7.329   2.710
  458   HD23  LEU  51          2HD2      LEU  51 -18.527  -6.249   4.101
  459    H    GLY  52           H        GLY  52 -17.977  -4.031  -1.252
  460    HA2  GLY  52           2HA      GLY  52 -18.977  -2.614  -2.735
  461    HA3  GLY  52           3HA      GLY  52 -20.508  -2.893  -1.923
  462    H    CYS  53           H        CYS  53 -17.394  -1.347  -1.065
  463    HA   CYS  53           HA       CYS  53 -18.789   0.861   0.225
  464    HB2  CYS  53           2HB      CYS  53 -15.855   0.128   0.020
  465    HB3  CYS  53           3HB      CYS  53 -16.430   1.592   0.815
  466    H    LYS  54           H        LYS  54 -19.310   2.654  -0.785
  467    HA   LYS  54           HA       LYS  54 -18.561   3.551  -3.333
  468    HB2  LYS  54           2HB      LYS  54 -20.571   4.393  -2.260
  469    HB3  LYS  54           3HB      LYS  54 -19.659   4.998  -0.885
  470    HG2  LYS  54           2HG      LYS  54 -20.399   6.846  -2.298
  471    HG3  LYS  54           3HG      LYS  54 -18.636   6.733  -2.311
  472    HD2  LYS  54           2HD      LYS  54 -18.766   5.541  -4.505
  473    HD3  LYS  54           3HD      LYS  54 -20.519   5.753  -4.494
  474    HE2  LYS  54           2HE      LYS  54 -20.235   8.195  -4.555
  475    HE3  LYS  54           3HE      LYS  54 -18.479   8.005  -4.492
  476    HZ1  LYS  54           3HZ      LYS  54 -18.570   6.831  -6.604
  477    HZ2  LYS  54           1HZ      LYS  54 -19.229   8.379  -6.744
  478    HZ3  LYS  54           2HZ      LYS  54 -20.247   7.035  -6.675
  479    H    ARG  55           H        ARG  55 -17.218   4.247  -0.122
  480    HA   ARG  55           HA       ARG  55 -14.675   4.994  -1.385
  481    HB2  ARG  55           2HB      ARG  55 -15.828   7.131  -0.819
  482    HB3  ARG  55           3HB      ARG  55 -15.961   6.620   0.861
  483    HG2  ARG  55           2HG      ARG  55 -13.527   6.667   1.112
  484    HG3  ARG  55           3HG      ARG  55 -13.324   7.030  -0.602
  485    HD2  ARG  55           2HD      ARG  55 -14.723   8.845   1.394
  486    HD3  ARG  55           3HD      ARG  55 -13.043   9.013   0.881
  487    HE   ARG  55           HE       ARG  55 -15.021   9.044  -1.260
  488   HH11  ARG  55          1HH1      ARG  55 -13.062  11.007   0.935
  489   HH12  ARG  55          2HH1      ARG  55 -13.201  12.436  -0.037
  490   HH21  ARG  55          1HH2      ARG  55 -15.176  10.953  -2.520
  491   HH22  ARG  55          2HH2      ARG  55 -14.393  12.400  -1.984
  492    H    VAL  56           H        VAL  56 -12.947   4.177  -0.376
  493    HA   VAL  56           HA       VAL  56 -13.309   2.606   2.129
  494    HB   VAL  56           HB       VAL  56 -11.354   1.205   1.321
  495   HG11  VAL  56          1HG1      VAL  56 -12.641  -0.149  -0.290
  496   HG12  VAL  56          2HG1      VAL  56 -13.795   1.174  -0.487
  497   HG13  VAL  56          3HG1      VAL  56 -13.634   0.368   1.075
  498   HG21  VAL  56          3HG2      VAL  56 -11.767   2.661  -1.327
  499   HG22  VAL  56          1HG2      VAL  56 -10.715   1.264  -1.073
  500   HG23  VAL  56          2HG2      VAL  56 -10.354   2.795  -0.278
  501    H    ARG  57           H        ARG  57 -11.767   2.848   3.751
  502    HA   ARG  57           HA       ARG  57  -9.828   5.060   3.460
  503    HB2  ARG  57           2HB      ARG  57 -11.431   5.149   5.399
  504    HB3  ARG  57           3HB      ARG  57 -10.812   3.605   5.969
  505    HG2  ARG  57           2HG      ARG  57  -9.794   5.291   7.315
  506    HG3  ARG  57           3HG      ARG  57  -8.540   4.707   6.219
  507    HD2  ARG  57           2HD      ARG  57  -8.386   7.111   6.364
  508    HD3  ARG  57           3HD      ARG  57  -8.991   6.709   4.750
  509    HE   ARG  57           HE       ARG  57 -11.195   7.113   6.441
  510   HH11  ARG  57          1HH1      ARG  57  -8.610   9.082   5.065
  511   HH12  ARG  57          2HH1      ARG  57  -9.548  10.537   5.095
  512   HH21  ARG  57          1HH2      ARG  57 -12.378   9.041   6.527
  513   HH22  ARG  57          2HH2      ARG  57 -11.688  10.515   5.929
  514    H    ILE  58           H        ILE  58  -8.019   4.178   2.553
  515    HA   ILE  58           HA       ILE  58  -6.921   1.618   3.536
  516    HB   ILE  58           HB       ILE  58  -6.027   3.296   1.131
  517   HG12  ILE  58          2HG1      ILE  58  -7.709   0.743   1.119
  518   HG13  ILE  58          3HG1      ILE  58  -8.335   2.360   0.826
  519   HG21  ILE  58          1HG2      ILE  58  -4.719   1.318   0.451
  520   HG22  ILE  58          2HG2      ILE  58  -5.241   0.461   1.902
  521   HG23  ILE  58          3HG2      ILE  58  -4.215   1.888   2.045
  522   HD11  ILE  58          3HD1      ILE  58  -8.055   1.169  -1.247
  523   HD12  ILE  58          1HD1      ILE  58  -6.347   0.888  -0.906
  524   HD13  ILE  58          2HD1      ILE  58  -6.937   2.530  -1.184
  525    H    SER  59           H        SER  59  -5.084   1.623   4.739
  526    HA   SER  59           HA       SER  59  -3.540   4.111   5.148
  527    HB2  SER  59           2HB      SER  59  -5.316   3.964   6.908
  528    HB3  SER  59           3HB      SER  59  -4.749   2.361   7.358
  529    HG   SER  59           HG       SER  59  -3.571   4.873   7.780
  530    H    ILE  60           H        ILE  60  -1.613   3.433   4.340
  531    HA   ILE  60           HA       ILE  60  -0.664   0.692   4.956
  532    HB   ILE  60           HB       ILE  60  -0.344   2.300   2.399
  533   HG12  ILE  60          2HG1      ILE  60  -1.572  -0.430   3.006
  534   HG13  ILE  60          3HG1      ILE  60  -2.435   1.034   2.554
  535   HG21  ILE  60          1HG2      ILE  60   1.862   1.337   2.877
  536   HG22  ILE  60          2HG2      ILE  60   1.120   0.503   1.513
  537   HG23  ILE  60          3HG2      ILE  60   1.142  -0.257   3.106
  538   HD11  ILE  60          3HD1      ILE  60  -1.341   0.928   0.332
  539   HD12  ILE  60          1HD1      ILE  60  -2.372  -0.452   0.697
  540   HD13  ILE  60          2HD1      ILE  60  -0.620  -0.613   0.801
  541    H    ARG  61           H        ARG  61   0.924   0.700   6.363
  542    HA   ARG  61           HA       ARG  61   2.920   2.886   6.396
  543    HB2  ARG  61           2HB      ARG  61   1.682   2.448   8.538
  544    HB3  ARG  61           3HB      ARG  61   2.316   0.804   8.550
  545    HG2  ARG  61           2HG      ARG  61   4.604   1.654   8.777
  546    HG3  ARG  61           3HG      ARG  61   4.024   3.314   8.648
  547    HD2  ARG  61           2HD      ARG  61   2.738   2.978  10.777
  548    HD3  ARG  61           3HD      ARG  61   3.456   1.364  10.911
  549    HE   ARG  61           HE       ARG  61   5.528   3.221  10.582
  550   HH11  ARG  61          1HH1      ARG  61   3.150   2.411  13.049
  551   HH12  ARG  61          2HH1      ARG  61   4.148   2.976  14.352
  552   HH21  ARG  61          1HH2      ARG  61   6.807   3.980  12.292
  553   HH22  ARG  61          2HH2      ARG  61   6.216   3.864  13.921
  554    H    VAL  62           H        VAL  62   5.069   2.407   6.104
  555    HA   VAL  62           HA       VAL  62   5.746  -0.270   5.071
  556    HB   VAL  62           HB       VAL  62   6.317   1.732   3.685
  557   HG11  VAL  62          1HG1      VAL  62   8.254   2.500   5.888
  558   HG12  VAL  62          2HG1      VAL  62   6.768   3.365   5.478
  559   HG13  VAL  62          3HG1      VAL  62   8.094   3.289   4.314
  560   HG21  VAL  62          3HG2      VAL  62   8.770   0.247   4.682
  561   HG22  VAL  62          1HG2      VAL  62   8.670   1.169   3.178
  562   HG23  VAL  62          2HG2      VAL  62   7.678  -0.270   3.397
  563    H    LYS  63           H        LYS  63   7.195  -1.638   6.171
  564    HA   LYS  63           HA       LYS  63   8.437  -0.745   8.676
  565    HB2  LYS  63           2HB      LYS  63   7.549  -3.030   8.668
  566    HB3  LYS  63           3HB      LYS  63   8.455  -3.421   7.229
  567    HG2  LYS  63           2HG      LYS  63   9.542  -4.470   9.096
  568    HG3  LYS  63           3HG      LYS  63  10.575  -3.161   8.524
  569    HD2  LYS  63           2HD      LYS  63  10.592  -3.110  10.919
  570    HD3  LYS  63           3HD      LYS  63   9.657  -1.718  10.371
  571    HE2  LYS  63           2HE      LYS  63   8.549  -2.749  12.271
  572    HE3  LYS  63           3HE      LYS  63   7.560  -3.018  10.834
  573    HZ1  LYS  63           3HZ      LYS  63   8.571  -5.256  10.683
  574    HZ2  LYS  63           1HZ      LYS  63   7.700  -5.028  12.118
  575    HZ3  LYS  63           2HZ      LYS  63   9.385  -4.968  12.131
  576    H    HIS  64           H        HIS  64  10.404   0.103   8.640
  577    HA   HIS  64           HA       HIS  64  11.958   0.077   6.159
  578    HB2  HIS  64           2HB      HIS  64  13.328   1.830   7.298
  579    HB3  HIS  64           3HB      HIS  64  11.644   2.257   7.065
  580    HD1  HIS  64           HD1      HIS  64  13.833   0.875   9.884
  581    HD2  HIS  64           HD2      HIS  64  10.591   3.399   9.261
  582    HE1  HIS  64           HE1      HIS  64  13.307   1.867  12.129
  583    HE2  HIS  64           HE2      HIS  64  11.342   3.382  11.731
  584    H    SER  65           H        SER  65  14.081  -0.539   6.038
  585    HA   SER  65           HA       SER  65  14.782  -2.798   7.729
  586    HB2  SER  65           2HB      SER  65  16.146  -1.673   5.249
  587    HB3  SER  65           3HB      SER  65  16.481  -3.233   6.001
  588    HG   SER  65           HG       SER  65  13.833  -2.654   5.296
  589    H    ASP  66           H        ASP  66  16.343   0.265   6.715
  590    HA   ASP  66           HA       ASP  66  18.408  -0.002   8.796
  591    HB2  ASP  66           2HB      ASP  66  18.062   1.979   6.503
  592    HB3  ASP  66           3HB      ASP  66  19.369   2.073   7.678
  593    H    ALA  67           H        ALA  67  19.004   2.429   9.603
  594    HA   ALA  67           HA       ALA  67  16.589   3.496  10.954
  595    HB1  ALA  67           3HB      ALA  67  18.071   4.076  12.823
  596    HB2  ALA  67           1HB      ALA  67  19.456   3.419  11.945
  597    HB3  ALA  67           2HB      ALA  67  18.149   2.351  12.461
  598    H    ALA  68           H        ALA  68  19.661   4.373   9.350
  599    HA   ALA  68           HA       ALA  68  18.997   7.230   9.322
  600    HB1  ALA  68           3HB      ALA  68  21.169   7.503   8.204
  601    HB2  ALA  68           1HB      ALA  68  21.339   5.749   8.064
  602    HB3  ALA  68           2HB      ALA  68  21.340   6.513   9.655
  603    H    GLU  69           H        GLU  69  19.533   4.637   6.942
  604    HA   GLU  69           HA       GLU  69  19.115   6.164   4.594
  605    HB2  GLU  69           2HB      GLU  69  19.111   3.158   5.096
  606    HB3  GLU  69           3HB      GLU  69  18.958   3.843   3.485
  607    HG2  GLU  69           2HG      GLU  69  21.241   3.074   3.946
  608    HG3  GLU  69           3HG      GLU  69  21.189   4.813   3.638
  609    H    GLU  70           H        GLU  70  16.892   4.810   6.774
  610    HA   GLU  70           HA       GLU  70  14.786   4.017   5.059
  611    HB2  GLU  70           2HB      GLU  70  13.475   3.924   7.178
  612    HB3  GLU  70           3HB      GLU  70  14.968   3.005   7.177
  613    HG2  GLU  70           2HG      GLU  70  14.853   3.955   9.301
  614    HG3  GLU  70           3HG      GLU  70  16.013   4.954   8.430
  615    H    LYS  71           H        LYS  71  15.687   7.086   6.334
  616    HA   LYS  71           HA       LYS  71  13.196   8.446   6.106
  617    HB2  LYS  71           2HB      LYS  71  15.250   9.136   7.446
  618    HB3  LYS  71           3HB      LYS  71  16.013   9.608   5.933
  619    HG2  LYS  71           2HG      LYS  71  14.260  11.315   5.584
  620    HG3  LYS  71           3HG      LYS  71  13.466  10.801   7.078
  621    HD2  LYS  71           2HD      LYS  71  14.780  12.818   7.517
  622    HD3  LYS  71           3HD      LYS  71  15.497  11.448   8.373
  623    HE2  LYS  71           2HE      LYS  71  17.247  11.257   6.683
  624    HE3  LYS  71           3HE      LYS  71  16.493  12.518   5.706
  625    HZ1  LYS  71           3HZ      LYS  71  16.925  14.104   7.471
  626    HZ2  LYS  71           1HZ      LYS  71  18.364  13.369   6.978
  627    HZ3  LYS  71           2HZ      LYS  71  17.631  12.907   8.429
  628    H    LYS  72           H        LYS  72  15.822   7.703   3.908
  629    HA   LYS  72           HA       LYS  72  14.728   9.090   1.606
  630    HB2  LYS  72           2HB      LYS  72  17.170   8.784   1.865
  631    HB3  LYS  72           3HB      LYS  72  16.972   7.036   1.874
  632    HG2  LYS  72           2HG      LYS  72  16.190   7.110  -0.480
  633    HG3  LYS  72           3HG      LYS  72  16.372   8.866  -0.489
  634    HD2  LYS  72           2HD      LYS  72  18.621   6.857  -0.080
  635    HD3  LYS  72           3HD      LYS  72  18.281   7.710  -1.585
  636    HE2  LYS  72           2HE      LYS  72  19.116   9.009   1.035
  637    HE3  LYS  72           3HE      LYS  72  20.156   8.746  -0.364
  638    HZ1  LYS  72           3HZ      LYS  72  17.786  10.527  -0.226
  639    HZ2  LYS  72           1HZ      LYS  72  18.642  10.198  -1.645
  640    HZ3  LYS  72           2HZ      LYS  72  19.401  10.993  -0.364
  641    H    GLU  73           H        GLU  73  14.864   5.786   2.901
  642    HA   GLU  73           HA       GLU  73  13.864   4.392   0.642
  643    HB2  GLU  73           2HB      GLU  73  15.155   3.289   2.417
  644    HB3  GLU  73           3HB      GLU  73  13.875   3.599   3.583
  645    HG2  GLU  73           2HG      GLU  73  12.373   2.071   2.412
  646    HG3  GLU  73           3HG      GLU  73  13.550   1.846   1.123
  647    H    ALA  74           H        ALA  74  12.240   5.993   3.322
  648    HA   ALA  74           HA       ALA  74   9.632   4.928   2.932
  649    HB1  ALA  74           3HB      ALA  74  10.296   6.061   5.013
  650    HB2  ALA  74           1HB      ALA  74   8.867   6.819   4.309
  651    HB3  ALA  74           2HB      ALA  74  10.447   7.593   4.147
  652    H    LYS  75           H        LYS  75  11.218   7.931   1.802
  653    HA   LYS  75           HA       LYS  75   9.106   8.827   0.141
  654    HB2  LYS  75           2HB      LYS  75  10.925  10.295   1.038
  655    HB3  LYS  75           3HB      LYS  75  12.075   9.510  -0.036
  656    HG2  LYS  75           2HG      LYS  75  11.343  11.709  -0.901
  657    HG3  LYS  75           3HG      LYS  75  10.925  10.391  -1.994
  658    HD2  LYS  75           2HD      LYS  75   9.020  11.792  -1.988
  659    HD3  LYS  75           3HD      LYS  75   8.576  10.453  -0.937
  660    HE2  LYS  75           2HE      LYS  75   9.483  13.211  -0.037
  661    HE3  LYS  75           3HE      LYS  75   7.831  12.609  -0.025
  662    HZ1  LYS  75           3HZ      LYS  75  10.080  11.621   1.642
  663    HZ2  LYS  75           1HZ      LYS  75   8.548  10.914   1.591
  664    HZ3  LYS  75           2HZ      LYS  75   8.734  12.489   2.157
  665    H    LYS  76           H        LYS  76  11.799   6.658  -0.433
  666    HA   LYS  76           HA       LYS  76  11.665   6.416  -3.257
  667    HB2  LYS  76           2HB      LYS  76  13.579   5.597  -1.892
  668    HB3  LYS  76           3HB      LYS  76  12.536   4.401  -1.133
  669    HG2  LYS  76           2HG      LYS  76  12.196   3.448  -3.518
  670    HG3  LYS  76           3HG      LYS  76  13.571   4.457  -3.982
  671    HD2  LYS  76           2HD      LYS  76  13.561   2.243  -1.891
  672    HD3  LYS  76           3HD      LYS  76  14.324   2.177  -3.479
  673    HE2  LYS  76           2HE      LYS  76  15.917   3.929  -2.800
  674    HE3  LYS  76           3HE      LYS  76  15.126   4.057  -1.224
  675    HZ1  LYS  76           3HZ      LYS  76  15.707   1.692  -0.850
  676    HZ2  LYS  76           1HZ      LYS  76  17.062   2.686  -1.019
  677    HZ3  LYS  76           2HZ      LYS  76  16.578   1.695  -2.299
  678    H    PHE  77           H        PHE  77  10.188   4.647  -0.564
  679    HA   PHE  77           HA       PHE  77   8.697   2.772  -2.146
  680    HB2  PHE  77           2HB      PHE  77   9.570   2.360   0.207
  681    HB3  PHE  77           3HB      PHE  77   8.358   3.479   0.810
  682    HD1  PHE  77           HD1      PHE  77   8.801   0.236  -0.998
  683    HD2  PHE  77           HD2      PHE  77   6.130   2.695   1.269
  684    HE1  PHE  77           HE1      PHE  77   7.202  -1.621  -0.843
  685    HE2  PHE  77           HE2      PHE  77   4.537   0.824   1.411
  686    HZ   PHE  77           HZ       PHE  77   5.069  -1.332   0.352
  687    H    ALA  78           H        ALA  78   8.216   5.962  -0.921
  688    HA   ALA  78           HA       ALA  78   5.398   6.203  -1.096
  689    HB1  ALA  78           3HB      ALA  78   5.816   8.617  -1.114
  690    HB2  ALA  78           1HB      ALA  78   7.529   8.339  -1.456
  691    HB3  ALA  78           2HB      ALA  78   6.838   7.821   0.081
  692    H    ALA  79           H        ALA  79   8.041   6.818  -3.407
  693    HA   ALA  79           HA       ALA  79   6.483   7.636  -5.616
  694    HB1  ALA  79           3HB      ALA  79   8.910   8.014  -5.474
  695    HB2  ALA  79           1HB      ALA  79   8.506   7.136  -6.950
  696    HB3  ALA  79           2HB      ALA  79   9.203   6.277  -5.572
  697    H    ILE  80           H        ILE  80   7.565   4.480  -4.461
  698    HA   ILE  80           HA       ILE  80   6.663   2.859  -6.597
  699    HB   ILE  80           HB       ILE  80   7.182   2.185  -3.664
  700   HG12  ILE  80          2HG1      ILE  80   9.193   3.005  -4.718
  701   HG13  ILE  80          3HG1      ILE  80   9.363   1.262  -4.584
  702   HG21  ILE  80          1HG2      ILE  80   7.361  -0.176  -4.297
  703   HG22  ILE  80          2HG2      ILE  80   6.895   0.214  -5.952
  704   HG23  ILE  80          3HG2      ILE  80   5.743   0.441  -4.639
  705   HD11  ILE  80          3HD1      ILE  80  10.215   2.054  -6.696
  706   HD12  ILE  80          1HD1      ILE  80   8.671   2.805  -7.091
  707   HD13  ILE  80          2HD1      ILE  80   8.797   1.045  -6.977
  708    H    LEU  81           H        LEU  81   5.107   3.835  -3.524
  709    HA   LEU  81           HA       LEU  81   2.706   2.357  -3.833
  710    HB2  LEU  81           2HB      LEU  81   3.484   4.765  -2.156
  711    HB3  LEU  81           3HB      LEU  81   1.813   4.228  -2.190
  712    HG   LEU  81           HG       LEU  81   4.143   2.473  -1.302
  713   HD11  LEU  81          1HD1      LEU  81   3.353   2.824   0.992
  714   HD12  LEU  81          2HD1      LEU  81   2.139   3.969   0.416
  715   HD13  LEU  81          3HD1      LEU  81   3.856   4.341   0.250
  716   HD21  LEU  81          3HD2      LEU  81   2.236   1.177  -2.152
  717   HD22  LEU  81          1HD2      LEU  81   1.143   2.032  -1.060
  718   HD23  LEU  81          2HD2      LEU  81   2.405   0.979  -0.411
  719    H    ASN  82           H        ASN  82   3.673   5.657  -4.710
  720    HA   ASN  82           HA       ASN  82   1.165   6.675  -5.492
  721    HB2  ASN  82           2HB      ASN  82   3.052   8.180  -5.058
  722    HB3  ASN  82           3HB      ASN  82   3.968   7.488  -6.393
  723   HD21  ASN  82          1HD2      ASN  82   3.465   8.126  -8.515
  724   HD22  ASN  82          2HD2      ASN  82   2.402   9.444  -8.867
  725    H    LYS  83           H        LYS  83   3.733   5.054  -7.334
  726    HA   LYS  83           HA       LYS  83   2.580   5.167  -9.894
  727    HB2  LYS  83           2HB      LYS  83   4.535   3.206  -8.639
  728    HB3  LYS  83           3HB      LYS  83   4.021   3.050 -10.313
  729    HG2  LYS  83           2HG      LYS  83   5.524   5.394  -9.106
  730    HG3  LYS  83           3HG      LYS  83   6.188   4.156 -10.173
  731    HD2  LYS  83           2HD      LYS  83   4.089   6.234 -10.903
  732    HD3  LYS  83           3HD      LYS  83   5.775   6.217 -11.416
  733    HE2  LYS  83           2HE      LYS  83   5.395   4.165 -12.699
  734    HE3  LYS  83           3HE      LYS  83   3.723   4.094 -12.135
  735    HZ1  LYS  83           3HZ      LYS  83   4.881   6.279 -13.782
  736    HZ2  LYS  83           1HZ      LYS  83   3.279   6.165 -13.269
  737    HZ3  LYS  83           2HZ      LYS  83   3.897   5.032 -14.361
  738    H    VAL  84           H        VAL  84   2.305   2.697  -7.327
  739    HA   VAL  84           HA       VAL  84   0.883   0.757  -8.823
  740    HB   VAL  84           HB       VAL  84   1.182   1.210  -5.815
  741   HG11  VAL  84          1HG1      VAL  84   0.316  -1.104  -5.474
  742   HG12  VAL  84          2HG1      VAL  84  -0.142  -1.166  -7.176
  743   HG13  VAL  84          3HG1      VAL  84  -0.918  -0.008  -6.100
  744   HG21  VAL  84          3HG2      VAL  84   2.739  -0.704  -5.941
  745   HG22  VAL  84          1HG2      VAL  84   3.242   0.591  -7.029
  746   HG23  VAL  84          2HG2      VAL  84   2.443  -0.843  -7.676
  747    H    PHE  85           H        PHE  85  -0.220   3.163  -6.436
  748    HA   PHE  85           HA       PHE  85  -2.977   2.664  -6.553
  749    HB2  PHE  85           2HB      PHE  85  -1.484   5.215  -5.799
  750    HB3  PHE  85           3HB      PHE  85  -3.226   5.038  -5.625
  751    HD1  PHE  85           HD1      PHE  85  -3.741   2.492  -4.467
  752    HD2  PHE  85           HD2      PHE  85  -0.415   5.075  -3.698
  753    HE1  PHE  85           HE1      PHE  85  -3.445   1.467  -2.247
  754    HE2  PHE  85           HE2      PHE  85  -0.128   4.035  -1.488
  755    HZ   PHE  85           HZ       PHE  85  -1.641   2.240  -0.764
  756    H    ALA  86           H        ALA  86  -0.987   4.931  -8.454
  757    HA   ALA  86           HA       ALA  86  -3.083   6.149  -9.925
  758    HB1  ALA  86           3HB      ALA  86  -0.162   5.823 -10.692
  759    HB2  ALA  86           1HB      ALA  86  -0.839   7.137  -9.730
  760    HB3  ALA  86           2HB      ALA  86  -1.305   6.954 -11.424
  761    H    GLU  87           H        GLU  87  -1.298   3.152 -10.382
  762    HA   GLU  87           HA       GLU  87  -2.273   2.676 -13.094
  763    HB2  GLU  87           2HB      GLU  87  -0.499   1.024 -11.244
  764    HB3  GLU  87           3HB      GLU  87  -0.958   0.516 -12.868
  765    HG2  GLU  87           2HG      GLU  87   0.199   2.461 -13.837
  766    HG3  GLU  87           3HG      GLU  87   0.600   3.042 -12.221
  767    H    LEU  88           H        LEU  88  -3.579   2.281 -10.032
  768    HA   LEU  88           HA       LEU  88  -5.262  -0.041 -10.808
  769    HB2  LEU  88           2HB      LEU  88  -4.812   1.209  -8.063
  770    HB3  LEU  88           3HB      LEU  88  -5.945  -0.094  -8.387
  771    HG   LEU  88           HG       LEU  88  -2.913  -0.256  -8.622
  772   HD11  LEU  88          1HD1      LEU  88  -3.695  -0.236  -6.302
  773   HD12  LEU  88          2HD1      LEU  88  -3.033  -1.809  -6.736
  774   HD13  LEU  88          3HD1      LEU  88  -4.784  -1.587  -6.637
  775   HD21  LEU  88          3HD2      LEU  88  -3.930  -1.652 -10.351
  776   HD22  LEU  88          1HD2      LEU  88  -4.956  -2.441  -9.149
  777   HD23  LEU  88          2HD2      LEU  88  -3.201  -2.651  -9.098
  778    H    GLY  89           H        GLY  89  -5.228   3.356 -10.447
  779    HA2  GLY  89           2HA      GLY  89  -6.909   4.636 -11.572
  780    HA3  GLY  89           3HA      GLY  89  -8.128   3.492 -11.044
  781    H    TYR  90           H        TYR  90  -5.807   4.427  -8.669
  782    HA   TYR  90           HA       TYR  90  -7.679   6.201  -7.308
  783    HB2  TYR  90           2HB      TYR  90  -4.872   5.295  -6.515
  784    HB3  TYR  90           3HB      TYR  90  -5.938   6.271  -5.510
  785    HD1  TYR  90           HD2      TYR  90  -8.123   5.254  -4.678
  786    HD2  TYR  90           HD1      TYR  90  -5.088   2.889  -6.550
  787    HE1  TYR  90           HE2      TYR  90  -9.133   3.210  -3.755
  788    HE2  TYR  90           HE1      TYR  90  -6.100   0.850  -5.616
  789    HH   TYR  90           HH       TYR  90  -7.583   0.241  -3.695
  790    H    ASN  91           H        ASN  91  -7.566   8.326  -7.350
  791    HA   ASN  91           HA       ASN  91  -5.873   9.713  -9.242
  792    HB2  ASN  91           2HB      ASN  91  -8.321  10.174  -8.983
  793    HB3  ASN  91           3HB      ASN  91  -8.041  10.724  -7.339
  794   HD21  ASN  91          1HD2      ASN  91  -7.614  11.490 -10.727
  795   HD22  ASN  91          2HD2      ASN  91  -7.314  13.176 -10.506
  796    H    ASP  92           H        ASP  92  -4.617  11.670  -8.623
  797    HA   ASP  92           HA       ASP  92  -2.801  11.375  -6.518
  798    HB2  ASP  92           2HB      ASP  92  -2.231  12.681  -8.461
  799    HB3  ASP  92           3HB      ASP  92  -3.599  13.760  -8.238
  800    H    SER  93           H        SER  93  -5.762  13.281  -6.713
  801    HA   SER  93           HA       SER  93  -5.611  14.371  -4.061
  802    HB2  SER  93           2HB      SER  93  -6.780  15.445  -6.064
  803    HB3  SER  93           3HB      SER  93  -8.076  14.266  -5.853
  804    HG   SER  93           HG       SER  93  -7.342  15.626  -3.559
  805    H    ASN  94           H        ASN  94  -6.037  11.222  -4.835
  806    HA   ASN  94           HA       ASN  94  -7.846  10.666  -2.554
  807    HB2  ASN  94           2HB      ASN  94  -6.646   8.758  -4.616
  808    HB3  ASN  94           3HB      ASN  94  -7.671   8.258  -3.276
  809   HD21  ASN  94          1HD2      ASN  94  -9.410  10.752  -3.732
  810   HD22  ASN  94          2HD2      ASN  94 -10.359  10.323  -5.105
  811    H    VAL  95           H        VAL  95  -4.505  10.819  -3.423
  812    HA   VAL  95           HA       VAL  95  -3.633   9.062  -1.192
  813    HB   VAL  95           HB       VAL  95  -2.068   9.930  -3.680
  814   HG11  VAL  95          1HG1      VAL  95  -1.319   7.888  -1.551
  815   HG12  VAL  95          2HG1      VAL  95  -0.575   9.473  -1.779
  816   HG13  VAL  95          3HG1      VAL  95  -0.400   8.231  -3.020
  817   HG21  VAL  95          3HG2      VAL  95  -2.350   7.610  -4.493
  818   HG22  VAL  95          1HG2      VAL  95  -3.906   8.427  -4.308
  819   HG23  VAL  95          2HG2      VAL  95  -3.381   7.245  -3.106
  820    H    THR  96           H        THR  96  -2.955  10.196   0.573
  821    HA   THR  96           HA       THR  96  -0.971  12.344   0.249
  822    HB   THR  96           HB       THR  96  -3.407  12.600   2.084
  823    HG1  THR  96           HG1      THR  96  -3.694  13.132  -0.193
  824   HG21  THR  96          3HG2      THR  96  -1.073  14.534   1.750
  825   HG22  THR  96          1HG2      THR  96  -1.385  13.541   3.181
  826   HG23  THR  96          2HG2      THR  96  -2.516  14.815   2.725
  827    H    TRP  97           H        TRP  97   0.745  11.961   1.568
  828    HA   TRP  97           HA       TRP  97   0.798   9.730   3.390
  829    HB2  TRP  97           2HB      TRP  97   2.849  11.738   2.453
  830    HB3  TRP  97           3HB      TRP  97   3.185  10.836   3.922
  831    HD1  TRP  97           HD1      TRP  97   2.740  10.283   0.137
  832    HE1  TRP  97           HE1      TRP  97   3.773   8.012  -0.463
  833    HE3  TRP  97           HE3      TRP  97   3.762   8.574   4.854
  834    HZ2  TRP  97           HZ2      TRP  97   4.888   5.789   0.875
  835    HZ3  TRP  97           HZ3      TRP  97   4.811   6.356   5.106
  836    HH2  TRP  97           HH2      TRP  97   5.363   4.991   3.152
  837    H    ASP  98           H        ASP  98   1.268   9.764   5.566
  838    HA   ASP  98           HA       ASP  98   0.992  12.220   7.154
  839    HB2  ASP  98           2HB      ASP  98  -1.289  11.219   7.089
  840    HB3  ASP  98           3HB      ASP  98  -0.640   9.667   7.592
  841    H    GLY  99           H        GLY  99   3.286  11.860   7.176
  842    HA2  GLY  99           2HA      GLY  99   5.239  11.340   8.215
  843    HA3  GLY  99           3HA      GLY  99   4.283  10.661   9.521
  844    H    ASP 100           H        ASP 100   4.016   8.452   9.657
  845    HA   ASP 100           HA       ASP 100   5.961   6.810   8.228
  846    HB2  ASP 100           2HB      ASP 100   4.003   6.094  10.462
  847    HB3  ASP 100           3HB      ASP 100   5.239   5.011   9.828
  848    H    THR 101           H        THR 101   2.583   7.442   8.032
  849    HA   THR 101           HA       THR 101   2.040   4.939   6.518
  850    HB   THR 101           HB       THR 101   0.172   6.350   8.486
  851    HG1  THR 101           HG1      THR 101   1.847   5.337   9.620
  852   HG21  THR 101          3HG2      THR 101  -1.224   4.334   8.285
  853   HG22  THR 101          1HG2      THR 101  -0.109   3.663   7.095
  854   HG23  THR 101          2HG2      THR 101  -1.034   5.117   6.716
  855    H    VAL 102           H        VAL 102   0.845   5.224   4.627
  856    HA   VAL 102           HA       VAL 102   0.195   7.975   3.820
  857    HB   VAL 102           HB       VAL 102   1.520   6.524   2.254
  858   HG11  VAL 102          1HG1      VAL 102  -1.014   4.896   1.928
  859   HG12  VAL 102          2HG1      VAL 102   0.487   4.346   2.672
  860   HG13  VAL 102          3HG1      VAL 102   0.451   4.742   0.952
  861   HG21  VAL 102          3HG2      VAL 102  -1.159   7.446   1.158
  862   HG22  VAL 102          1HG2      VAL 102   0.292   7.136   0.196
  863   HG23  VAL 102          2HG2      VAL 102   0.280   8.444   1.381
  864    H    THR 103           H        THR 103  -1.862   8.663   3.517
  865    HA   THR 103           HA       THR 103  -4.144   6.957   4.260
  866    HB   THR 103           HB       THR 103  -3.997  10.006   4.034
  867    HG1  THR 103           HG1      THR 103  -2.651   9.199   5.718
  868   HG21  THR 103          3HG2      THR 103  -6.086   9.996   5.345
  869   HG22  THR 103          1HG2      THR 103  -6.094   8.233   5.353
  870   HG23  THR 103          2HG2      THR 103  -6.303   9.110   3.832
  871    H    VAL 104           H        VAL 104  -4.921   6.023   2.432
  872    HA   VAL 104           HA       VAL 104  -5.311   7.635  -0.031
  873    HB   VAL 104           HB       VAL 104  -4.853   4.615   0.200
  874   HG11  VAL 104          1HG1      VAL 104  -5.157   6.317  -2.305
  875   HG12  VAL 104          2HG1      VAL 104  -6.329   5.145  -1.698
  876   HG13  VAL 104          3HG1      VAL 104  -4.751   4.598  -2.268
  877   HG21  VAL 104          3HG2      VAL 104  -2.786   5.857   0.652
  878   HG22  VAL 104          1HG2      VAL 104  -2.982   6.773  -0.848
  879   HG23  VAL 104          2HG2      VAL 104  -2.682   5.036  -0.903
  880    H    GLU 105           H        GLU 105  -7.432   8.163  -0.119
  881    HA   GLU 105           HA       GLU 105  -9.435   6.055   0.222
  882    HB2  GLU 105           2HB      GLU 105 -10.914   7.687   1.527
  883    HB3  GLU 105           3HB      GLU 105  -9.573   6.958   2.391
  884    HG2  GLU 105           2HG      GLU 105  -9.486   9.135   3.141
  885    HG3  GLU 105           3HG      GLU 105  -8.304   9.163   1.840
  886    H    GLY 106           H        GLY 106 -11.220   6.263  -1.046
  887    HA2  GLY 106           2HA      GLY 106 -12.201   8.242  -2.612
  888    HA3  GLY 106           3HA      GLY 106 -10.741   7.755  -3.477
  889    H    GLN 107           H        GLN 107 -11.847   6.897  -5.237
  890    HA   GLN 107           HA       GLN 107 -14.127   5.234  -5.094
  891    HB2  GLN 107           2HB      GLN 107 -13.798   4.891  -7.508
  892    HB3  GLN 107           3HB      GLN 107 -13.568   6.582  -7.076
  893    HG2  GLN 107           2HG      GLN 107 -11.118   6.288  -7.189
  894    HG3  GLN 107           3HG      GLN 107 -11.342   4.591  -7.611
  895   HE21  GLN 107          1HE2      GLN 107 -11.520   7.877  -8.766
  896   HE22  GLN 107          2HE2      GLN 107 -11.739   7.486 -10.436
  897    H    LEU 108           H        LEU 108 -14.400   3.038  -5.236
  898    HA   LEU 108           HA       LEU 108 -12.122   1.252  -4.702
  899    HB2  LEU 108           2HB      LEU 108 -14.556   1.295  -3.562
  900    HB3  LEU 108           3HB      LEU 108 -15.008   0.329  -4.949
  901    HG   LEU 108           HG       LEU 108 -12.957  -0.424  -2.818
  902   HD11  LEU 108          1HD1      LEU 108 -15.726  -1.538  -3.357
  903   HD12  LEU 108          2HD1      LEU 108 -15.249  -0.517  -1.994
  904   HD13  LEU 108          3HD1      LEU 108 -14.577  -2.137  -2.155
  905   HD21  LEU 108          3HD2      LEU 108 -12.854  -2.642  -3.841
  906   HD22  LEU 108          1HD2      LEU 108 -12.292  -1.407  -4.965
  907   HD23  LEU 108          2HD2      LEU 108 -13.900  -2.108  -5.160
  908    H    GLU 109           H        GLU 109 -11.166   0.180  -6.464
  909    HA   GLU 109           HA       GLU 109 -12.454  -0.006  -9.036
  910    HB2  GLU 109           2HB      GLU 109 -10.003  -0.010  -8.953
  911    HB3  GLU 109           3HB      GLU 109  -9.997  -1.450  -7.942
  912    HG2  GLU 109           2HG      GLU 109  -9.386  -1.959 -10.283
  913    HG3  GLU 109           3HG      GLU 109 -10.848  -2.807  -9.788
  914    H    GLY 110           H        GLY 110 -14.414  -0.957  -8.757
  915    HA2  GLY 110           2HA      GLY 110 -15.116  -3.458  -9.076
  916    HA3  GLY 110           3HA      GLY 110 -14.677  -3.542  -7.371
  917    H    VAL 111           H        VAL 111 -16.193  -0.763  -8.960
  918    HA   VAL 111           HA       VAL 111 -18.326  -0.636  -7.031
  919    HB   VAL 111           HB       VAL 111 -18.098   0.931  -9.653
  920   HG11  VAL 111          1HG1      VAL 111 -19.711   1.543  -7.140
  921   HG12  VAL 111          2HG1      VAL 111 -20.366   1.004  -8.689
  922   HG13  VAL 111          3HG1      VAL 111 -19.590   2.583  -8.561
  923   HG21  VAL 111          3HG2      VAL 111 -17.085   2.756  -8.345
  924   HG22  VAL 111          1HG2      VAL 111 -16.087   1.300  -8.290
  925   HG23  VAL 111          2HG2      VAL 111 -17.086   1.739  -6.903
  926    H    ASP 112           H        ASP 112 -19.596  -2.432  -7.189
  927    HA   ASP 112           HA       ASP 112 -21.401  -3.649  -7.731
  928    HB2  ASP 112           2HB      ASP 112 -22.375  -1.352  -8.086
  929    HB3  ASP 112           3HB      ASP 112 -21.951  -1.456  -9.788
  930    H    LEU 113           H        LEU 113 -18.779  -3.894  -9.309
  931    HA   LEU 113           HA       LEU 113 -19.453  -4.876 -11.921
  932    HB2  LEU 113           2HB      LEU 113 -16.914  -5.220 -10.267
  933    HB3  LEU 113           3HB      LEU 113 -17.076  -5.701 -11.949
  934    HG   LEU 113           HG       LEU 113 -17.167  -2.852 -10.872
  935   HD11  LEU 113          1HD1      LEU 113 -15.094  -4.224 -12.623
  936   HD12  LEU 113          2HD1      LEU 113 -14.902  -3.788 -10.921
  937   HD13  LEU 113          3HD1      LEU 113 -15.087  -2.524 -12.134
  938   HD21  LEU 113          3HD2      LEU 113 -17.494  -3.817 -13.733
  939   HD22  LEU 113          1HD2      LEU 113 -17.285  -2.134 -13.234
  940   HD23  LEU 113          2HD2      LEU 113 -18.717  -3.025 -12.732
  941    H    GLU 114           H        GLU 114 -20.123  -6.850 -12.453
  942    HA   GLU 114           HA       GLU 114 -20.576  -8.975 -10.600
  943    HB2  GLU 114           2HB      GLU 114 -21.324 -10.284 -12.516
  944    HB3  GLU 114           3HB      GLU 114 -21.953  -8.654 -12.664
  945    HG2  GLU 114           2HG      GLU 114 -19.518  -9.660 -14.173
  946    HG3  GLU 114           3HG      GLU 114 -21.155  -9.719 -14.807
  947    H    HIS 115           H        HIS 115 -19.715 -11.210 -10.973
  948    HA   HIS 115           HA       HIS 115 -18.178 -12.821 -11.145
  949    HB2  HIS 115           2HB      HIS 115 -16.569 -10.912 -12.880
  950    HB3  HIS 115           3HB      HIS 115 -16.206 -12.620 -12.660
  951    HD1  HIS 115           HD1      HIS 115 -17.335 -10.758 -15.260
  952    HD2  HIS 115           HD2      HIS 115 -19.084 -13.968 -13.282
  953    HE1  HIS 115           HE1      HIS 115 -19.028 -11.697 -16.862
  954    HE2  HIS 115           HE2      HIS 115 -19.855 -13.788 -15.733
  955    H    HIS 116           H        HIS 116 -17.595 -10.004  -9.420
  956    HA   HIS 116           HA       HIS 116 -15.041 -10.666  -8.294
  957    HB2  HIS 116           2HB      HIS 116 -15.508  -9.126  -6.479
  958    HB3  HIS 116           3HB      HIS 116 -16.084  -8.398  -7.965
  959    HD1  HIS 116           HD1      HIS 116 -18.328  -7.365  -7.782
  960    HD2  HIS 116           HD2      HIS 116 -17.819 -10.302  -4.903
  961    HE1  HIS 116           HE1      HIS 116 -20.398  -7.294  -6.373
  962    HE2  HIS 116           HE2      HIS 116 -20.128  -9.176  -4.742
  963    H    HIS 117           H        HIS 117 -18.350 -11.653  -7.660
  964    HA   HIS 117           HA       HIS 117 -17.754 -13.533  -5.578
  965    HB2  HIS 117           2HB      HIS 117 -20.071 -12.603  -5.972
  966    HB3  HIS 117           3HB      HIS 117 -20.143 -13.476  -7.497
  967    HD1  HIS 117           HD1      HIS 117 -20.579 -13.891  -3.837
  968    HD2  HIS 117           HD2      HIS 117 -20.405 -16.342  -7.192
  969    HE1  HIS 117           HE1      HIS 117 -21.451 -16.123  -3.096
  970    HE2  HIS 117           HE2      HIS 117 -21.448 -17.548  -5.163
  971    H    HIS 118           H        HIS 118 -15.937 -14.529  -6.387
  972    HA   HIS 118           HA       HIS 118 -15.838 -15.686  -9.040
  973    HB2  HIS 118           2HB      HIS 118 -13.459 -16.253  -8.360
  974    HB3  HIS 118           3HB      HIS 118 -13.855 -14.541  -8.297
  975    HD1  HIS 118           HD1      HIS 118 -13.573 -13.355  -6.067
  976    HD2  HIS 118           HD2      HIS 118 -13.198 -17.487  -5.750
  977    HE1  HIS 118           HE1      HIS 118 -12.760 -13.797  -3.736
  978    HE2  HIS 118           HE2      HIS 118 -12.332 -16.264  -3.656
  979    H    HIS 119           H        HIS 119 -15.739 -17.818  -9.565
  980    HA   HIS 119           HA       HIS 119 -16.344 -19.846  -7.503
  981    HB2  HIS 119           2HB      HIS 119 -16.904 -21.329  -9.445
  982    HB3  HIS 119           3HB      HIS 119 -17.884 -19.874  -9.387
  983    HD1  HIS 119           HD1      HIS 119 -15.464 -21.699 -11.514
  984    HD2  HIS 119           HD2      HIS 119 -17.324 -17.978 -11.462
  985    HE1  HIS 119           HE1      HIS 119 -15.164 -20.752 -13.819
  986    HE2  HIS 119           HE2      HIS 119 -16.235 -18.481 -13.742
  987    H    HIS 120           H        HIS 120 -13.685 -18.453  -8.606
  988    HA   HIS 120           HA       HIS 120 -11.892 -20.655  -9.011
  989    HB2  HIS 120           2HB      HIS 120 -11.342 -18.433  -9.895
  990    HB3  HIS 120           3HB      HIS 120 -11.406 -17.730  -8.283
  991    HD1  HIS 120           HD1      HIS 120  -9.383 -18.098  -6.739
  992    HD2  HIS 120           HD2      HIS 120  -8.952 -19.869 -10.474
  993    HE1  HIS 120           HE1      HIS 120  -6.961 -18.735  -6.902
  994    HE2  HIS 120           HE2      HIS 120  -6.765 -19.943  -9.104
  Start of MODEL   16
    1    H1   MET   1           1H       MET   1  23.897  -5.846  -3.506
    2    H2   MET   1           2H       MET   1  24.823  -5.465  -2.148
    3    H3   MET   1           3H       MET   1  24.081  -4.234  -3.034
    4    HA   MET   1           HA       MET   1  22.717  -6.351  -1.502
    5    HB2  MET   1           2HB      MET   1  22.988  -3.365  -0.945
    6    HB3  MET   1           3HB      MET   1  21.948  -4.455  -0.037
    7    HG2  MET   1           2HG      MET   1  24.966  -4.684  -0.207
    8    HG3  MET   1           3HG      MET   1  24.072  -3.960   1.130
    9    HE1  MET   1           3HE      MET   1  22.537  -5.348   2.823
   10    HE2  MET   1           1HE      MET   1  22.213  -7.073   2.651
   11    HE3  MET   1           2HE      MET   1  21.556  -5.932   1.478
   12    H    SER   2           H        SER   2  21.181  -6.968  -2.871
   13    HA   SER   2           HA       SER   2  19.019  -5.165  -3.532
   14    HB2  SER   2           2HB      SER   2  20.556  -4.961  -5.533
   15    HB3  SER   2           3HB      SER   2  20.416  -6.701  -5.785
   16    HG   SER   2           HG       SER   2  18.120  -6.337  -6.007
   17    H    GLY   3           H        GLY   3  18.343  -6.581  -1.814
   18    HA2  GLY   3           2HA      GLY   3  16.714  -8.757  -2.735
   19    HA3  GLY   3           3HA      GLY   3  18.046  -9.297  -1.703
   20    H    LYS   4           H        LYS   4  15.480  -6.843  -1.856
   21    HA   LYS   4           HA       LYS   4  15.790  -6.272   0.996
   22    HB2  LYS   4           2HB      LYS   4  15.613  -4.544  -1.037
   23    HB3  LYS   4           3HB      LYS   4  13.883  -4.769  -0.823
   24    HG2  LYS   4           2HG      LYS   4  14.572  -2.806   0.407
   25    HG3  LYS   4           3HG      LYS   4  14.132  -4.063   1.573
   26    HD2  LYS   4           2HD      LYS   4  16.509  -4.606   1.920
   27    HD3  LYS   4           3HD      LYS   4  16.981  -3.435   0.687
   28    HE2  LYS   4           2HE      LYS   4  16.086  -1.612   2.106
   29    HE3  LYS   4           3HE      LYS   4  15.656  -2.804   3.339
   30    HZ1  LYS   4           3HZ      LYS   4  17.958  -3.367   3.603
   31    HZ2  LYS   4           1HZ      LYS   4  17.789  -1.695   3.766
   32    HZ3  LYS   4           2HZ      LYS   4  18.414  -2.342   2.338
   33    H    LYS   5           H        LYS   5  14.101  -6.367   2.502
   34    HA   LYS   5           HA       LYS   5  11.536  -7.612   1.677
   35    HB2  LYS   5           2HB      LYS   5  12.992  -9.225   2.948
   36    HB3  LYS   5           3HB      LYS   5  13.027  -8.100   4.292
   37    HG2  LYS   5           2HG      LYS   5  10.478  -8.292   4.389
   38    HG3  LYS   5           3HG      LYS   5  10.614  -9.609   3.219
   39    HD2  LYS   5           2HD      LYS   5  10.442 -10.497   5.502
   40    HD3  LYS   5           3HD      LYS   5  12.022 -10.881   4.814
   41    HE2  LYS   5           2HE      LYS   5  13.002  -8.958   6.070
   42    HE3  LYS   5           3HE      LYS   5  11.419  -8.636   6.778
   43    HZ1  LYS   5           3HZ      LYS   5  11.490 -10.816   7.822
   44    HZ2  LYS   5           1HZ      LYS   5  12.819  -9.878   8.283
   45    HZ3  LYS   5           2HZ      LYS   5  13.012 -11.118   7.151
   46    H    VAL   6           H        VAL   6  10.203  -5.900   1.768
   47    HA   VAL   6           HA       VAL   6  10.182  -4.125   4.147
   48    HB   VAL   6           HB       VAL   6  10.128  -2.877   2.050
   49   HG11  VAL   6          1HG1      VAL   6   7.663  -4.490   1.294
   50   HG12  VAL   6          2HG1      VAL   6   9.263  -4.645   0.565
   51   HG13  VAL   6          3HG1      VAL   6   8.348  -3.148   0.369
   52   HG21  VAL   6          3HG2      VAL   6   8.791  -1.952   3.881
   53   HG22  VAL   6          1HG2      VAL   6   7.374  -2.843   3.320
   54   HG23  VAL   6          2HG2      VAL   6   8.071  -1.567   2.317
   55    H    GLU   7           H        GLU   7   8.378  -4.028   5.478
   56    HA   GLU   7           HA       GLU   7   6.300  -6.102   5.091
   57    HB2  GLU   7           2HB      GLU   7   7.473  -5.000   7.674
   58    HB3  GLU   7           3HB      GLU   7   6.092  -6.091   7.590
   59    HG2  GLU   7           2HG      GLU   7   7.565  -7.760   6.396
   60    HG3  GLU   7           3HG      GLU   7   8.930  -6.685   6.697
   61    H    VAL   8           H        VAL   8   4.408  -5.352   4.635
   62    HA   VAL   8           HA       VAL   8   3.841  -2.453   4.820
   63    HB   VAL   8           HB       VAL   8   2.904  -4.575   2.820
   64   HG11  VAL   8          1HG1      VAL   8   1.779  -2.774   1.572
   65   HG12  VAL   8          2HG1      VAL   8   2.191  -1.619   2.838
   66   HG13  VAL   8          3HG1      VAL   8   1.083  -2.944   3.188
   67   HG21  VAL   8          3HG2      VAL   8   4.228  -3.279   1.182
   68   HG22  VAL   8          1HG2      VAL   8   5.243  -3.844   2.515
   69   HG23  VAL   8          2HG2      VAL   8   4.718  -2.157   2.456
   70    H    GLN   9           H        GLN   9   2.342  -1.912   6.294
   71    HA   GLN   9           HA       GLN   9   0.469  -3.937   7.360
   72    HB2  GLN   9           2HB      GLN   9   1.164  -1.154   8.435
   73    HB3  GLN   9           3HB      GLN   9   0.238  -2.398   9.275
   74    HG2  GLN   9           2HG      GLN   9   2.182  -3.785   9.529
   75    HG3  GLN   9           3HG      GLN   9   3.128  -2.766   8.448
   76   HE21  GLN   9          1HE2      GLN   9   3.937  -0.796   9.216
   77   HE22  GLN   9          2HE2      GLN   9   3.993  -0.414  10.901
   78    H    VAL  10           H        VAL  10  -1.284  -3.947   5.978
   79    HA   VAL  10           HA       VAL  10  -2.395  -1.402   4.971
   80    HB   VAL  10           HB       VAL  10  -3.129  -4.280   4.204
   81   HG11  VAL  10          1HG1      VAL  10  -4.362  -3.271   2.306
   82   HG12  VAL  10          2HG1      VAL  10  -3.991  -1.657   2.917
   83   HG13  VAL  10          3HG1      VAL  10  -5.023  -2.737   3.855
   84   HG21  VAL  10          3HG2      VAL  10  -1.426  -2.250   2.701
   85   HG22  VAL  10          1HG2      VAL  10  -1.907  -3.839   2.093
   86   HG23  VAL  10          2HG2      VAL  10  -0.838  -3.715   3.492
   87    H    LYS  11           H        LYS  11  -3.789  -0.473   6.384
   88    HA   LYS  11           HA       LYS  11  -5.746  -2.156   7.857
   89    HB2  LYS  11           2HB      LYS  11  -4.190  -0.734   9.261
   90    HB3  LYS  11           3HB      LYS  11  -4.833   0.700   8.469
   91    HG2  LYS  11           2HG      LYS  11  -7.135  -0.004   9.339
   92    HG3  LYS  11           3HG      LYS  11  -6.301  -1.219  10.304
   93    HD2  LYS  11           2HD      LYS  11  -6.735   0.696  11.712
   94    HD3  LYS  11           3HD      LYS  11  -4.996   0.635  11.408
   95    HE2  LYS  11           2HE      LYS  11  -5.238   2.391   9.682
   96    HE3  LYS  11           3HE      LYS  11  -6.982   2.430   9.960
   97    HZ1  LYS  11           3HZ      LYS  11  -5.913   4.217  11.132
   98    HZ2  LYS  11           1HZ      LYS  11  -4.882   3.148  11.939
   99    HZ3  LYS  11           2HZ      LYS  11  -6.542   3.121  12.250
  100    H    ILE  12           H        ILE  12  -7.587  -2.212   6.626
  101    HA   ILE  12           HA       ILE  12  -8.471   0.260   5.237
  102    HB   ILE  12           HB       ILE  12  -7.769  -1.299   3.552
  103   HG12  ILE  12          2HG1      ILE  12 -10.820  -1.406   3.690
  104   HG13  ILE  12          3HG1      ILE  12  -9.884  -0.040   3.092
  105   HG21  ILE  12          1HG2      ILE  12  -9.547  -3.427   4.791
  106   HG22  ILE  12          2HG2      ILE  12  -7.784  -3.395   4.838
  107   HG23  ILE  12          3HG2      ILE  12  -8.621  -3.597   3.297
  108   HD11  ILE  12          3HD1      ILE  12 -10.017  -2.792   1.863
  109   HD12  ILE  12          1HD1      ILE  12  -9.022  -1.455   1.277
  110   HD13  ILE  12          2HD1      ILE  12 -10.779  -1.317   1.266
  111    H    THR  13           H        THR  13 -10.340   1.072   5.931
  112    HA   THR  13           HA       THR  13 -12.214  -0.560   7.503
  113    HB   THR  13           HB       THR  13 -12.184   2.462   7.041
  114    HG1  THR  13           HG1      THR  13 -11.325   0.940   9.305
  115   HG21  THR  13          3HG2      THR  13 -13.727   0.791   9.068
  116   HG22  THR  13          1HG2      THR  13 -14.429   1.629   7.674
  117   HG23  THR  13          2HG2      THR  13 -13.706   2.552   8.988
  118    H    CYS  14           H        CYS  14 -13.678  -1.601   6.311
  119    HA   CYS  14           HA       CYS  14 -15.319  -0.223   4.311
  120    HB2  CYS  14           2HB      CYS  14 -13.714  -1.252   2.857
  121    HB3  CYS  14           3HB      CYS  14 -13.711  -2.745   3.791
  122    H    ASN  15           H        ASN  15 -17.417  -0.719   4.580
  123    HA   ASN  15           HA       ASN  15 -19.374  -1.701   5.139
  124    HB2  ASN  15           2HB      ASN  15 -18.167  -3.585   3.744
  125    HB3  ASN  15           3HB      ASN  15 -17.996  -4.409   5.279
  126   HD21  ASN  15          1HD2      ASN  15 -20.684  -3.597   6.279
  127   HD22  ASN  15          2HD2      ASN  15 -21.805  -4.527   5.361
  128    H    GLY  16           H        GLY  16 -17.725  -0.633   7.182
  129    HA2  GLY  16           2HA      GLY  16 -17.920  -0.266   9.438
  130    HA3  GLY  16           3HA      GLY  16 -19.148  -1.519   9.496
  131    H    LYS  17           H        LYS  17 -16.283  -2.682   8.128
  132    HA   LYS  17           HA       LYS  17 -15.164  -3.547  10.733
  133    HB2  LYS  17           2HB      LYS  17 -15.484  -5.137   8.150
  134    HB3  LYS  17           3HB      LYS  17 -14.401  -5.646   9.434
  135    HG2  LYS  17           2HG      LYS  17 -17.320  -5.177  10.061
  136    HG3  LYS  17           3HG      LYS  17 -16.827  -6.659   9.244
  137    HD2  LYS  17           2HD      LYS  17 -16.947  -7.152  11.591
  138    HD3  LYS  17           3HD      LYS  17 -15.242  -7.117  11.158
  139    HE2  LYS  17           2HE      LYS  17 -15.135  -4.779  12.106
  140    HE3  LYS  17           3HE      LYS  17 -16.798  -4.980  12.657
  141    HZ1  LYS  17           3HZ      LYS  17 -14.491  -6.668  13.474
  142    HZ2  LYS  17           1HZ      LYS  17 -16.084  -6.846  14.008
  143    HZ3  LYS  17           2HZ      LYS  17 -15.210  -5.460  14.414
  144    H    THR  18           H        THR  18 -12.964  -3.486  10.949
  145    HA   THR  18           HA       THR  18 -11.413  -2.169   8.794
  146    HB   THR  18           HB       THR  18 -10.978  -2.071  11.821
  147    HG1  THR  18           HG1      THR  18 -12.757  -0.811  10.673
  148   HG21  THR  18          3HG2      THR  18  -9.485  -0.619   9.596
  149   HG22  THR  18          1HG2      THR  18  -8.825  -1.923  10.589
  150   HG23  THR  18          2HG2      THR  18  -9.248  -0.378  11.328
  151    H    TYR  19           H        TYR  19  -9.927  -3.401   7.873
  152    HA   TYR  19           HA       TYR  19  -9.200  -6.031   9.018
  153    HB2  TYR  19           2HB      TYR  19  -9.075  -5.226   6.072
  154    HB3  TYR  19           3HB      TYR  19  -9.032  -6.846   6.751
  155    HD1  TYR  19           HD2      TYR  19 -11.236  -3.956   5.986
  156    HD2  TYR  19           HD1      TYR  19 -11.110  -8.051   7.211
  157    HE1  TYR  19           HE2      TYR  19 -13.649  -4.136   5.594
  158    HE2  TYR  19           HE1      TYR  19 -13.538  -8.229   6.814
  159    HH   TYR  19           HH       TYR  19 -15.345  -5.707   5.221
  160    H    GLU  20           H        GLU  20  -7.150  -5.846   9.886
  161    HA   GLU  20           HA       GLU  20  -5.091  -4.427   8.313
  162    HB2  GLU  20           2HB      GLU  20  -4.072  -3.642  10.464
  163    HB3  GLU  20           3HB      GLU  20  -5.622  -2.926  10.074
  164    HG2  GLU  20           2HG      GLU  20  -5.729  -3.281  12.380
  165    HG3  GLU  20           3HG      GLU  20  -6.656  -4.616  11.697
  166    H    ARG  21           H        ARG  21  -3.105  -5.291   8.200
  167    HA   ARG  21           HA       ARG  21  -2.096  -7.407   9.815
  168    HB2  ARG  21           2HB      ARG  21  -3.668  -8.803   8.524
  169    HB3  ARG  21           3HB      ARG  21  -3.055  -8.151   7.005
  170    HG2  ARG  21           2HG      ARG  21  -0.877  -9.223   7.394
  171    HG3  ARG  21           3HG      ARG  21  -1.432  -9.832   8.952
  172    HD2  ARG  21           2HD      ARG  21  -3.060 -11.270   7.867
  173    HD3  ARG  21           3HD      ARG  21  -2.685 -10.568   6.289
  174    HE   ARG  21           HE       ARG  21  -0.282 -11.503   7.036
  175   HH11  ARG  21          1HH1      ARG  21  -3.422 -13.081   7.085
  176   HH12  ARG  21          2HH1      ARG  21  -2.761 -14.658   6.830
  177   HH21  ARG  21          1HH2      ARG  21   0.562 -13.580   6.682
  178   HH22  ARG  21          2HH2      ARG  21  -0.506 -14.947   6.600
  179    H    THR  22           H        THR  22   0.077  -7.622   9.526
  180    HA   THR  22           HA       THR  22   1.493  -5.876   7.665
  181    HB   THR  22           HB       THR  22   2.620  -7.741   9.813
  182    HG1  THR  22           HG1      THR  22   1.153  -5.555  10.143
  183   HG21  THR  22          3HG2      THR  22   4.272  -6.997   8.112
  184   HG22  THR  22          1HG2      THR  22   4.605  -6.276   9.689
  185   HG23  THR  22          2HG2      THR  22   3.835  -5.315   8.427
  186    H    TYR  23           H        TYR  23   2.047  -6.664   5.703
  187    HA   TYR  23           HA       TYR  23   2.235  -9.570   5.203
  188    HB2  TYR  23           2HB      TYR  23   2.029  -7.280   3.182
  189    HB3  TYR  23           3HB      TYR  23   1.916  -9.003   2.827
  190    HD1  TYR  23           HD2      TYR  23  -0.120 -10.299   3.551
  191    HD2  TYR  23           HD1      TYR  23   0.100  -6.053   4.026
  192    HE1  TYR  23           HE2      TYR  23  -2.554 -10.202   3.868
  193    HE2  TYR  23           HE1      TYR  23  -2.331  -5.966   4.345
  194    HH   TYR  23           HH       TYR  23  -4.211  -8.688   4.937
  195    H    GLN  24           H        GLN  24   4.113 -10.479   4.503
  196    HA   GLN  24           HA       GLN  24   6.574  -8.846   4.600
  197    HB2  GLN  24           2HB      GLN  24   6.175 -11.879   4.579
  198    HB3  GLN  24           3HB      GLN  24   7.749 -11.100   4.504
  199    HG2  GLN  24           2HG      GLN  24   7.348 -11.870   6.755
  200    HG3  GLN  24           3HG      GLN  24   7.367 -10.111   6.740
  201   HE21  GLN  24          1HE2      GLN  24   5.507  -9.001   7.329
  202   HE22  GLN  24          2HE2      GLN  24   4.089  -9.777   7.946
  203    H    LEU  25           H        LEU  25   6.984  -7.938   2.673
  204    HA   LEU  25           HA       LEU  25   6.554  -9.480   0.181
  205    HB2  LEU  25           2HB      LEU  25   6.644  -6.456   0.585
  206    HB3  LEU  25           3HB      LEU  25   6.406  -7.272  -0.955
  207    HG   LEU  25           HG       LEU  25   4.488  -7.257   1.413
  208   HD11  LEU  25          1HD1      LEU  25   4.159  -6.125  -1.380
  209   HD12  LEU  25          2HD1      LEU  25   4.426  -5.200   0.102
  210   HD13  LEU  25          3HD1      LEU  25   2.939  -6.123  -0.103
  211   HD21  LEU  25          3HD2      LEU  25   4.461  -9.487   0.391
  212   HD22  LEU  25          1HD2      LEU  25   4.179  -8.775  -1.201
  213   HD23  LEU  25          2HD2      LEU  25   2.960  -8.628   0.069
  214    H    TYR  26           H        TYR  26   8.454 -10.504  -0.055
  215    HA   TYR  26           HA       TYR  26  11.016  -9.089   0.120
  216    HB2  TYR  26           2HB      TYR  26  10.698 -11.420   1.078
  217    HB3  TYR  26           3HB      TYR  26  10.492 -12.025  -0.563
  218    HD1  TYR  26           HD1      TYR  26  12.891 -10.540   1.817
  219    HD2  TYR  26           HD2      TYR  26  12.473 -12.323  -2.035
  220    HE1  TYR  26           HE1      TYR  26  15.324 -10.710   1.653
  221    HE2  TYR  26           HE2      TYR  26  14.930 -12.506  -2.206
  222    HH   TYR  26           HH       TYR  26  17.009 -11.866   0.505
  223    H    ALA  27           H        ALA  27  12.356  -8.796  -1.649
  224    HA   ALA  27           HA       ALA  27  11.698  -9.631  -4.348
  225    HB1  ALA  27           3HB      ALA  27  10.205  -7.678  -4.106
  226    HB2  ALA  27           1HB      ALA  27  11.517  -7.309  -5.219
  227    HB3  ALA  27           2HB      ALA  27  11.561  -6.684  -3.569
  228    H    VAL  28           H        VAL  28  13.458  -9.073  -5.831
  229    HA   VAL  28           HA       VAL  28  16.059  -8.733  -4.624
  230    HB   VAL  28           HB       VAL  28  15.181  -8.871  -7.550
  231   HG11  VAL  28          1HG1      VAL  28  17.566  -9.076  -8.180
  232   HG12  VAL  28          2HG1      VAL  28  18.039  -8.757  -6.510
  233   HG13  VAL  28          3HG1      VAL  28  17.228  -7.503  -7.447
  234   HG21  VAL  28          3HG2      VAL  28  16.240 -11.111  -7.511
  235   HG22  VAL  28          1HG2      VAL  28  14.962 -10.988  -6.298
  236   HG23  VAL  28          2HG2      VAL  28  16.655 -10.892  -5.809
  237    H    ARG  29           H        ARG  29  14.399  -6.781  -7.166
  238    HA   ARG  29           HA       ARG  29  15.658  -4.334  -6.110
  239    HB2  ARG  29           2HB      ARG  29  13.992  -4.729  -8.633
  240    HB3  ARG  29           3HB      ARG  29  14.808  -3.239  -8.165
  241    HG2  ARG  29           2HG      ARG  29  16.995  -4.327  -8.439
  242    HG3  ARG  29           3HG      ARG  29  16.202  -5.853  -8.841
  243    HD2  ARG  29           2HD      ARG  29  15.115  -4.684 -10.795
  244    HD3  ARG  29           3HD      ARG  29  16.101  -3.265 -10.431
  245    HE   ARG  29           HE       ARG  29  17.799  -5.484 -10.726
  246   HH11  ARG  29          1HH1      ARG  29  15.677  -3.487 -12.725
  247   HH12  ARG  29          2HH1      ARG  29  16.583  -3.776 -14.178
  248   HH21  ARG  29          1HH2      ARG  29  18.930  -5.898 -12.662
  249   HH22  ARG  29          2HH2      ARG  29  18.420  -5.138 -14.137
  250    H    ASP  30           H        ASP  30  14.346  -2.413  -5.850
  251    HA   ASP  30           HA       ASP  30  11.922  -2.737  -4.384
  252    HB2  ASP  30           2HB      ASP  30  11.907  -0.276  -4.243
  253    HB3  ASP  30           3HB      ASP  30  13.510  -0.907  -3.890
  254    H    GLU  31           H        GLU  31  12.637  -2.073  -7.774
  255    HA   GLU  31           HA       GLU  31  10.033  -1.211  -8.573
  256    HB2  GLU  31           2HB      GLU  31  10.735  -1.642 -10.874
  257    HB3  GLU  31           3HB      GLU  31  12.016  -0.817  -9.994
  258    HG2  GLU  31           2HG      GLU  31  13.319  -2.828  -9.824
  259    HG3  GLU  31           3HG      GLU  31  11.994  -3.819 -10.435
  260    H    GLU  32           H        GLU  32  11.388  -4.344  -7.933
  261    HA   GLU  32           HA       GLU  32   9.449  -5.964  -9.280
  262    HB2  GLU  32           2HB      GLU  32  11.132  -6.681  -6.845
  263    HB3  GLU  32           3HB      GLU  32  10.374  -7.812  -7.962
  264    HG2  GLU  32           2HG      GLU  32  12.566  -5.857  -8.706
  265    HG3  GLU  32           3HG      GLU  32  12.840  -7.539  -8.265
  266    H    LEU  33           H        LEU  33   9.658  -4.374  -6.202
  267    HA   LEU  33           HA       LEU  33   7.632  -5.728  -4.766
  268    HB2  LEU  33           2HB      LEU  33   9.588  -3.876  -4.142
  269    HB3  LEU  33           3HB      LEU  33   8.169  -2.857  -4.082
  270    HG   LEU  33           HG       LEU  33   8.733  -3.666  -1.852
  271   HD11  LEU  33          1HD1      LEU  33   6.623  -4.633  -1.121
  272   HD12  LEU  33          2HD1      LEU  33   6.195  -5.023  -2.789
  273   HD13  LEU  33          3HD1      LEU  33   6.356  -3.337  -2.289
  274   HD21  LEU  33          3HD2      LEU  33   8.690  -6.032  -1.225
  275   HD22  LEU  33          1HD2      LEU  33   9.919  -5.727  -2.452
  276   HD23  LEU  33          2HD2      LEU  33   8.396  -6.496  -2.902
  277    H    LYS  34           H        LYS  34   7.520  -3.271  -7.225
  278    HA   LYS  34           HA       LYS  34   5.171  -1.887  -6.695
  279    HB2  LYS  34           2HB      LYS  34   6.352  -2.677  -9.389
  280    HB3  LYS  34           3HB      LYS  34   5.041  -1.515  -9.191
  281    HG2  LYS  34           2HG      LYS  34   6.509  -0.018  -7.933
  282    HG3  LYS  34           3HG      LYS  34   7.814  -1.201  -8.009
  283    HD2  LYS  34           2HD      LYS  34   8.309   0.445  -9.663
  284    HD3  LYS  34           3HD      LYS  34   7.748  -0.975 -10.543
  285    HE2  LYS  34           2HE      LYS  34   6.061   1.471  -9.918
  286    HE3  LYS  34           3HE      LYS  34   6.875   1.170 -11.447
  287    HZ1  LYS  34           3HZ      LYS  34   5.491  -0.784 -11.762
  288    HZ2  LYS  34           1HZ      LYS  34   4.542   0.595 -11.561
  289    HZ3  LYS  34           2HZ      LYS  34   4.706  -0.504 -10.296
  290    H    GLU  35           H        GLU  35   5.476  -4.758  -8.851
  291    HA   GLU  35           HA       GLU  35   2.687  -5.019  -9.251
  292    HB2  GLU  35           2HB      GLU  35   3.260  -7.241 -10.290
  293    HB3  GLU  35           3HB      GLU  35   4.126  -5.864 -10.946
  294    HG2  GLU  35           2HG      GLU  35   5.738  -7.552 -10.854
  295    HG3  GLU  35           3HG      GLU  35   6.088  -6.557  -9.444
  296    H    LYS  36           H        LYS  36   4.788  -6.196  -6.742
  297    HA   LYS  36           HA       LYS  36   3.104  -8.230  -5.665
  298    HB2  LYS  36           2HB      LYS  36   5.217  -6.574  -4.202
  299    HB3  LYS  36           3HB      LYS  36   4.548  -8.124  -3.674
  300    HG2  LYS  36           2HG      LYS  36   5.478  -9.195  -5.704
  301    HG3  LYS  36           3HG      LYS  36   6.184  -7.647  -6.178
  302    HD2  LYS  36           2HD      LYS  36   7.546  -7.686  -4.071
  303    HD3  LYS  36           3HD      LYS  36   6.896  -9.296  -3.726
  304    HE2  LYS  36           2HE      LYS  36   8.633  -8.475  -6.074
  305    HE3  LYS  36           3HE      LYS  36   9.053  -9.577  -4.765
  306    HZ1  LYS  36           3HZ      LYS  36   7.122 -10.027  -6.967
  307    HZ2  LYS  36           1HZ      LYS  36   7.205 -11.028  -5.608
  308    HZ3  LYS  36           2HZ      LYS  36   8.541 -10.886  -6.633
  309    H    LEU  37           H        LEU  37   3.563  -4.789  -4.915
  310    HA   LEU  37           HA       LEU  37   1.628  -4.494  -2.908
  311    HB2  LEU  37           2HB      LEU  37   2.661  -2.528  -4.975
  312    HB3  LEU  37           3HB      LEU  37   1.576  -2.060  -3.673
  313    HG   LEU  37           HG       LEU  37   4.325  -3.272  -3.204
  314   HD11  LEU  37          1HD1      LEU  37   3.520  -0.354  -3.188
  315   HD12  LEU  37          2HD1      LEU  37   4.553  -1.151  -4.378
  316   HD13  LEU  37          3HD1      LEU  37   5.088  -1.004  -2.708
  317   HD21  LEU  37          3HD2      LEU  37   2.773  -3.572  -1.315
  318   HD22  LEU  37          1HD2      LEU  37   2.431  -1.838  -1.300
  319   HD23  LEU  37          2HD2      LEU  37   4.048  -2.428  -0.908
  320    H    LYS  38           H        LYS  38   1.346  -4.170  -6.496
  321    HA   LYS  38           HA       LYS  38  -1.346  -3.463  -6.687
  322    HB2  LYS  38           2HB      LYS  38   0.273  -5.232  -8.572
  323    HB3  LYS  38           3HB      LYS  38  -1.295  -4.520  -8.958
  324    HG2  LYS  38           2HG      LYS  38  -0.307  -2.255  -8.699
  325    HG3  LYS  38           3HG      LYS  38   1.265  -3.001  -8.387
  326    HD2  LYS  38           2HD      LYS  38   1.118  -2.287 -10.727
  327    HD3  LYS  38           3HD      LYS  38   1.213  -4.047 -10.635
  328    HE2  LYS  38           2HE      LYS  38  -1.222  -4.207 -10.987
  329    HE3  LYS  38           3HE      LYS  38  -1.345  -2.447 -11.022
  330    HZ1  LYS  38           3HZ      LYS  38   0.137  -2.485 -12.981
  331    HZ2  LYS  38           1HZ      LYS  38  -1.343  -3.266 -13.238
  332    HZ3  LYS  38           2HZ      LYS  38   0.057  -4.174 -12.980
  333    H    LYS  39           H        LYS  39   0.159  -6.672  -6.435
  334    HA   LYS  39           HA       LYS  39  -2.173  -8.235  -6.665
  335    HB2  LYS  39           2HB      LYS  39   0.516  -8.803  -5.355
  336    HB3  LYS  39           3HB      LYS  39  -0.764 -10.012  -5.429
  337    HG2  LYS  39           2HG      LYS  39   0.606  -8.705  -7.801
  338    HG3  LYS  39           3HG      LYS  39   0.868 -10.351  -7.225
  339    HD2  LYS  39           2HD      LYS  39  -1.747  -9.266  -8.367
  340    HD3  LYS  39           3HD      LYS  39  -0.593 -10.294  -9.220
  341    HE2  LYS  39           2HE      LYS  39  -1.002 -12.126  -7.685
  342    HE3  LYS  39           3HE      LYS  39  -2.036 -11.109  -6.679
  343    HZ1  LYS  39           3HZ      LYS  39  -2.611 -11.807  -9.500
  344    HZ2  LYS  39           1HZ      LYS  39  -3.619 -10.976  -8.438
  345    HZ3  LYS  39           2HZ      LYS  39  -3.270 -12.604  -8.161
  346    H    VAL  40           H        VAL  40  -0.374  -7.319  -3.706
  347    HA   VAL  40           HA       VAL  40  -2.134  -8.555  -1.898
  348    HB   VAL  40           HB       VAL  40  -0.161  -6.258  -1.408
  349   HG11  VAL  40          1HG1      VAL  40  -0.213  -6.900   0.993
  350   HG12  VAL  40          2HG1      VAL  40  -1.514  -8.042   0.657
  351   HG13  VAL  40          3HG1      VAL  40  -1.789  -6.314   0.438
  352   HG21  VAL  40          3HG2      VAL  40   0.152  -9.251  -0.989
  353   HG22  VAL  40          1HG2      VAL  40   1.362  -8.025  -0.594
  354   HG23  VAL  40          2HG2      VAL  40   0.899  -8.303  -2.273
  355    H    LEU  41           H        LEU  41  -2.081  -5.249  -3.171
  356    HA   LEU  41           HA       LEU  41  -4.087  -4.199  -1.431
  357    HB2  LEU  41           2HB      LEU  41  -2.825  -3.214  -4.003
  358    HB3  LEU  41           3HB      LEU  41  -4.166  -2.341  -3.277
  359    HG   LEU  41           HG       LEU  41  -1.572  -2.923  -1.786
  360   HD11  LEU  41          1HD1      LEU  41  -1.072  -1.517  -3.724
  361   HD12  LEU  41          2HD1      LEU  41  -0.925  -0.598  -2.228
  362   HD13  LEU  41          3HD1      LEU  41  -2.344  -0.385  -3.260
  363   HD21  LEU  41          3HD2      LEU  41  -2.371  -1.180  -0.243
  364   HD22  LEU  41          1HD2      LEU  41  -3.517  -2.518  -0.338
  365   HD23  LEU  41          2HD2      LEU  41  -3.855  -1.002  -1.185
  366    H    ASN  42           H        ASN  42  -4.166  -5.392  -4.819
  367    HA   ASN  42           HA       ASN  42  -6.937  -4.825  -5.231
  368    HB2  ASN  42           2HB      ASN  42  -5.222  -5.074  -7.069
  369    HB3  ASN  42           3HB      ASN  42  -5.188  -6.807  -6.760
  370   HD21  ASN  42          1HD2      ASN  42  -5.959  -7.408  -8.760
  371   HD22  ASN  42          2HD2      ASN  42  -7.549  -7.060  -9.329
  372    H    GLU  43           H        GLU  43  -5.173  -7.615  -4.012
  373    HA   GLU  43           HA       GLU  43  -7.426  -9.447  -4.038
  374    HB2  GLU  43           2HB      GLU  43  -4.647  -9.723  -2.809
  375    HB3  GLU  43           3HB      GLU  43  -5.858 -11.003  -2.843
  376    HG2  GLU  43           2HG      GLU  43  -5.781 -11.030  -5.299
  377    HG3  GLU  43           3HG      GLU  43  -4.610  -9.721  -5.299
  378    H    ARG  44           H        ARG  44  -5.680  -7.482  -1.612
  379    HA   ARG  44           HA       ARG  44  -7.177  -8.123   0.677
  380    HB2  ARG  44           2HB      ARG  44  -5.186  -6.697   0.856
  381    HB3  ARG  44           3HB      ARG  44  -5.922  -5.473  -0.162
  382    HG2  ARG  44           2HG      ARG  44  -5.973  -4.653   2.079
  383    HG3  ARG  44           3HG      ARG  44  -7.630  -5.077   1.654
  384    HD2  ARG  44           2HD      ARG  44  -5.790  -6.882   3.258
  385    HD3  ARG  44           3HD      ARG  44  -6.892  -5.713   3.982
  386    HE   ARG  44           HE       ARG  44  -8.285  -7.481   2.234
  387   HH11  ARG  44          1HH1      ARG  44  -6.889  -7.327   5.454
  388   HH12  ARG  44          2HH1      ARG  44  -7.945  -8.549   6.092
  389   HH21  ARG  44          1HH2      ARG  44  -9.621  -9.104   3.076
  390   HH22  ARG  44          2HH2      ARG  44  -9.489  -9.553   4.745
  391    H    MET  45           H        MET  45  -7.698  -5.819  -1.918
  392    HA   MET  45           HA       MET  45 -10.274  -4.976  -0.893
  393    HB2  MET  45           2HB      MET  45  -8.675  -4.046  -3.300
  394    HB3  MET  45           3HB      MET  45 -10.260  -3.415  -2.873
  395    HG2  MET  45           2HG      MET  45  -9.256  -2.771  -0.621
  396    HG3  MET  45           3HG      MET  45  -7.683  -3.139  -1.329
  397    HE1  MET  45           3HE      MET  45 -10.494   0.185  -2.896
  398    HE2  MET  45           1HE      MET  45 -10.871  -0.816  -1.496
  399    HE3  MET  45           2HE      MET  45 -10.857  -1.528  -3.111
  400    H    ASP  46           H        ASP  46  -9.391  -7.648  -2.639
  401    HA   ASP  46           HA       ASP  46 -11.296  -7.606  -4.746
  402    HB2  ASP  46           2HB      ASP  46  -9.414  -9.171  -4.824
  403    HB3  ASP  46           3HB      ASP  46  -9.982  -9.998  -3.383
  404    HA   PRO  47           HA       PRO  47 -14.436  -9.752  -1.663
  405    HB2  PRO  47           2HB      PRO  47 -13.925  -9.588   1.035
  406    HB3  PRO  47           3HB      PRO  47 -13.396 -10.965   0.044
  407    HG2  PRO  47           2HG      PRO  47 -11.810  -8.553   0.890
  408    HG3  PRO  47           3HG      PRO  47 -11.355 -10.273   0.961
  409    HD2  PRO  47           2HD      PRO  47 -10.489  -8.696  -1.035
  410    HD3  PRO  47           3HD      PRO  47 -10.929 -10.393  -1.334
  411    H    ILE  48           H        ILE  48 -12.628  -6.855  -1.022
  412    HA   ILE  48           HA       ILE  48 -14.631  -5.391   0.462
  413    HB   ILE  48           HB       ILE  48 -12.052  -4.555  -0.915
  414   HG12  ILE  48          2HG1      ILE  48 -11.607  -6.083   0.916
  415   HG13  ILE  48          3HG1      ILE  48 -11.093  -4.475   1.399
  416   HG21  ILE  48          1HG2      ILE  48 -12.097  -2.452   0.327
  417   HG22  ILE  48          2HG2      ILE  48 -13.695  -2.851   0.951
  418   HG23  ILE  48          3HG2      ILE  48 -13.470  -2.591  -0.775
  419   HD11  ILE  48          3HD1      ILE  48 -12.134  -5.649   3.219
  420   HD12  ILE  48          1HD1      ILE  48 -13.605  -5.886   2.280
  421   HD13  ILE  48          2HD1      ILE  48 -13.117  -4.260   2.764
  422    H    LYS  49           H        LYS  49 -13.595  -5.654  -2.906
  423    HA   LYS  49           HA       LYS  49 -15.371  -3.568  -3.873
  424    HB2  LYS  49           2HB      LYS  49 -13.559  -5.507  -5.386
  425    HB3  LYS  49           3HB      LYS  49 -14.514  -4.234  -6.145
  426    HG2  LYS  49           2HG      LYS  49 -13.242  -2.540  -4.771
  427    HG3  LYS  49           3HG      LYS  49 -12.217  -3.844  -4.185
  428    HD2  LYS  49           2HD      LYS  49 -12.465  -2.868  -7.055
  429    HD3  LYS  49           3HD      LYS  49 -11.091  -2.641  -5.980
  430    HE2  LYS  49           2HE      LYS  49 -12.042  -5.356  -6.960
  431    HE3  LYS  49           3HE      LYS  49 -10.763  -4.416  -7.724
  432    HZ1  LYS  49           3HZ      LYS  49  -9.834  -6.057  -6.272
  433    HZ2  LYS  49           1HZ      LYS  49 -10.724  -5.473  -4.960
  434    HZ3  LYS  49           2HZ      LYS  49  -9.516  -4.519  -5.651
  435    H    LYS  50           H        LYS  50 -15.556  -6.950  -3.184
  436    HA   LYS  50           HA       LYS  50 -18.060  -7.425  -4.558
  437    HB2  LYS  50           2HB      LYS  50 -16.637  -9.339  -3.990
  438    HB3  LYS  50           3HB      LYS  50 -16.633  -8.894  -2.288
  439    HG2  LYS  50           2HG      LYS  50 -19.121  -9.360  -2.236
  440    HG3  LYS  50           3HG      LYS  50 -18.994  -9.964  -3.887
  441    HD2  LYS  50           2HD      LYS  50 -17.484 -11.100  -1.499
  442    HD3  LYS  50           3HD      LYS  50 -18.983 -11.769  -2.144
  443    HE2  LYS  50           2HE      LYS  50 -16.357 -11.561  -3.652
  444    HE3  LYS  50           3HE      LYS  50 -17.003 -13.022  -2.914
  445    HZ1  LYS  50           3HZ      LYS  50 -17.437 -12.961  -5.280
  446    HZ2  LYS  50           1HZ      LYS  50 -18.268 -11.499  -5.124
  447    HZ3  LYS  50           2HZ      LYS  50 -18.890 -12.901  -4.419
  448    H    LEU  51           H        LEU  51 -16.994  -6.156  -1.448
  449    HA   LEU  51           HA       LEU  51 -19.586  -6.185  -0.157
  450    HB2  LEU  51           2HB      LEU  51 -17.032  -4.695   0.573
  451    HB3  LEU  51           3HB      LEU  51 -18.486  -4.693   1.562
  452    HG   LEU  51           HG       LEU  51 -16.777  -7.130   0.934
  453   HD11  LEU  51          1HD1      LEU  51 -16.116  -7.089   3.276
  454   HD12  LEU  51          2HD1      LEU  51 -17.069  -5.628   3.542
  455   HD13  LEU  51          3HD1      LEU  51 -15.670  -5.586   2.469
  456   HD21  LEU  51          3HD2      LEU  51 -19.117  -7.787   1.161
  457   HD22  LEU  51          1HD2      LEU  51 -19.223  -6.952   2.714
  458   HD23  LEU  51          2HD2      LEU  51 -18.171  -8.359   2.530
  459    H    GLY  52           H        GLY  52 -17.744  -3.984  -2.158
  460    HA2  GLY  52           2HA      GLY  52 -18.393  -2.226  -3.464
  461    HA3  GLY  52           3HA      GLY  52 -20.060  -2.608  -3.065
  462    H    CYS  53           H        CYS  53 -17.607  -1.845  -0.681
  463    HA   CYS  53           HA       CYS  53 -19.074   0.302   0.467
  464    HB2  CYS  53           2HB      CYS  53 -16.767   0.631   1.698
  465    HB3  CYS  53           3HB      CYS  53 -17.713  -0.823   2.000
  466    H    LYS  54           H        LYS  54 -19.332   2.213  -0.450
  467    HA   LYS  54           HA       LYS  54 -18.057   3.036  -2.814
  468    HB2  LYS  54           2HB      LYS  54 -19.836   4.658  -0.954
  469    HB3  LYS  54           3HB      LYS  54 -19.423   5.103  -2.611
  470    HG2  LYS  54           2HG      LYS  54 -20.568   3.067  -3.447
  471    HG3  LYS  54           3HG      LYS  54 -20.972   2.623  -1.788
  472    HD2  LYS  54           2HD      LYS  54 -22.955   3.600  -2.599
  473    HD3  LYS  54           3HD      LYS  54 -22.215   4.894  -1.662
  474    HE2  LYS  54           2HE      LYS  54 -22.156   4.611  -4.686
  475    HE3  LYS  54           3HE      LYS  54 -23.159   5.728  -3.771
  476    HZ1  LYS  54           3HZ      LYS  54 -21.321   6.928  -4.610
  477    HZ2  LYS  54           1HZ      LYS  54 -20.206   5.777  -4.063
  478    HZ3  LYS  54           2HZ      LYS  54 -21.041   6.743  -2.952
  479    H    ARG  55           H        ARG  55 -17.226   3.638   0.471
  480    HA   ARG  55           HA       ARG  55 -14.860   5.154  -0.435
  481    HB2  ARG  55           2HB      ARG  55 -16.582   6.689   0.699
  482    HB3  ARG  55           3HB      ARG  55 -16.348   5.749   2.170
  483    HG2  ARG  55           2HG      ARG  55 -13.815   6.356   1.897
  484    HG3  ARG  55           3HG      ARG  55 -14.388   7.587   0.767
  485    HD2  ARG  55           2HD      ARG  55 -14.142   8.631   2.923
  486    HD3  ARG  55           3HD      ARG  55 -15.878   8.465   2.619
  487    HE   ARG  55           HE       ARG  55 -14.581   6.321   4.126
  488   HH11  ARG  55          1HH1      ARG  55 -16.525   9.247   4.324
  489   HH12  ARG  55          2HH1      ARG  55 -17.094   8.898   5.927
  490   HH21  ARG  55          1HH2      ARG  55 -15.308   5.883   6.208
  491   HH22  ARG  55          2HH2      ARG  55 -16.396   6.983   6.999
  492    H    VAL  56           H        VAL  56 -13.035   4.174   0.297
  493    HA   VAL  56           HA       VAL  56 -13.125   2.538   2.773
  494    HB   VAL  56           HB       VAL  56 -11.362   1.068   1.840
  495   HG11  VAL  56          1HG1      VAL  56 -12.735  -0.191   0.222
  496   HG12  VAL  56          2HG1      VAL  56 -13.809   1.199   0.039
  497   HG13  VAL  56          3HG1      VAL  56 -13.699   0.366   1.592
  498   HG21  VAL  56          3HG2      VAL  56 -10.738   1.128  -0.550
  499   HG22  VAL  56          1HG2      VAL  56 -10.301   2.635   0.257
  500   HG23  VAL  56          2HG2      VAL  56 -11.724   2.575  -0.783
  501    H    ARG  57           H        ARG  57 -11.575   3.021   4.271
  502    HA   ARG  57           HA       ARG  57  -9.591   5.133   3.630
  503    HB2  ARG  57           2HB      ARG  57 -11.267   5.607   5.464
  504    HB3  ARG  57           3HB      ARG  57 -10.619   4.242   6.369
  505    HG2  ARG  57           2HG      ARG  57  -8.415   5.374   6.487
  506    HG3  ARG  57           3HG      ARG  57  -9.069   6.735   5.575
  507    HD2  ARG  57           2HD      ARG  57 -10.700   7.142   7.423
  508    HD3  ARG  57           3HD      ARG  57  -9.957   5.828   8.341
  509    HE   ARG  57           HE       ARG  57  -8.238   8.050   7.478
  510   HH11  ARG  57          1HH1      ARG  57  -9.964   6.522  10.151
  511   HH12  ARG  57          2HH1      ARG  57  -9.089   7.403  11.364
  512   HH21  ARG  57          1HH2      ARG  57  -7.130   9.207   9.095
  513   HH22  ARG  57          2HH2      ARG  57  -7.494   8.915  10.766
  514    H    ILE  58           H        ILE  58  -7.731   4.155   3.042
  515    HA   ILE  58           HA       ILE  58  -6.868   1.645   4.373
  516    HB   ILE  58           HB       ILE  58  -5.867   2.790   1.714
  517   HG12  ILE  58          2HG1      ILE  58  -7.977   0.612   2.088
  518   HG13  ILE  58          3HG1      ILE  58  -8.314   2.258   1.568
  519   HG21  ILE  58          1HG2      ILE  58  -5.583  -0.005   2.894
  520   HG22  ILE  58          2HG2      ILE  58  -4.309   1.215   2.811
  521   HG23  ILE  58          3HG2      ILE  58  -4.963   0.522   1.327
  522   HD11  ILE  58          3HD1      ILE  58  -8.312   0.734  -0.302
  523   HD12  ILE  58          1HD1      ILE  58  -6.662   0.231   0.063
  524   HD13  ILE  58          2HD1      ILE  58  -6.989   1.889  -0.454
  525    H    SER  59           H        SER  59  -5.543   2.319   6.105
  526    HA   SER  59           HA       SER  59  -3.474   4.365   5.651
  527    HB2  SER  59           2HB      SER  59  -4.296   2.967   8.240
  528    HB3  SER  59           3HB      SER  59  -3.199   4.342   8.090
  529    HG   SER  59           HG       SER  59  -5.418   5.044   6.877
  530    H    ILE  60           H        ILE  60  -1.797   3.437   4.631
  531    HA   ILE  60           HA       ILE  60  -0.858   0.730   5.310
  532    HB   ILE  60           HB       ILE  60  -0.133   2.597   3.011
  533   HG12  ILE  60          2HG1      ILE  60  -1.673  -0.037   3.006
  534   HG13  ILE  60          3HG1      ILE  60  -2.396   1.562   2.856
  535   HG21  ILE  60          1HG2      ILE  60   0.900  -0.219   3.532
  536   HG22  ILE  60          2HG2      ILE  60   1.848   1.268   3.609
  537   HG23  ILE  60          3HG2      ILE  60   1.192   0.718   2.067
  538   HD11  ILE  60          3HD1      ILE  60  -0.528   0.247   0.889
  539   HD12  ILE  60          1HD1      ILE  60  -1.168   1.889   0.745
  540   HD13  ILE  60          2HD1      ILE  60  -2.263   0.508   0.713
  541    H    ARG  61           H        ARG  61   0.566   0.725   6.986
  542    HA   ARG  61           HA       ARG  61   2.554   2.902   7.233
  543    HB2  ARG  61           2HB      ARG  61   1.992   0.654   9.221
  544    HB3  ARG  61           3HB      ARG  61   3.010   2.071   9.471
  545    HG2  ARG  61           2HG      ARG  61   0.815   3.431   9.074
  546    HG3  ARG  61           3HG      ARG  61  -0.003   1.896   9.375
  547    HD2  ARG  61           2HD      ARG  61   1.860   3.378  11.262
  548    HD3  ARG  61           3HD      ARG  61   0.115   3.200  11.434
  549    HE   ARG  61           HE       ARG  61   0.498   0.789  11.787
  550   HH11  ARG  61          1HH1      ARG  61   3.259   2.930  12.270
  551   HH12  ARG  61          2HH1      ARG  61   4.066   1.833  13.347
  552   HH21  ARG  61          1HH2      ARG  61   1.574  -0.626  13.200
  553   HH22  ARG  61          2HH2      ARG  61   3.109  -0.181  13.869
  554    H    VAL  62           H        VAL  62   4.324   2.500   6.079
  555    HA   VAL  62           HA       VAL  62   4.960  -0.258   5.281
  556    HB   VAL  62           HB       VAL  62   4.632   1.623   3.564
  557   HG11  VAL  62          1HG1      VAL  62   5.875   3.436   4.690
  558   HG12  VAL  62          2HG1      VAL  62   6.483   3.144   3.057
  559   HG13  VAL  62          3HG1      VAL  62   7.384   2.545   4.455
  560   HG21  VAL  62          3HG2      VAL  62   7.248   0.110   3.482
  561   HG22  VAL  62          1HG2      VAL  62   6.437   0.835   2.091
  562   HG23  VAL  62          2HG2      VAL  62   5.671  -0.492   2.966
  563    H    LYS  63           H        LYS  63   6.962  -1.239   5.798
  564    HA   LYS  63           HA       LYS  63   8.308  -0.079   8.094
  565    HB2  LYS  63           2HB      LYS  63   7.724  -2.467   8.154
  566    HB3  LYS  63           3HB      LYS  63   8.725  -2.779   6.740
  567    HG2  LYS  63           2HG      LYS  63  10.745  -2.384   7.944
  568    HG3  LYS  63           3HG      LYS  63   9.901  -1.619   9.288
  569    HD2  LYS  63           2HD      LYS  63   9.701  -4.573   8.560
  570    HD3  LYS  63           3HD      LYS  63  10.732  -3.910   9.831
  571    HE2  LYS  63           2HE      LYS  63   8.648  -3.007  10.950
  572    HE3  LYS  63           3HE      LYS  63   7.693  -3.871   9.740
  573    HZ1  LYS  63           3HZ      LYS  63   8.663  -5.951  10.527
  574    HZ2  LYS  63           1HZ      LYS  63   7.873  -5.135  11.779
  575    HZ3  LYS  63           2HZ      LYS  63   9.564  -5.114  11.688
  576    H    HIS  64           H        HIS  64   9.957   1.170   7.900
  577    HA   HIS  64           HA       HIS  64  11.550   1.468   5.489
  578    HB2  HIS  64           2HB      HIS  64  11.784   2.894   8.189
  579    HB3  HIS  64           3HB      HIS  64  12.510   3.407   6.663
  580    HD1  HIS  64           HD1      HIS  64   9.321   3.488   8.585
  581    HD2  HIS  64           HD2      HIS  64  10.626   4.500   4.769
  582    HE1  HIS  64           HE1      HIS  64   7.475   4.856   7.582
  583    HE2  HIS  64           HE2      HIS  64   8.405   5.659   5.392
  584    H    SER  65           H        SER  65  13.855   1.224   5.492
  585    HA   SER  65           HA       SER  65  14.642  -1.273   6.547
  586    HB2  SER  65           2HB      SER  65  15.440  -0.386   4.374
  587    HB3  SER  65           3HB      SER  65  16.376   0.850   5.217
  588    HG   SER  65           HG       SER  65  17.605  -0.800   6.160
  589    H    ASP  66           H        ASP  66  15.764   2.011   7.307
  590    HA   ASP  66           HA       ASP  66  16.831   1.176   9.918
  591    HB2  ASP  66           2HB      ASP  66  18.471   2.725   7.848
  592    HB3  ASP  66           3HB      ASP  66  18.962   2.432   9.506
  593    H    ALA  67           H        ALA  67  17.856   3.450  10.841
  594    HA   ALA  67           HA       ALA  67  15.578   5.089  11.339
  595    HB1  ALA  67           3HB      ALA  67  18.476   5.524  12.126
  596    HB2  ALA  67           1HB      ALA  67  17.269   4.629  13.051
  597    HB3  ALA  67           2HB      ALA  67  17.078   6.365  12.806
  598    H    ALA  68           H        ALA  68  18.739   5.889   9.801
  599    HA   ALA  68           HA       ALA  68  17.866   8.415   8.730
  600    HB1  ALA  68           3HB      ALA  68  20.252   6.693   7.943
  601    HB2  ALA  68           1HB      ALA  68  20.247   7.951   9.179
  602    HB3  ALA  68           2HB      ALA  68  20.002   8.381   7.485
  603    H    GLU  69           H        GLU  69  17.674   5.107   7.678
  604    HA   GLU  69           HA       GLU  69  16.966   5.672   4.955
  605    HB2  GLU  69           2HB      GLU  69  16.748   3.131   6.585
  606    HB3  GLU  69           3HB      GLU  69  16.267   3.240   4.897
  607    HG2  GLU  69           2HG      GLU  69  19.056   3.765   5.957
  608    HG3  GLU  69           3HG      GLU  69  18.523   2.273   5.184
  609    H    GLU  70           H        GLU  70  15.167   5.950   7.879
  610    HA   GLU  70           HA       GLU  70  12.564   5.378   6.988
  611    HB2  GLU  70           2HB      GLU  70  13.503   7.516   8.929
  612    HB3  GLU  70           3HB      GLU  70  11.801   7.191   8.614
  613    HG2  GLU  70           2HG      GLU  70  12.038   4.917   9.467
  614    HG3  GLU  70           3HG      GLU  70  13.770   5.159   9.701
  615    H    LYS  71           H        LYS  71  14.339   8.475   6.761
  616    HA   LYS  71           HA       LYS  71  12.328   9.795   5.215
  617    HB2  LYS  71           2HB      LYS  71  13.952  11.623   5.012
  618    HB3  LYS  71           3HB      LYS  71  13.905  11.022   6.666
  619    HG2  LYS  71           2HG      LYS  71  15.983   9.646   6.099
  620    HG3  LYS  71           3HG      LYS  71  16.079  10.562   4.595
  621    HD2  LYS  71           2HD      LYS  71  16.270  11.663   7.426
  622    HD3  LYS  71           3HD      LYS  71  17.581  11.530   6.253
  623    HE2  LYS  71           2HE      LYS  71  15.147  13.329   6.007
  624    HE3  LYS  71           3HE      LYS  71  16.780  13.837   6.424
  625    HZ1  LYS  71           3HZ      LYS  71  16.228  14.250   4.095
  626    HZ2  LYS  71           1HZ      LYS  71  16.008  12.594   3.841
  627    HZ3  LYS  71           2HZ      LYS  71  17.536  13.189   4.250
  628    H    LYS  72           H        LYS  72  15.155   7.864   4.420
  629    HA   LYS  72           HA       LYS  72  15.414   8.535   1.667
  630    HB2  LYS  72           2HB      LYS  72  17.179   7.379   3.057
  631    HB3  LYS  72           3HB      LYS  72  16.176   5.938   3.072
  632    HG2  LYS  72           2HG      LYS  72  17.857   5.565   1.429
  633    HG3  LYS  72           3HG      LYS  72  16.365   5.880   0.541
  634    HD2  LYS  72           2HD      LYS  72  18.268   7.027  -0.508
  635    HD3  LYS  72           3HD      LYS  72  17.104   8.201   0.112
  636    HE2  LYS  72           2HE      LYS  72  19.454   8.864   0.571
  637    HE3  LYS  72           3HE      LYS  72  18.535   8.640   2.058
  638    HZ1  LYS  72           3HZ      LYS  72  20.739   7.670   2.215
  639    HZ2  LYS  72           1HZ      LYS  72  20.434   6.683   0.878
  640    HZ3  LYS  72           2HZ      LYS  72  19.564   6.459   2.308
  641    H    GLU  73           H        GLU  73  14.123   5.600   3.195
  642    HA   GLU  73           HA       GLU  73  12.775   4.559   0.958
  643    HB2  GLU  73           2HB      GLU  73  12.383   3.929   3.918
  644    HB3  GLU  73           3HB      GLU  73  11.708   2.984   2.597
  645    HG2  GLU  73           2HG      GLU  73  14.683   3.381   3.036
  646    HG3  GLU  73           3HG      GLU  73  13.771   2.019   3.674
  647    H    ALA  74           H        ALA  74  11.790   7.089   3.190
  648    HA   ALA  74           HA       ALA  74   8.998   6.885   2.893
  649    HB1  ALA  74           3HB      ALA  74  10.032   8.414   4.517
  650    HB2  ALA  74           1HB      ALA  74   8.941   9.289   3.445
  651    HB3  ALA  74           2HB      ALA  74  10.688   9.393   3.202
  652    H    LYS  75           H        LYS  75  11.248   9.061   1.155
  653    HA   LYS  75           HA       LYS  75   9.450   9.772  -0.913
  654    HB2  LYS  75           2HB      LYS  75  11.408  11.142  -0.112
  655    HB3  LYS  75           3HB      LYS  75  12.498   9.989  -0.871
  656    HG2  LYS  75           2HG      LYS  75  12.282  11.949  -2.285
  657    HG3  LYS  75           3HG      LYS  75  11.530  10.573  -3.096
  658    HD2  LYS  75           2HD      LYS  75   9.297  11.375  -2.420
  659    HD3  LYS  75           3HD      LYS  75  10.030  12.720  -1.539
  660    HE2  LYS  75           2HE      LYS  75   9.178  13.509  -3.671
  661    HE3  LYS  75           3HE      LYS  75  10.939  13.591  -3.692
  662    HZ1  LYS  75           3HZ      LYS  75  10.084  12.725  -5.758
  663    HZ2  LYS  75           1HZ      LYS  75   9.269  11.482  -4.954
  664    HZ3  LYS  75           2HZ      LYS  75  10.961  11.521  -4.963
  665    H    LYS  76           H        LYS  76  12.037   7.363  -0.735
  666    HA   LYS  76           HA       LYS  76  12.158   6.672  -3.474
  667    HB2  LYS  76           2HB      LYS  76  14.023   6.265  -2.012
  668    HB3  LYS  76           3HB      LYS  76  13.066   5.232  -0.958
  669    HG2  LYS  76           2HG      LYS  76  13.032   3.460  -2.559
  670    HG3  LYS  76           3HG      LYS  76  13.637   4.512  -3.847
  671    HD2  LYS  76           2HD      LYS  76  15.819   4.658  -2.827
  672    HD3  LYS  76           3HD      LYS  76  15.251   3.895  -1.340
  673    HE2  LYS  76           2HE      LYS  76  15.374   2.498  -4.033
  674    HE3  LYS  76           3HE      LYS  76  16.619   2.395  -2.785
  675    HZ1  LYS  76           3HZ      LYS  76  14.894   1.530  -1.269
  676    HZ2  LYS  76           1HZ      LYS  76  15.197   0.521  -2.594
  677    HZ3  LYS  76           2HZ      LYS  76  13.810   1.484  -2.566
  678    H    PHE  77           H        PHE  77  10.568   4.963  -0.719
  679    HA   PHE  77           HA       PHE  77   9.280   3.063  -2.473
  680    HB2  PHE  77           2HB      PHE  77   9.916   2.737   0.062
  681    HB3  PHE  77           3HB      PHE  77   8.379   3.524   0.393
  682    HD1  PHE  77           HD1      PHE  77   9.991   0.473  -0.929
  683    HD2  PHE  77           HD2      PHE  77   6.246   2.368  -0.139
  684    HE1  PHE  77           HE1      PHE  77   8.840  -1.679  -1.214
  685    HE2  PHE  77           HE2      PHE  77   5.104   0.211  -0.419
  686    HZ   PHE  77           HZ       PHE  77   6.394  -1.810  -0.956
  687    H    ALA  78           H        ALA  78   8.517   6.263  -1.303
  688    HA   ALA  78           HA       ALA  78   5.746   6.402  -1.775
  689    HB1  ALA  78           3HB      ALA  78   7.777   8.581  -2.350
  690    HB2  ALA  78           1HB      ALA  78   6.988   8.283  -0.805
  691    HB3  ALA  78           2HB      ALA  78   6.030   8.804  -2.192
  692    H    ALA  79           H        ALA  79   8.466   6.586  -4.057
  693    HA   ALA  79           HA       ALA  79   7.016   7.140  -6.415
  694    HB1  ALA  79           3HB      ALA  79   9.008   6.305  -7.600
  695    HB2  ALA  79           1HB      ALA  79   9.620   5.603  -6.090
  696    HB3  ALA  79           2HB      ALA  79   9.465   7.350  -6.257
  697    H    ILE  80           H        ILE  80   7.978   4.103  -4.867
  698    HA   ILE  80           HA       ILE  80   7.087   2.287  -6.831
  699    HB   ILE  80           HB       ILE  80   7.477   1.895  -3.823
  700   HG12  ILE  80          2HG1      ILE  80   9.543   2.624  -4.931
  701   HG13  ILE  80          3HG1      ILE  80   9.699   0.930  -4.483
  702   HG21  ILE  80          1HG2      ILE  80   7.291  -0.260  -5.958
  703   HG22  ILE  80          2HG2      ILE  80   6.062   0.092  -4.746
  704   HG23  ILE  80          3HG2      ILE  80   7.639  -0.516  -4.248
  705   HD11  ILE  80          3HD1      ILE  80  10.651   1.333  -6.665
  706   HD12  ILE  80          1HD1      ILE  80   9.131   1.999  -7.256
  707   HD13  ILE  80          2HD1      ILE  80   9.240   0.289  -6.825
  708    H    LEU  81           H        LEU  81   5.497   3.593  -3.910
  709    HA   LEU  81           HA       LEU  81   3.053   2.144  -4.178
  710    HB2  LEU  81           2HB      LEU  81   3.948   4.513  -2.515
  711    HB3  LEU  81           3HB      LEU  81   2.255   4.053  -2.534
  712    HG   LEU  81           HG       LEU  81   4.500   2.173  -1.701
  713   HD11  LEU  81          1HD1      LEU  81   2.627   3.761   0.079
  714   HD12  LEU  81          2HD1      LEU  81   4.357   4.046  -0.133
  715   HD13  LEU  81          3HD1      LEU  81   3.799   2.551   0.612
  716   HD21  LEU  81          3HD2      LEU  81   2.507   0.991  -2.512
  717   HD22  LEU  81          1HD2      LEU  81   1.485   1.906  -1.396
  718   HD23  LEU  81          2HD2      LEU  81   2.694   0.778  -0.775
  719    H    ASN  82           H        ASN  82   4.132   5.383  -5.178
  720    HA   ASN  82           HA       ASN  82   1.701   6.611  -5.853
  721    HB2  ASN  82           2HB      ASN  82   3.864   7.840  -5.709
  722    HB3  ASN  82           3HB      ASN  82   4.451   7.001  -7.142
  723   HD21  ASN  82          1HD2      ASN  82   4.743   8.792  -8.408
  724   HD22  ASN  82          2HD2      ASN  82   3.463   9.830  -8.935
  725    H    LYS  83           H        LYS  83   3.905   4.624  -7.763
  726    HA   LYS  83           HA       LYS  83   2.531   4.778 -10.244
  727    HB2  LYS  83           2HB      LYS  83   4.465   2.639  -9.262
  728    HB3  LYS  83           3HB      LYS  83   3.979   2.893 -10.936
  729    HG2  LYS  83           2HG      LYS  83   5.599   4.787  -9.216
  730    HG3  LYS  83           3HG      LYS  83   6.197   3.815 -10.559
  731    HD2  LYS  83           2HD      LYS  83   4.864   5.127 -12.143
  732    HD3  LYS  83           3HD      LYS  83   4.134   6.043 -10.820
  733    HE2  LYS  83           2HE      LYS  83   5.894   7.355 -11.905
  734    HE3  LYS  83           3HE      LYS  83   6.358   6.976 -10.248
  735    HZ1  LYS  83           3HZ      LYS  83   7.775   5.218 -11.087
  736    HZ2  LYS  83           1HZ      LYS  83   8.192   6.696 -11.793
  737    HZ3  LYS  83           2HZ      LYS  83   7.312   5.554 -12.674
  738    H    VAL  84           H        VAL  84   2.392   2.516  -7.505
  739    HA   VAL  84           HA       VAL  84   0.921   0.430  -8.780
  740    HB   VAL  84           HB       VAL  84   1.387   1.123  -5.840
  741   HG11  VAL  84          1HG1      VAL  84  -0.026  -1.352  -6.914
  742   HG12  VAL  84          2HG1      VAL  84  -0.752  -0.084  -5.925
  743   HG13  VAL  84          3HG1      VAL  84   0.501  -1.122  -5.247
  744   HG21  VAL  84          3HG2      VAL  84   2.920  -0.795  -5.901
  745   HG22  VAL  84          1HG2      VAL  84   3.351   0.382  -7.142
  746   HG23  VAL  84          2HG2      VAL  84   2.501  -1.097  -7.589
  747    H    PHE  85           H        PHE  85   0.010   3.062  -6.585
  748    HA   PHE  85           HA       PHE  85  -2.765   2.640  -6.535
  749    HB2  PHE  85           2HB      PHE  85  -1.188   5.217  -6.119
  750    HB3  PHE  85           3HB      PHE  85  -2.901   5.034  -5.752
  751    HD1  PHE  85           HD1      PHE  85  -3.040   2.374  -4.468
  752    HD2  PHE  85           HD2      PHE  85  -0.116   5.466  -4.014
  753    HE1  PHE  85           HE1      PHE  85  -2.489   1.537  -2.221
  754    HE2  PHE  85           HE2      PHE  85   0.429   4.611  -1.775
  755    HZ   PHE  85           HZ       PHE  85  -0.755   2.652  -0.878
  756    H    ALA  86           H        ALA  86  -0.739   4.600  -8.709
  757    HA   ALA  86           HA       ALA  86  -2.818   5.676 -10.324
  758    HB1  ALA  86           3HB      ALA  86  -1.028   6.257 -11.906
  759    HB2  ALA  86           1HB      ALA  86   0.098   5.191 -11.042
  760    HB3  ALA  86           2HB      ALA  86  -0.546   6.629 -10.254
  761    H    GLU  87           H        GLU  87  -1.248   2.553 -10.293
  762    HA   GLU  87           HA       GLU  87  -2.247   1.695 -12.908
  763    HB2  GLU  87           2HB      GLU  87  -0.694   0.244 -10.715
  764    HB3  GLU  87           3HB      GLU  87  -1.223  -0.545 -12.198
  765    HG2  GLU  87           2HG      GLU  87   0.187   0.946 -13.533
  766    HG3  GLU  87           3HG      GLU  87   0.663   1.835 -12.089
  767    H    LEU  88           H        LEU  88  -3.566   1.998  -9.821
  768    HA   LEU  88           HA       LEU  88  -5.413  -0.304 -10.140
  769    HB2  LEU  88           2HB      LEU  88  -4.675   1.267  -7.633
  770    HB3  LEU  88           3HB      LEU  88  -5.938   0.048  -7.692
  771    HG   LEU  88           HG       LEU  88  -2.968  -0.468  -8.152
  772   HD11  LEU  88          1HD1      LEU  88  -4.712  -1.232  -5.786
  773   HD12  LEU  88          2HD1      LEU  88  -3.469   0.022  -5.804
  774   HD13  LEU  88          3HD1      LEU  88  -3.013  -1.666  -6.018
  775   HD21  LEU  88          3HD2      LEU  88  -4.318  -2.006  -9.497
  776   HD22  LEU  88          1HD2      LEU  88  -5.256  -2.465  -8.074
  777   HD23  LEU  88          2HD2      LEU  88  -3.538  -2.861  -8.170
  778    H    GLY  89           H        GLY  89  -5.194   3.178  -9.987
  779    HA2  GLY  89           2HA      GLY  89  -6.934   4.402 -11.205
  780    HA3  GLY  89           3HA      GLY  89  -8.137   3.408 -10.401
  781    H    TYR  90           H        TYR  90  -5.550   4.412  -8.385
  782    HA   TYR  90           HA       TYR  90  -7.131   6.602  -7.193
  783    HB2  TYR  90           2HB      TYR  90  -4.638   5.358  -5.964
  784    HB3  TYR  90           3HB      TYR  90  -5.915   6.255  -5.155
  785    HD1  TYR  90           HD2      TYR  90  -8.393   4.980  -5.725
  786    HD2  TYR  90           HD1      TYR  90  -4.562   3.126  -5.287
  787    HE1  TYR  90           HE2      TYR  90  -9.482   2.853  -5.132
  788    HE2  TYR  90           HE1      TYR  90  -5.649   1.004  -4.690
  789    HH   TYR  90           HH       TYR  90  -7.820   0.248  -3.770
  790    H    ASN  91           H        ASN  91  -6.359   8.689  -7.411
  791    HA   ASN  91           HA       ASN  91  -3.776   9.070  -8.823
  792    HB2  ASN  91           2HB      ASN  91  -6.411  10.465  -9.471
  793    HB3  ASN  91           3HB      ASN  91  -4.856  10.838 -10.205
  794   HD21  ASN  91          1HD2      ASN  91  -3.935   9.334 -11.669
  795   HD22  ASN  91          2HD2      ASN  91  -4.902   8.127 -12.435
  796    H    ASP  92           H        ASP  92  -2.744   9.769  -6.937
  797    HA   ASP  92           HA       ASP  92  -1.627  11.401  -5.855
  798    HB2  ASP  92           2HB      ASP  92  -3.286  13.223  -7.625
  799    HB3  ASP  92           3HB      ASP  92  -2.033  13.832  -6.548
  800    H    SER  93           H        SER  93  -4.818  13.001  -6.051
  801    HA   SER  93           HA       SER  93  -4.839  14.202  -3.537
  802    HB2  SER  93           2HB      SER  93  -7.267  13.296  -5.145
  803    HB3  SER  93           3HB      SER  93  -7.209  14.620  -3.979
  804    HG   SER  93           HG       SER  93  -6.531  14.593  -6.616
  805    H    ASN  94           H        ASN  94  -5.849  10.972  -4.489
  806    HA   ASN  94           HA       ASN  94  -7.224  10.173  -2.148
  807    HB2  ASN  94           2HB      ASN  94  -5.613   8.416  -4.060
  808    HB3  ASN  94           3HB      ASN  94  -6.895   7.877  -2.977
  809   HD21  ASN  94          1HD2      ASN  94  -9.067   8.285  -3.569
  810   HD22  ASN  94          2HD2      ASN  94  -9.504   8.804  -5.157
  811    H    VAL  95           H        VAL  95  -3.833  10.261  -3.009
  812    HA   VAL  95           HA       VAL  95  -2.966   8.435  -0.880
  813    HB   VAL  95           HB       VAL  95  -1.401   9.709  -3.189
  814   HG11  VAL  95          1HG1      VAL  95   0.080   8.973  -1.358
  815   HG12  VAL  95          2HG1      VAL  95   0.295   7.970  -2.793
  816   HG13  VAL  95          3HG1      VAL  95  -0.628   7.354  -1.422
  817   HG21  VAL  95          3HG2      VAL  95  -3.226   8.298  -4.050
  818   HG22  VAL  95          1HG2      VAL  95  -2.660   6.941  -3.069
  819   HG23  VAL  95          2HG2      VAL  95  -1.654   7.565  -4.381
  820    H    THR  96           H        THR  96  -2.706   9.545   1.073
  821    HA   THR  96           HA       THR  96  -1.086  12.047   1.066
  822    HB   THR  96           HB       THR  96  -3.315  11.313   3.029
  823    HG1  THR  96           HG1      THR  96  -3.469  12.371   0.596
  824   HG21  THR  96          3HG2      THR  96  -3.038  13.625   3.875
  825   HG22  THR  96          1HG2      THR  96  -1.699  13.887   2.761
  826   HG23  THR  96          2HG2      THR  96  -1.540  12.709   4.070
  827    H    TRP  97           H        TRP  97   0.818  11.828   2.146
  828    HA   TRP  97           HA       TRP  97   1.279   9.569   3.961
  829    HB2  TRP  97           2HB      TRP  97   3.133  11.684   2.774
  830    HB3  TRP  97           3HB      TRP  97   3.666  10.513   3.979
  831    HD1  TRP  97           HD1      TRP  97   2.169  10.488   0.364
  832    HE1  TRP  97           HE1      TRP  97   3.082   8.408  -0.848
  833    HE3  TRP  97           HE3      TRP  97   4.757   8.332   4.233
  834    HZ2  TRP  97           HZ2      TRP  97   4.678   6.166  -0.254
  835    HZ3  TRP  97           HZ3      TRP  97   5.948   6.214   3.824
  836    HH2  TRP  97           HH2      TRP  97   5.906   5.151   1.621
  837    H    ASP  98           H        ASP  98   1.914   9.798   6.096
  838    HA   ASP  98           HA       ASP  98   1.947  12.296   7.508
  839    HB2  ASP  98           2HB      ASP  98   0.032  11.757   9.027
  840    HB3  ASP  98           3HB      ASP  98  -0.478  12.051   7.375
  841    H    GLY  99           H        GLY  99   3.889  11.819   8.347
  842    HA2  GLY  99           2HA      GLY  99   5.362  11.060   9.938
  843    HA3  GLY  99           3HA      GLY  99   4.126   9.971  10.539
  844    H    ASP 100           H        ASP 100   4.163   7.857   9.936
  845    HA   ASP 100           HA       ASP 100   6.311   6.881   8.117
  846    HB2  ASP 100           2HB      ASP 100   6.313   4.820   9.408
  847    HB3  ASP 100           3HB      ASP 100   6.431   6.155  10.549
  848    H    THR 101           H        THR 101   3.109   7.509   8.220
  849    HA   THR 101           HA       THR 101   2.076   5.029   7.022
  850    HB   THR 101           HB       THR 101   0.565   7.349   8.319
  851    HG1  THR 101           HG1      THR 101   2.116   5.609   9.523
  852   HG21  THR 101          3HG2      THR 101  -0.331   4.510   7.673
  853   HG22  THR 101          1HG2      THR 101  -0.840   5.966   6.808
  854   HG23  THR 101          2HG2      THR 101  -1.300   5.733   8.496
  855    H    VAL 102           H        VAL 102   0.796   5.163   5.145
  856    HA   VAL 102           HA       VAL 102   0.314   7.790   3.903
  857    HB   VAL 102           HB       VAL 102   2.010   6.791   2.521
  858   HG11  VAL 102          1HG1      VAL 102   0.364   4.253   2.342
  859   HG12  VAL 102          2HG1      VAL 102   1.879   4.452   3.223
  860   HG13  VAL 102          3HG1      VAL 102   1.861   4.578   1.463
  861   HG21  VAL 102          3HG2      VAL 102   0.869   6.613   0.342
  862   HG22  VAL 102          1HG2      VAL 102   0.198   7.926   1.314
  863   HG23  VAL 102          2HG2      VAL 102  -0.679   6.401   1.164
  864    H    THR 103           H        THR 103  -1.785   8.109   4.314
  865    HA   THR 103           HA       THR 103  -3.712   5.919   4.382
  866    HB   THR 103           HB       THR 103  -4.112   8.862   5.093
  867    HG1  THR 103           HG1      THR 103  -2.629   8.067   6.537
  868   HG21  THR 103          3HG2      THR 103  -6.063   8.029   6.372
  869   HG22  THR 103          1HG2      THR 103  -5.748   6.387   5.809
  870   HG23  THR 103          2HG2      THR 103  -6.231   7.640   4.659
  871    H    VAL 104           H        VAL 104  -4.351   5.421   2.392
  872    HA   VAL 104           HA       VAL 104  -4.950   7.437   0.343
  873    HB   VAL 104           HB       VAL 104  -4.691   4.399   0.052
  874   HG11  VAL 104          1HG1      VAL 104  -4.610   4.817  -2.387
  875   HG12  VAL 104          2HG1      VAL 104  -4.867   6.542  -2.110
  876   HG13  VAL 104          3HG1      VAL 104  -6.136   5.387  -1.698
  877   HG21  VAL 104          3HG2      VAL 104  -2.505   4.853  -1.007
  878   HG22  VAL 104          1HG2      VAL 104  -2.534   5.387   0.675
  879   HG23  VAL 104          2HG2      VAL 104  -2.670   6.566  -0.632
  880    H    GLU 105           H        GLU 105  -7.059   7.995   0.139
  881    HA   GLU 105           HA       GLU 105  -9.219   6.244   1.067
  882    HB2  GLU 105           2HB      GLU 105  -9.352   8.680   1.528
  883    HB3  GLU 105           3HB      GLU 105  -9.293   9.024  -0.198
  884    HG2  GLU 105           2HG      GLU 105 -11.463   7.869  -0.512
  885    HG3  GLU 105           3HG      GLU 105 -11.517   7.493   1.210
  886    H    GLY 106           H        GLY 106 -10.182   4.825  -0.311
  887    HA2  GLY 106           2HA      GLY 106  -9.957   5.197  -3.253
  888    HA3  GLY 106           3HA      GLY 106 -10.291   3.678  -2.424
  889    H    GLN 107           H        GLN 107 -11.839   4.920  -4.548
  890    HA   GLN 107           HA       GLN 107 -14.472   4.967  -3.209
  891    HB2  GLN 107           2HB      GLN 107 -13.884   7.325  -3.733
  892    HB3  GLN 107           3HB      GLN 107 -13.611   6.902  -5.420
  893    HG2  GLN 107           2HG      GLN 107 -16.018   6.264  -5.616
  894    HG3  GLN 107           3HG      GLN 107 -16.263   6.761  -3.944
  895   HE21  GLN 107          1HE2      GLN 107 -16.305   8.988  -3.459
  896   HE22  GLN 107          2HE2      GLN 107 -16.445  10.197  -4.681
  897    H    LEU 108           H        LEU 108 -15.604   3.275  -3.989
  898    HA   LEU 108           HA       LEU 108 -16.067   3.042  -6.808
  899    HB2  LEU 108           2HB      LEU 108 -15.426   0.759  -7.195
  900    HB3  LEU 108           3HB      LEU 108 -14.036   1.633  -6.610
  901    HG   LEU 108           HG       LEU 108 -13.830  -0.502  -5.661
  902   HD11  LEU 108          1HD1      LEU 108 -14.019  -0.297  -3.235
  903   HD12  LEU 108          2HD1      LEU 108 -15.067   1.110  -3.424
  904   HD13  LEU 108          3HD1      LEU 108 -13.392   1.183  -3.966
  905   HD21  LEU 108          3HD2      LEU 108 -15.559  -1.811  -4.525
  906   HD22  LEU 108          1HD2      LEU 108 -16.037  -1.416  -6.177
  907   HD23  LEU 108          2HD2      LEU 108 -16.744  -0.538  -4.820
  908    H    GLU 109           H        GLU 109 -18.074   2.464  -7.197
  909    HA   GLU 109           HA       GLU 109 -19.964   2.016  -5.058
  910    HB2  GLU 109           2HB      GLU 109 -20.231   2.108  -8.096
  911    HB3  GLU 109           3HB      GLU 109 -21.601   1.751  -7.051
  912    HG2  GLU 109           2HG      GLU 109 -21.576   4.102  -7.775
  913    HG3  GLU 109           3HG      GLU 109 -21.466   3.938  -6.026
  914    H    GLY 110           H        GLY 110 -18.726   0.195  -7.805
  915    HA2  GLY 110           2HA      GLY 110 -18.429  -2.273  -6.576
  916    HA3  GLY 110           3HA      GLY 110 -20.043  -2.265  -7.292
  917    H    VAL 111           H        VAL 111 -16.606  -2.195  -7.939
  918    HA   VAL 111           HA       VAL 111 -16.700  -1.769 -10.748
  919    HB   VAL 111           HB       VAL 111 -14.364  -2.539 -10.824
  920   HG11  VAL 111          1HG1      VAL 111 -14.759  -0.245 -10.053
  921   HG12  VAL 111          2HG1      VAL 111 -13.347  -0.928  -9.247
  922   HG13  VAL 111          3HG1      VAL 111 -14.881  -0.802  -8.380
  923   HG21  VAL 111          3HG2      VAL 111 -14.503  -4.481  -9.333
  924   HG22  VAL 111          1HG2      VAL 111 -14.738  -3.424  -7.939
  925   HG23  VAL 111          2HG2      VAL 111 -13.204  -3.405  -8.815
  926    H    ASP 112           H        ASP 112 -16.170  -3.339 -12.425
  927    HA   ASP 112           HA       ASP 112 -17.814  -5.695 -12.232
  928    HB2  ASP 112           2HB      ASP 112 -17.680  -4.277 -14.306
  929    HB3  ASP 112           3HB      ASP 112 -16.011  -4.793 -14.525
  930    H    LEU 113           H        LEU 113 -16.785  -6.988 -10.660
  931    HA   LEU 113           HA       LEU 113 -14.143  -8.068 -10.980
  932    HB2  LEU 113           2HB      LEU 113 -16.532  -9.083  -9.380
  933    HB3  LEU 113           3HB      LEU 113 -14.931  -9.798  -9.310
  934    HG   LEU 113           HG       LEU 113 -15.727  -7.017  -8.339
  935   HD11  LEU 113          1HD1      LEU 113 -14.716  -9.433  -6.798
  936   HD12  LEU 113          2HD1      LEU 113 -16.377  -8.833  -6.823
  937   HD13  LEU 113          3HD1      LEU 113 -15.100  -7.848  -6.119
  938   HD21  LEU 113          3HD2      LEU 113 -13.407  -6.730  -7.575
  939   HD22  LEU 113          1HD2      LEU 113 -13.492  -6.878  -9.331
  940   HD23  LEU 113          2HD2      LEU 113 -12.949  -8.246  -8.358
  941    H    GLU 114           H        GLU 114 -13.873  -8.801 -12.982
  942    HA   GLU 114           HA       GLU 114 -15.718 -10.033 -14.658
  943    HB2  GLU 114           2HB      GLU 114 -13.850 -10.470 -16.190
  944    HB3  GLU 114           3HB      GLU 114 -13.743  -8.855 -15.520
  945    HG2  GLU 114           2HG      GLU 114 -12.052 -11.232 -14.688
  946    HG3  GLU 114           3HG      GLU 114 -11.534  -9.931 -15.751
  947    H    HIS 115           H        HIS 115 -12.976 -11.634 -12.992
  948    HA   HIS 115           HA       HIS 115 -14.367 -14.120 -12.564
  949    HB2  HIS 115           2HB      HIS 115 -12.131 -14.015 -14.658
  950    HB3  HIS 115           3HB      HIS 115 -12.663 -15.503 -13.883
  951    HD1  HIS 115           HD1      HIS 115 -13.431 -13.219 -16.658
  952    HD2  HIS 115           HD2      HIS 115 -15.347 -16.300 -14.638
  953    HE1  HIS 115           HE1      HIS 115 -15.381 -13.863 -18.101
  954    HE2  HIS 115           HE2      HIS 115 -16.611 -15.609 -16.776
  955    H    HIS 116           H        HIS 116 -13.289 -15.272 -10.942
  956    HA   HIS 116           HA       HIS 116 -10.792 -14.121  -9.854
  957    HB2  HIS 116           2HB      HIS 116 -12.745 -16.161  -8.692
  958    HB3  HIS 116           3HB      HIS 116 -11.260 -15.649  -7.890
  959    HD1  HIS 116           HD1      HIS 116 -14.764 -14.901  -7.892
  960    HD2  HIS 116           HD2      HIS 116 -11.285 -12.654  -7.561
  961    HE1  HIS 116           HE1      HIS 116 -15.459 -12.721  -6.848
  962    HE2  HIS 116           HE2      HIS 116 -13.305 -11.463  -6.507
  963    H    HIS 117           H        HIS 117  -8.911 -15.386  -9.639
  964    HA   HIS 117           HA       HIS 117  -8.814 -17.910 -11.208
  965    HB2  HIS 117           2HB      HIS 117  -7.986 -15.916 -12.536
  966    HB3  HIS 117           3HB      HIS 117  -6.742 -15.659 -11.321
  967    HD1  HIS 117           HD1      HIS 117  -7.770 -18.089 -14.026
  968    HD2  HIS 117           HD2      HIS 117  -4.479 -17.255 -11.623
  969    HE1  HIS 117           HE1      HIS 117  -5.888 -19.465 -14.952
  970    HE2  HIS 117           HE2      HIS 117  -3.877 -18.819 -13.587
  971    H    HIS 118           H        HIS 118  -7.161 -19.380 -10.582
  972    HA   HIS 118           HA       HIS 118  -6.548 -19.717  -7.878
  973    HB2  HIS 118           2HB      HIS 118  -5.113 -20.836 -10.335
  974    HB3  HIS 118           3HB      HIS 118  -4.788 -21.376  -8.694
  975    HD1  HIS 118           HD1      HIS 118  -5.479 -23.623 -10.224
  976    HD2  HIS 118           HD2      HIS 118  -8.509 -21.139  -8.845
  977    HE1  HIS 118           HE1      HIS 118  -7.564 -25.017 -10.268
  978    HE2  HIS 118           HE2      HIS 118  -9.402 -23.432  -9.610
  979    H    HIS 119           H        HIS 119  -5.423 -18.242  -6.703
  980    HA   HIS 119           HA       HIS 119  -3.467 -16.467  -7.732
  981    HB2  HIS 119           2HB      HIS 119  -3.190 -15.629  -5.509
  982    HB3  HIS 119           3HB      HIS 119  -4.880 -16.105  -5.613
  983    HD1  HIS 119           HD1      HIS 119  -5.439 -18.510  -4.444
  984    HD2  HIS 119           HD2      HIS 119  -1.817 -16.745  -3.418
  985    HE1  HIS 119           HE1      HIS 119  -4.676 -19.691  -2.369
  986    HE2  HIS 119           HE2      HIS 119  -2.461 -18.647  -1.800
  987    H    HIS 120           H        HIS 120  -1.230 -16.527  -7.666
  988    HA   HIS 120           HA       HIS 120   0.039 -19.137  -7.327
  989    HB2  HIS 120           2HB      HIS 120   1.329 -16.539  -8.282
  990    HB3  HIS 120           3HB      HIS 120   1.954 -18.173  -8.477
  991    HD1  HIS 120           HD1      HIS 120   0.634 -15.702 -10.494
  992    HD2  HIS 120           HD2      HIS 120  -0.349 -19.714 -10.025
  993    HE1  HIS 120           HE1      HIS 120  -0.594 -16.345 -12.588
  994    HE2  HIS 120           HE2      HIS 120  -1.003 -18.810 -12.351
  Start of MODEL   17
    1    H1   MET   1           1H       MET   1  21.728  -0.554  -2.541
    2    H2   MET   1           2H       MET   1  23.060  -1.573  -2.741
    3    H3   MET   1           3H       MET   1  22.439  -1.285  -1.199
    4    HA   MET   1           HA       MET   1  21.010  -2.652  -3.384
    5    HB2  MET   1           2HB      MET   1  23.030  -3.854  -2.241
    6    HB3  MET   1           3HB      MET   1  22.023  -3.920  -0.803
    7    HG2  MET   1           2HG      MET   1  21.351  -5.175  -3.477
    8    HG3  MET   1           3HG      MET   1  22.004  -6.024  -2.079
    9    HE1  MET   1           3HE      MET   1  18.314  -7.359  -2.337
   10    HE2  MET   1           1HE      MET   1  20.023  -7.777  -2.447
   11    HE3  MET   1           2HE      MET   1  19.258  -6.835  -3.730
   12    H    SER   2           H        SER   2  19.035  -1.731  -3.149
   13    HA   SER   2           HA       SER   2  17.960  -0.939  -0.563
   14    HB2  SER   2           2HB      SER   2  17.771   0.544  -2.568
   15    HB3  SER   2           3HB      SER   2  16.755  -0.667  -3.352
   16    HG   SER   2           HG       SER   2  15.326  -0.402  -1.466
   17    H    GLY   3           H        GLY   3  17.888  -3.784  -2.383
   18    HA2  GLY   3           2HA      GLY   3  15.148  -4.590  -2.025
   19    HA3  GLY   3           3HA      GLY   3  16.480  -5.580  -2.588
   20    H    LYS   4           H        LYS   4  15.237  -4.090   0.386
   21    HA   LYS   4           HA       LYS   4  15.959  -6.518   1.911
   22    HB2  LYS   4           2HB      LYS   4  16.034  -3.647   2.580
   23    HB3  LYS   4           3HB      LYS   4  15.024  -4.507   3.726
   24    HG2  LYS   4           2HG      LYS   4  17.287  -4.354   4.582
   25    HG3  LYS   4           3HG      LYS   4  16.887  -6.038   4.240
   26    HD2  LYS   4           2HD      LYS   4  19.157  -5.602   3.523
   27    HD3  LYS   4           3HD      LYS   4  18.157  -5.880   2.097
   28    HE2  LYS   4           2HE      LYS   4  19.712  -4.034   1.722
   29    HE3  LYS   4           3HE      LYS   4  18.056  -3.430   1.714
   30    HZ1  LYS   4           3HZ      LYS   4  19.535  -1.984   2.960
   31    HZ2  LYS   4           1HZ      LYS   4  19.960  -3.256   3.990
   32    HZ3  LYS   4           2HZ      LYS   4  18.376  -2.666   3.988
   33    H    LYS   5           H        LYS   5  14.254  -6.895   3.732
   34    HA   LYS   5           HA       LYS   5  11.676  -7.243   2.407
   35    HB2  LYS   5           2HB      LYS   5  12.809  -9.152   3.594
   36    HB3  LYS   5           3HB      LYS   5  12.604  -8.287   5.114
   37    HG2  LYS   5           2HG      LYS   5  10.138  -8.388   4.834
   38    HG3  LYS   5           3HG      LYS   5  10.351  -9.250   3.309
   39    HD2  LYS   5           2HD      LYS   5   9.808 -10.837   5.094
   40    HD3  LYS   5           3HD      LYS   5  11.452 -11.117   4.519
   41    HE2  LYS   5           2HE      LYS   5  12.354  -9.923   6.478
   42    HE3  LYS   5           3HE      LYS   5  10.718  -9.568   7.031
   43    HZ1  LYS   5           3HZ      LYS   5  11.542 -11.421   8.247
   44    HZ2  LYS   5           1HZ      LYS   5  11.993 -12.241   6.841
   45    HZ3  LYS   5           2HZ      LYS   5  10.360 -12.003   7.188
   46    H    VAL   6           H        VAL   6  10.315  -5.592   2.573
   47    HA   VAL   6           HA       VAL   6  10.076  -4.006   5.056
   48    HB   VAL   6           HB       VAL   6  10.214  -2.613   3.034
   49   HG11  VAL   6          1HG1      VAL   6   9.471  -4.247   1.345
   50   HG12  VAL   6          2HG1      VAL   6   8.590  -2.725   1.189
   51   HG13  VAL   6          3HG1      VAL   6   7.812  -4.122   1.940
   52   HG21  VAL   6          3HG2      VAL   6   8.086  -1.323   3.198
   53   HG22  VAL   6          1HG2      VAL   6   8.726  -1.765   4.786
   54   HG23  VAL   6          2HG2      VAL   6   7.365  -2.656   4.104
   55    H    GLU   7           H        GLU   7   8.134  -4.021   6.218
   56    HA   GLU   7           HA       GLU   7   6.178  -6.125   5.493
   57    HB2  GLU   7           2HB      GLU   7   6.847  -4.934   8.221
   58    HB3  GLU   7           3HB      GLU   7   5.533  -6.074   7.925
   59    HG2  GLU   7           2HG      GLU   7   7.164  -7.760   7.150
   60    HG3  GLU   7           3HG      GLU   7   8.481  -6.622   7.433
   61    H    VAL   8           H        VAL   8   4.563  -5.304   4.513
   62    HA   VAL   8           HA       VAL   8   3.790  -2.486   4.762
   63    HB   VAL   8           HB       VAL   8   3.278  -4.580   2.593
   64   HG11  VAL   8          1HG1      VAL   8   1.332  -3.069   2.712
   65   HG12  VAL   8          2HG1      VAL   8   2.259  -2.790   1.238
   66   HG13  VAL   8          3HG1      VAL   8   2.404  -1.670   2.592
   67   HG21  VAL   8          3HG2      VAL   8   4.994  -2.064   2.560
   68   HG22  VAL   8          1HG2      VAL   8   4.763  -3.174   1.205
   69   HG23  VAL   8          2HG2      VAL   8   5.599  -3.721   2.661
   70    H    GLN   9           H        GLN   9   2.088  -2.102   6.064
   71    HA   GLN   9           HA       GLN   9   0.158  -4.261   6.667
   72    HB2  GLN   9           2HB      GLN   9   0.796  -1.739   8.272
   73    HB3  GLN   9           3HB      GLN   9  -0.288  -3.043   8.760
   74    HG2  GLN   9           2HG      GLN   9   1.636  -4.604   8.829
   75    HG3  GLN   9           3HG      GLN   9   2.713  -3.285   8.368
   76   HE21  GLN   9          1HE2      GLN   9   0.772  -4.644  10.920
   77   HE22  GLN   9          2HE2      GLN   9   1.394  -3.651  12.191
   78    H    VAL  10           H        VAL  10  -1.411  -4.001   5.165
   79    HA   VAL  10           HA       VAL  10  -2.420  -1.320   4.470
   80    HB   VAL  10           HB       VAL  10  -2.887  -4.053   3.184
   81   HG11  VAL  10          1HG1      VAL  10  -4.127  -2.872   1.392
   82   HG12  VAL  10          2HG1      VAL  10  -3.997  -1.361   2.295
   83   HG13  VAL  10          3HG1      VAL  10  -4.943  -2.699   2.949
   84   HG21  VAL  10          3HG2      VAL  10  -0.657  -3.133   2.748
   85   HG22  VAL  10          1HG2      VAL  10  -1.362  -1.596   2.235
   86   HG23  VAL  10          2HG2      VAL  10  -1.628  -3.051   1.276
   87    H    LYS  11           H        LYS  11  -3.944  -0.591   5.746
   88    HA   LYS  11           HA       LYS  11  -5.793  -2.437   7.145
   89    HB2  LYS  11           2HB      LYS  11  -4.218  -1.153   8.606
   90    HB3  LYS  11           3HB      LYS  11  -4.832   0.352   7.926
   91    HG2  LYS  11           2HG      LYS  11  -7.113  -0.273   8.820
   92    HG3  LYS  11           3HG      LYS  11  -6.354  -1.643   9.630
   93    HD2  LYS  11           2HD      LYS  11  -6.647   0.207  11.199
   94    HD3  LYS  11           3HD      LYS  11  -4.927  -0.079  10.925
   95    HE2  LYS  11           2HE      LYS  11  -4.781   1.854   9.467
   96    HE3  LYS  11           3HE      LYS  11  -6.533   2.066   9.494
   97    HZ1  LYS  11           3HZ      LYS  11  -4.723   2.372  11.827
   98    HZ2  LYS  11           1HZ      LYS  11  -6.400   2.569  11.848
   99    HZ3  LYS  11           2HZ      LYS  11  -5.439   3.629  10.953
  100    H    ILE  12           H        ILE  12  -7.689  -2.432   6.024
  101    HA   ILE  12           HA       ILE  12  -8.800   0.138   5.060
  102    HB   ILE  12           HB       ILE  12  -8.035  -1.111   3.120
  103   HG12  ILE  12          2HG1      ILE  12 -11.074  -1.318   3.287
  104   HG13  ILE  12          3HG1      ILE  12 -10.182   0.157   2.932
  105   HG21  ILE  12          1HG2      ILE  12  -8.847  -3.349   2.506
  106   HG22  ILE  12          2HG2      ILE  12  -9.763  -3.443   4.014
  107   HG23  ILE  12          3HG2      ILE  12  -7.998  -3.388   4.055
  108   HD11  ILE  12          3HD1      ILE  12 -11.077  -0.821   0.919
  109   HD12  ILE  12          1HD1      ILE  12 -10.233  -2.336   1.235
  110   HD13  ILE  12          2HD1      ILE  12  -9.316  -0.867   0.885
  111    H    THR  13           H        THR  13 -10.579   0.659   6.169
  112    HA   THR  13           HA       THR  13 -12.160  -1.415   7.520
  113    HB   THR  13           HB       THR  13 -12.223   1.612   7.802
  114    HG1  THR  13           HG1      THR  13 -10.367   0.352   8.629
  115   HG21  THR  13          3HG2      THR  13 -13.690  -0.503   9.447
  116   HG22  THR  13          1HG2      THR  13 -14.458   0.659   8.350
  117   HG23  THR  13          2HG2      THR  13 -13.643   1.221   9.807
  118    H    CYS  14           H        CYS  14 -14.000  -2.098   6.692
  119    HA   CYS  14           HA       CYS  14 -15.759  -0.495   5.001
  120    HB2  CYS  14           2HB      CYS  14 -14.139  -1.527   3.408
  121    HB3  CYS  14           3HB      CYS  14 -14.527  -3.121   4.040
  122    H    ASN  15           H        ASN  15 -17.881  -1.409   4.865
  123    HA   ASN  15           HA       ASN  15 -19.767  -2.403   5.584
  124    HB2  ASN  15           2HB      ASN  15 -18.812  -4.574   4.975
  125    HB3  ASN  15           3HB      ASN  15 -17.901  -4.647   6.480
  126   HD21  ASN  15          1HD2      ASN  15 -18.819  -6.586   7.157
  127   HD22  ASN  15          2HD2      ASN  15 -20.474  -6.739   7.629
  128    H    GLY  16           H        GLY  16 -17.685  -3.544   8.204
  129    HA2  GLY  16           2HA      GLY  16 -18.186  -1.322   9.964
  130    HA3  GLY  16           3HA      GLY  16 -19.072  -2.777  10.423
  131    H    LYS  17           H        LYS  17 -16.142  -3.405   8.805
  132    HA   LYS  17           HA       LYS  17 -14.789  -4.168  11.331
  133    HB2  LYS  17           2HB      LYS  17 -14.880  -5.726   8.703
  134    HB3  LYS  17           3HB      LYS  17 -13.959  -6.189  10.131
  135    HG2  LYS  17           2HG      LYS  17 -16.060  -6.498  11.389
  136    HG3  LYS  17           3HG      LYS  17 -16.987  -6.017   9.964
  137    HD2  LYS  17           2HD      LYS  17 -16.962  -8.466  10.184
  138    HD3  LYS  17           3HD      LYS  17 -16.101  -7.972   8.724
  139    HE2  LYS  17           2HE      LYS  17 -13.942  -8.264   9.923
  140    HE3  LYS  17           3HE      LYS  17 -14.825  -8.780  11.360
  141    HZ1  LYS  17           3HZ      LYS  17 -13.982 -10.653  10.096
  142    HZ2  LYS  17           1HZ      LYS  17 -14.858 -10.160   8.735
  143    HZ3  LYS  17           2HZ      LYS  17 -15.672 -10.663  10.129
  144    H    THR  18           H        THR  18 -12.505  -4.271  11.210
  145    HA   THR  18           HA       THR  18 -11.213  -2.569   9.169
  146    HB   THR  18           HB       THR  18 -10.323  -3.387  11.976
  147    HG1  THR  18           HG1      THR  18 -11.412  -1.042  10.827
  148   HG21  THR  18          3HG2      THR  18  -8.927  -1.514  10.027
  149   HG22  THR  18          1HG2      THR  18  -8.338  -3.117  10.514
  150   HG23  THR  18          2HG2      THR  18  -8.445  -1.814  11.696
  151    H    TYR  19           H        TYR  19 -10.268  -3.713   7.576
  152    HA   TYR  19           HA       TYR  19  -9.427  -6.523   7.984
  153    HB2  TYR  19           2HB      TYR  19  -9.882  -5.054   5.340
  154    HB3  TYR  19           3HB      TYR  19  -9.602  -6.779   5.551
  155    HD1  TYR  19           HD2      TYR  19 -12.082  -4.063   5.868
  156    HD2  TYR  19           HD1      TYR  19 -11.426  -8.263   6.341
  157    HE1  TYR  19           HE2      TYR  19 -14.488  -4.418   6.036
  158    HE2  TYR  19           HE1      TYR  19 -13.861  -8.610   6.516
  159    HH   TYR  19           HH       TYR  19 -16.143  -6.130   5.805
  160    H    GLU  20           H        GLU  20  -7.363  -6.406   8.689
  161    HA   GLU  20           HA       GLU  20  -5.366  -4.987   7.055
  162    HB2  GLU  20           2HB      GLU  20  -4.186  -4.364   9.250
  163    HB3  GLU  20           3HB      GLU  20  -5.629  -3.461   8.837
  164    HG2  GLU  20           2HG      GLU  20  -5.691  -3.861  11.185
  165    HG3  GLU  20           3HG      GLU  20  -6.930  -4.878  10.448
  166    H    ARG  21           H        ARG  21  -3.257  -5.803   7.199
  167    HA   ARG  21           HA       ARG  21  -2.625  -8.170   8.719
  168    HB2  ARG  21           2HB      ARG  21  -3.863  -9.075   6.679
  169    HB3  ARG  21           3HB      ARG  21  -2.596  -8.388   5.674
  170    HG2  ARG  21           2HG      ARG  21  -0.949  -9.848   7.000
  171    HG3  ARG  21           3HG      ARG  21  -2.368 -10.643   7.672
  172    HD2  ARG  21           2HD      ARG  21  -1.436 -10.601   4.803
  173    HD3  ARG  21           3HD      ARG  21  -1.643 -12.000   5.861
  174    HE   ARG  21           HE       ARG  21  -4.155 -10.933   5.685
  175   HH11  ARG  21          1HH1      ARG  21  -1.832 -12.090   3.306
  176   HH12  ARG  21          2HH1      ARG  21  -3.052 -12.539   2.164
  177   HH21  ARG  21          1HH2      ARG  21  -5.730 -11.472   4.139
  178   HH22  ARG  21          2HH2      ARG  21  -5.256 -12.190   2.634
  179    H    THR  22           H        THR  22  -0.408  -8.425   8.889
  180    HA   THR  22           HA       THR  22   1.330  -6.375   7.736
  181    HB   THR  22           HB       THR  22   1.988  -8.660   9.662
  182    HG1  THR  22           HG1      THR  22   0.403  -6.952  10.344
  183   HG21  THR  22          3HG2      THR  22   3.997  -7.747   8.519
  184   HG22  THR  22          1HG2      THR  22   3.985  -7.307  10.231
  185   HG23  THR  22          2HG2      THR  22   3.535  -6.116   9.011
  186    H    TYR  23           H        TYR  23   1.862  -6.795   5.648
  187    HA   TYR  23           HA       TYR  23   2.220  -9.545   4.646
  188    HB2  TYR  23           2HB      TYR  23   2.140  -6.878   3.136
  189    HB3  TYR  23           3HB      TYR  23   2.216  -8.467   2.389
  190    HD1  TYR  23           HD1      TYR  23   0.014  -6.126   4.265
  191    HD2  TYR  23           HD2      TYR  23   0.198  -9.812   2.116
  192    HE1  TYR  23           HE1      TYR  23  -2.433  -6.173   4.153
  193    HE2  TYR  23           HE2      TYR  23  -2.259  -9.861   2.013
  194    HH   TYR  23           HH       TYR  23  -4.199  -7.193   2.716
  195    H    GLN  24           H        GLN  24   4.241 -10.339   4.509
  196    HA   GLN  24           HA       GLN  24   6.570  -8.560   4.839
  197    HB2  GLN  24           2HB      GLN  24   6.387 -11.609   4.838
  198    HB3  GLN  24           3HB      GLN  24   7.889 -10.709   5.011
  199    HG2  GLN  24           2HG      GLN  24   7.234 -11.399   7.201
  200    HG3  GLN  24           3HG      GLN  24   6.946  -9.665   7.096
  201   HE21  GLN  24          1HE2      GLN  24   5.410  -9.618   8.743
  202   HE22  GLN  24          2HE2      GLN  24   3.844 -10.332   8.583
  203    H    LEU  25           H        LEU  25   7.273  -7.676   3.014
  204    HA   LEU  25           HA       LEU  25   7.151  -9.160   0.453
  205    HB2  LEU  25           2HB      LEU  25   7.011  -6.146   0.908
  206    HB3  LEU  25           3HB      LEU  25   6.943  -6.952  -0.654
  207    HG   LEU  25           HG       LEU  25   4.832  -7.070   1.543
  208   HD11  LEU  25          1HD1      LEU  25   3.385  -5.915  -0.048
  209   HD12  LEU  25          2HD1      LEU  25   4.704  -5.831  -1.219
  210   HD13  LEU  25          3HD1      LEU  25   4.823  -4.965   0.313
  211   HD21  LEU  25          3HD2      LEU  25   4.828  -8.493  -1.139
  212   HD22  LEU  25          1HD2      LEU  25   3.459  -8.388  -0.026
  213   HD23  LEU  25          2HD2      LEU  25   4.920  -9.243   0.457
  214    H    TYR  26           H        TYR  26   9.201 -10.017   0.435
  215    HA   TYR  26           HA       TYR  26  11.541  -8.253   0.667
  216    HB2  TYR  26           2HB      TYR  26  11.702 -10.514   1.710
  217    HB3  TYR  26           3HB      TYR  26  11.405 -11.267   0.146
  218    HD1  TYR  26           HD1      TYR  26  13.799  -9.061   1.977
  219    HD2  TYR  26           HD2      TYR  26  13.278 -11.674  -1.370
  220    HE1  TYR  26           HE1      TYR  26  16.190  -8.928   1.506
  221    HE2  TYR  26           HE2      TYR  26  15.697 -11.539  -1.832
  222    HH   TYR  26           HH       TYR  26  17.931 -10.264   0.385
  223    H    ALA  27           H        ALA  27  12.584  -7.491  -1.079
  224    HA   ALA  27           HA       ALA  27  12.066  -8.636  -3.766
  225    HB1  ALA  27           3HB      ALA  27  12.222  -5.676  -3.078
  226    HB2  ALA  27           1HB      ALA  27  10.769  -6.553  -3.566
  227    HB3  ALA  27           2HB      ALA  27  12.102  -6.351  -4.705
  228    H    VAL  28           H        VAL  28  13.800  -7.890  -5.324
  229    HA   VAL  28           HA       VAL  28  16.465  -7.880  -4.066
  230    HB   VAL  28           HB       VAL  28  15.793  -8.090  -7.044
  231   HG11  VAL  28          1HG1      VAL  28  18.080  -9.034  -7.261
  232   HG12  VAL  28          2HG1      VAL  28  18.353  -8.761  -5.538
  233   HG13  VAL  28          3HG1      VAL  28  18.111  -7.389  -6.621
  234   HG21  VAL  28          3HG2      VAL  28  16.287 -10.369  -5.084
  235   HG22  VAL  28          1HG2      VAL  28  16.102 -10.539  -6.832
  236   HG23  VAL  28          2HG2      VAL  28  14.746  -9.979  -5.850
  237    H    ARG  29           H        ARG  29  14.278  -5.893  -5.971
  238    HA   ARG  29           HA       ARG  29  16.039  -3.531  -5.663
  239    HB2  ARG  29           2HB      ARG  29  14.266  -3.869  -8.114
  240    HB3  ARG  29           3HB      ARG  29  15.634  -2.784  -7.893
  241    HG2  ARG  29           2HG      ARG  29  17.201  -4.621  -8.160
  242    HG3  ARG  29           3HG      ARG  29  15.890  -5.801  -8.135
  243    HD2  ARG  29           2HD      ARG  29  15.000  -4.546 -10.236
  244    HD3  ARG  29           3HD      ARG  29  16.620  -3.842 -10.324
  245    HE   ARG  29           HE       ARG  29  17.146  -6.483 -10.143
  246   HH11  ARG  29          1HH1      ARG  29  14.977  -4.698 -12.271
  247   HH12  ARG  29          2HH1      ARG  29  15.128  -5.842 -13.566
  248   HH21  ARG  29          1HH2      ARG  29  17.279  -7.990 -11.824
  249   HH22  ARG  29          2HH2      ARG  29  16.434  -7.714 -13.315
  250    H    ASP  30           H        ASP  30  14.730  -1.476  -5.947
  251    HA   ASP  30           HA       ASP  30  12.403  -1.375  -4.320
  252    HB2  ASP  30           2HB      ASP  30  12.328   1.024  -4.942
  253    HB3  ASP  30           3HB      ASP  30  13.964   0.532  -4.526
  254    H    GLU  31           H        GLU  31  12.900  -1.291  -7.818
  255    HA   GLU  31           HA       GLU  31  10.264  -0.720  -8.678
  256    HB2  GLU  31           2HB      GLU  31  11.082  -1.481 -10.910
  257    HB3  GLU  31           3HB      GLU  31  12.206  -0.374 -10.126
  258    HG2  GLU  31           2HG      GLU  31  13.587  -2.303  -9.406
  259    HG3  GLU  31           3HG      GLU  31  12.480  -3.396 -10.237
  260    H    GLU  32           H        GLU  32  11.713  -3.654  -7.541
  261    HA   GLU  32           HA       GLU  32   9.896  -5.507  -8.813
  262    HB2  GLU  32           2HB      GLU  32  11.772  -5.951  -6.449
  263    HB3  GLU  32           3HB      GLU  32  11.000  -7.206  -7.413
  264    HG2  GLU  32           2HG      GLU  32  13.078  -5.235  -8.402
  265    HG3  GLU  32           3HG      GLU  32  13.381  -6.915  -7.977
  266    H    LEU  33           H        LEU  33   9.959  -3.634  -5.884
  267    HA   LEU  33           HA       LEU  33   8.192  -5.212  -4.286
  268    HB2  LEU  33           2HB      LEU  33   9.961  -3.209  -3.731
  269    HB3  LEU  33           3HB      LEU  33   8.493  -2.264  -3.745
  270    HG   LEU  33           HG       LEU  33   9.094  -2.899  -1.454
  271   HD11  LEU  33          1HD1      LEU  33   6.700  -2.703  -1.893
  272   HD12  LEU  33          2HD1      LEU  33   7.036  -3.891  -0.638
  273   HD13  LEU  33          3HD1      LEU  33   6.614  -4.428  -2.267
  274   HD21  LEU  33          3HD2      LEU  33   8.882  -5.794  -2.327
  275   HD22  LEU  33          1HD2      LEU  33   9.139  -5.221  -0.674
  276   HD23  LEU  33          2HD2      LEU  33  10.364  -4.933  -1.906
  277    H    LYS  34           H        LYS  34   7.707  -2.907  -6.842
  278    HA   LYS  34           HA       LYS  34   5.278  -1.683  -6.169
  279    HB2  LYS  34           2HB      LYS  34   6.101  -2.436  -9.000
  280    HB3  LYS  34           3HB      LYS  34   4.980  -1.161  -8.527
  281    HG2  LYS  34           2HG      LYS  34   6.896   0.034  -7.450
  282    HG3  LYS  34           3HG      LYS  34   7.978  -1.210  -8.080
  283    HD2  LYS  34           2HD      LYS  34   6.334   0.801  -9.659
  284    HD3  LYS  34           3HD      LYS  34   8.086   0.690  -9.559
  285    HE2  LYS  34           2HE      LYS  34   7.618  -0.204 -11.680
  286    HE3  LYS  34           3HE      LYS  34   7.785  -1.648 -10.687
  287    HZ1  LYS  34           3HZ      LYS  34   5.416  -1.888 -10.621
  288    HZ2  LYS  34           1HZ      LYS  34   5.865  -1.680 -12.234
  289    HZ3  LYS  34           2HZ      LYS  34   5.169  -0.400 -11.373
  290    H    GLU  35           H        GLU  35   5.807  -4.588  -8.222
  291    HA   GLU  35           HA       GLU  35   3.111  -5.109  -8.766
  292    HB2  GLU  35           2HB      GLU  35   3.836  -7.277  -9.615
  293    HB3  GLU  35           3HB      GLU  35   4.945  -6.019 -10.119
  294    HG2  GLU  35           2HG      GLU  35   6.532  -7.542  -9.536
  295    HG3  GLU  35           3HG      GLU  35   6.275  -6.897  -7.919
  296    H    LYS  36           H        LYS  36   5.103  -5.988  -6.039
  297    HA   LYS  36           HA       LYS  36   3.453  -7.993  -4.877
  298    HB2  LYS  36           2HB      LYS  36   5.391  -6.122  -3.434
  299    HB3  LYS  36           3HB      LYS  36   4.815  -7.696  -2.866
  300    HG2  LYS  36           2HG      LYS  36   5.944  -8.790  -4.754
  301    HG3  LYS  36           3HG      LYS  36   6.516  -7.221  -5.326
  302    HD2  LYS  36           2HD      LYS  36   7.794  -6.978  -3.178
  303    HD3  LYS  36           3HD      LYS  36   7.287  -8.618  -2.741
  304    HE2  LYS  36           2HE      LYS  36   8.985  -7.807  -5.126
  305    HE3  LYS  36           3HE      LYS  36   9.509  -8.719  -3.711
  306    HZ1  LYS  36           3HZ      LYS  36   7.931 -10.479  -4.370
  307    HZ2  LYS  36           1HZ      LYS  36   9.142 -10.214  -5.519
  308    HZ3  LYS  36           2HZ      LYS  36   7.581  -9.619  -5.784
  309    H    LEU  37           H        LEU  37   3.753  -4.484  -4.370
  310    HA   LEU  37           HA       LEU  37   1.771  -4.111  -2.410
  311    HB2  LEU  37           2HB      LEU  37   2.704  -2.233  -4.608
  312    HB3  LEU  37           3HB      LEU  37   1.711  -1.738  -3.244
  313    HG   LEU  37           HG       LEU  37   4.514  -2.892  -2.954
  314   HD11  LEU  37          1HD1      LEU  37   4.639  -0.789  -4.183
  315   HD12  LEU  37          2HD1      LEU  37   5.293  -0.610  -2.557
  316   HD13  LEU  37          3HD1      LEU  37   3.688   0.022  -2.935
  317   HD21  LEU  37          3HD2      LEU  37   3.119  -3.172  -0.959
  318   HD22  LEU  37          1HD2      LEU  37   2.742  -1.446  -0.957
  319   HD23  LEU  37          2HD2      LEU  37   4.397  -1.996  -0.671
  320    H    LYS  38           H        LYS  38   1.550  -4.161  -5.991
  321    HA   LYS  38           HA       LYS  38  -1.186  -3.563  -6.271
  322    HB2  LYS  38           2HB      LYS  38   0.618  -5.270  -8.034
  323    HB3  LYS  38           3HB      LYS  38  -0.956  -4.634  -8.515
  324    HG2  LYS  38           2HG      LYS  38  -0.129  -2.352  -8.391
  325    HG3  LYS  38           3HG      LYS  38   1.414  -2.908  -7.735
  326    HD2  LYS  38           2HD      LYS  38   1.638  -2.368 -10.115
  327    HD3  LYS  38           3HD      LYS  38   1.899  -4.092  -9.845
  328    HE2  LYS  38           2HE      LYS  38  -0.405  -4.557 -10.628
  329    HE3  LYS  38           3HE      LYS  38  -0.667  -2.829 -10.879
  330    HZ1  LYS  38           3HZ      LYS  38   1.226  -2.902 -12.467
  331    HZ2  LYS  38           1HZ      LYS  38  -0.121  -3.802 -12.951
  332    HZ3  LYS  38           2HZ      LYS  38   1.235  -4.586 -12.321
  333    H    LYS  39           H        LYS  39   0.527  -6.696  -5.893
  334    HA   LYS  39           HA       LYS  39  -1.698  -8.411  -6.122
  335    HB2  LYS  39           2HB      LYS  39   0.809  -8.871  -4.433
  336    HB3  LYS  39           3HB      LYS  39  -0.347 -10.114  -4.905
  337    HG2  LYS  39           2HG      LYS  39   1.454  -8.548  -6.763
  338    HG3  LYS  39           3HG      LYS  39   1.682 -10.220  -6.271
  339    HD2  LYS  39           2HD      LYS  39  -0.290 -10.916  -7.506
  340    HD3  LYS  39           3HD      LYS  39  -0.746  -9.241  -7.833
  341    HE2  LYS  39           2HE      LYS  39   0.273 -10.323  -9.818
  342    HE3  LYS  39           3HE      LYS  39   1.231  -8.952  -9.261
  343    HZ1  LYS  39           3HZ      LYS  39   2.543 -10.925  -9.867
  344    HZ2  LYS  39           1HZ      LYS  39   1.834 -11.779  -8.597
  345    HZ3  LYS  39           2HZ      LYS  39   2.798 -10.429  -8.275
  346    H    VAL  40           H        VAL  40  -0.175  -6.944  -3.266
  347    HA   VAL  40           HA       VAL  40  -1.795  -7.906  -1.220
  348    HB   VAL  40           HB       VAL  40  -0.221  -5.302  -1.469
  349   HG11  VAL  40          1HG1      VAL  40  -1.564  -6.390   1.025
  350   HG12  VAL  40          2HG1      VAL  40  -1.962  -4.886   0.192
  351   HG13  VAL  40          3HG1      VAL  40  -0.402  -5.060   0.996
  352   HG21  VAL  40          3HG2      VAL  40   1.139  -7.366  -1.442
  353   HG22  VAL  40          1HG2      VAL  40   0.385  -7.852   0.075
  354   HG23  VAL  40          2HG2      VAL  40   1.410  -6.415   0.019
  355    H    LEU  41           H        LEU  41  -2.165  -4.903  -3.127
  356    HA   LEU  41           HA       LEU  41  -4.383  -3.925  -1.616
  357    HB2  LEU  41           2HB      LEU  41  -3.094  -3.039  -4.214
  358    HB3  LEU  41           3HB      LEU  41  -4.534  -2.243  -3.592
  359    HG   LEU  41           HG       LEU  41  -1.899  -2.440  -2.070
  360   HD11  LEU  41          1HD1      LEU  41  -1.577  -0.071  -2.560
  361   HD12  LEU  41          2HD1      LEU  41  -3.035  -0.058  -3.557
  362   HD13  LEU  41          3HD1      LEU  41  -1.637  -1.018  -4.045
  363   HD21  LEU  41          3HD2      LEU  41  -4.390  -0.815  -1.468
  364   HD22  LEU  41          1HD2      LEU  41  -2.884  -0.806  -0.548
  365   HD23  LEU  41          2HD2      LEU  41  -3.866  -2.266  -0.603
  366    H    ASN  42           H        ASN  42  -4.146  -5.316  -4.935
  367    HA   ASN  42           HA       ASN  42  -6.897  -5.360  -5.508
  368    HB2  ASN  42           2HB      ASN  42  -4.674  -7.194  -6.516
  369    HB3  ASN  42           3HB      ASN  42  -6.306  -7.188  -7.181
  370   HD21  ASN  42          1HD2      ASN  42  -3.740  -6.581  -8.467
  371   HD22  ASN  42          2HD2      ASN  42  -3.907  -5.000  -9.136
  372    H    GLU  43           H        GLU  43  -4.871  -7.735  -3.812
  373    HA   GLU  43           HA       GLU  43  -6.736  -9.845  -3.586
  374    HB2  GLU  43           2HB      GLU  43  -4.387 -10.255  -3.183
  375    HB3  GLU  43           3HB      GLU  43  -4.331  -9.063  -1.899
  376    HG2  GLU  43           2HG      GLU  43  -4.233 -11.333  -1.002
  377    HG3  GLU  43           3HG      GLU  43  -5.686 -10.497  -0.457
  378    H    ARG  44           H        ARG  44  -5.843  -7.270  -1.268
  379    HA   ARG  44           HA       ARG  44  -7.658  -8.152   0.749
  380    HB2  ARG  44           2HB      ARG  44  -5.517  -6.955   1.261
  381    HB3  ARG  44           3HB      ARG  44  -6.181  -5.495   0.544
  382    HG2  ARG  44           2HG      ARG  44  -6.311  -5.310   2.953
  383    HG3  ARG  44           3HG      ARG  44  -7.944  -5.446   2.311
  384    HD2  ARG  44           2HD      ARG  44  -6.377  -7.740   3.551
  385    HD3  ARG  44           3HD      ARG  44  -7.558  -6.757   4.415
  386    HE   ARG  44           HE       ARG  44  -9.060  -7.650   2.402
  387   HH11  ARG  44          1HH1      ARG  44  -6.891  -9.455   4.513
  388   HH12  ARG  44          2HH1      ARG  44  -7.788 -10.932   4.358
  389   HH21  ARG  44          1HH2      ARG  44 -10.151  -9.636   2.150
  390   HH22  ARG  44          2HH2      ARG  44  -9.617 -11.032   3.026
  391    H    MET  45           H        MET  45  -7.839  -5.778  -1.857
  392    HA   MET  45           HA       MET  45 -10.336  -4.631  -0.865
  393    HB2  MET  45           2HB      MET  45  -8.644  -3.915  -3.279
  394    HB3  MET  45           3HB      MET  45 -10.166  -3.130  -2.891
  395    HG2  MET  45           2HG      MET  45  -9.094  -2.572  -0.614
  396    HG3  MET  45           3HG      MET  45  -7.566  -3.021  -1.369
  397    HE1  MET  45           3HE      MET  45 -10.614  -0.496  -1.407
  398    HE2  MET  45           1HE      MET  45 -10.703  -1.185  -3.033
  399    HE3  MET  45           2HE      MET  45 -10.216   0.494  -2.810
  400    H    ASP  46           H        ASP  46  -9.554  -7.310  -2.715
  401    HA   ASP  46           HA       ASP  46 -11.508  -7.265  -4.738
  402    HB2  ASP  46           2HB      ASP  46  -9.572  -8.854  -4.669
  403    HB3  ASP  46           3HB      ASP  46 -10.367  -9.738  -3.372
  404    HA   PRO  47           HA       PRO  47 -14.691  -9.353  -1.660
  405    HB2  PRO  47           2HB      PRO  47 -14.199  -9.346   1.031
  406    HB3  PRO  47           3HB      PRO  47 -13.617 -10.652  -0.028
  407    HG2  PRO  47           2HG      PRO  47 -12.108  -8.240   0.968
  408    HG3  PRO  47           3HG      PRO  47 -11.610  -9.951   0.974
  409    HD2  PRO  47           2HD      PRO  47 -10.762  -8.259  -0.950
  410    HD3  PRO  47           3HD      PRO  47 -11.114  -9.960  -1.307
  411    H    ILE  48           H        ILE  48 -12.886  -6.459  -0.901
  412    HA   ILE  48           HA       ILE  48 -14.836  -5.078   0.698
  413    HB   ILE  48           HB       ILE  48 -12.517  -3.967  -0.941
  414   HG12  ILE  48          2HG1      ILE  48 -11.713  -5.572   0.730
  415   HG13  ILE  48          3HG1      ILE  48 -11.235  -3.949   1.191
  416   HG21  ILE  48          1HG2      ILE  48 -14.119  -2.189  -0.424
  417   HG22  ILE  48          2HG2      ILE  48 -12.626  -1.961   0.485
  418   HG23  ILE  48          3HG2      ILE  48 -14.058  -2.603   1.291
  419   HD11  ILE  48          3HD1      ILE  48 -13.033  -3.921   2.862
  420   HD12  ILE  48          1HD1      ILE  48 -11.891  -5.241   3.103
  421   HD13  ILE  48          2HD1      ILE  48 -13.472  -5.567   2.396
  422    H    LYS  49           H        LYS  49 -14.148  -5.365  -2.734
  423    HA   LYS  49           HA       LYS  49 -15.879  -3.402  -3.791
  424    HB2  LYS  49           2HB      LYS  49 -14.945  -6.055  -4.958
  425    HB3  LYS  49           3HB      LYS  49 -15.770  -4.803  -5.885
  426    HG2  LYS  49           2HG      LYS  49 -13.920  -3.297  -5.696
  427    HG3  LYS  49           3HG      LYS  49 -13.156  -4.279  -4.442
  428    HD2  LYS  49           2HD      LYS  49 -12.819  -6.095  -6.108
  429    HD3  LYS  49           3HD      LYS  49 -13.518  -5.058  -7.353
  430    HE2  LYS  49           2HE      LYS  49 -11.019  -4.361  -5.773
  431    HE3  LYS  49           3HE      LYS  49 -11.003  -5.145  -7.353
  432    HZ1  LYS  49           3HZ      LYS  49 -12.092  -2.451  -6.743
  433    HZ2  LYS  49           1HZ      LYS  49 -12.181  -3.209  -8.253
  434    HZ3  LYS  49           2HZ      LYS  49 -10.681  -2.798  -7.598
  435    H    LYS  50           H        LYS  50 -16.371  -6.775  -2.825
  436    HA   LYS  50           HA       LYS  50 -19.087  -6.992  -3.747
  437    HB2  LYS  50           2HB      LYS  50 -17.242  -8.859  -3.243
  438    HB3  LYS  50           3HB      LYS  50 -17.915  -8.818  -1.626
  439    HG2  LYS  50           2HG      LYS  50 -19.503  -9.420  -4.148
  440    HG3  LYS  50           3HG      LYS  50 -18.810 -10.648  -3.096
  441    HD2  LYS  50           2HD      LYS  50 -21.018  -8.675  -2.365
  442    HD3  LYS  50           3HD      LYS  50 -21.212 -10.401  -2.675
  443    HE2  LYS  50           2HE      LYS  50 -19.803 -10.899  -0.690
  444    HE3  LYS  50           3HE      LYS  50 -19.653  -9.168  -0.377
  445    HZ1  LYS  50           3HZ      LYS  50 -21.358 -10.188   0.991
  446    HZ2  LYS  50           1HZ      LYS  50 -22.192 -10.704  -0.386
  447    HZ3  LYS  50           2HZ      LYS  50 -22.037  -9.052  -0.060
  448    H    LEU  51           H        LEU  51 -17.513  -5.949  -0.790
  449    HA   LEU  51           HA       LEU  51 -19.823  -5.952   0.923
  450    HB2  LEU  51           2HB      LEU  51 -17.211  -4.394   1.076
  451    HB3  LEU  51           3HB      LEU  51 -18.439  -4.356   2.334
  452    HG   LEU  51           HG       LEU  51 -16.886  -6.832   1.473
  453   HD11  LEU  51          1HD1      LEU  51 -15.464  -5.219   2.639
  454   HD12  LEU  51          2HD1      LEU  51 -15.734  -6.657   3.618
  455   HD13  LEU  51          3HD1      LEU  51 -16.603  -5.164   3.988
  456   HD21  LEU  51          3HD2      LEU  51 -17.903  -7.922   3.425
  457   HD22  LEU  51          1HD2      LEU  51 -19.125  -7.421   2.258
  458   HD23  LEU  51          2HD2      LEU  51 -18.881  -6.485   3.736
  459    H    GLY  52           H        GLY  52 -18.342  -3.674  -1.307
  460    HA2  GLY  52           2HA      GLY  52 -19.240  -1.971  -2.517
  461    HA3  GLY  52           3HA      GLY  52 -20.822  -2.416  -1.895
  462    H    CYS  53           H        CYS  53 -17.878  -1.304  -0.242
  463    HA   CYS  53           HA       CYS  53 -19.289   0.720   1.227
  464    HB2  CYS  53           2HB      CYS  53 -16.338   0.057   0.993
  465    HB3  CYS  53           3HB      CYS  53 -16.957   1.373   1.995
  466    H    LYS  54           H        LYS  54 -19.834   2.622   0.476
  467    HA   LYS  54           HA       LYS  54 -19.191   3.751  -2.003
  468    HB2  LYS  54           2HB      LYS  54 -20.292   5.817  -1.092
  469    HB3  LYS  54           3HB      LYS  54 -21.237   4.348  -0.879
  470    HG2  LYS  54           2HG      LYS  54 -20.573   4.233   1.488
  471    HG3  LYS  54           3HG      LYS  54 -19.565   5.668   1.291
  472    HD2  LYS  54           2HD      LYS  54 -21.710   6.213   2.377
  473    HD3  LYS  54           3HD      LYS  54 -21.550   7.031   0.823
  474    HE2  LYS  54           2HE      LYS  54 -23.832   6.141   1.177
  475    HE3  LYS  54           3HE      LYS  54 -23.061   5.394  -0.220
  476    HZ1  LYS  54           3HZ      LYS  54 -23.295   4.182   2.484
  477    HZ2  LYS  54           1HZ      LYS  54 -22.571   3.454   1.142
  478    HZ3  LYS  54           2HZ      LYS  54 -24.230   3.771   1.137
  479    H    ARG  55           H        ARG  55 -17.522   3.927   1.023
  480    HA   ARG  55           HA       ARG  55 -15.210   5.095  -0.220
  481    HB2  ARG  55           2HB      ARG  55 -16.467   7.148   0.409
  482    HB3  ARG  55           3HB      ARG  55 -16.561   6.591   2.076
  483    HG2  ARG  55           2HG      ARG  55 -14.055   6.703   2.200
  484    HG3  ARG  55           3HG      ARG  55 -14.040   7.376   0.567
  485    HD2  ARG  55           2HD      ARG  55 -13.852   9.136   2.292
  486    HD3  ARG  55           3HD      ARG  55 -15.320   9.316   1.331
  487    HE   ARG  55           HE       ARG  55 -16.550   8.281   3.210
  488   HH11  ARG  55          1HH1      ARG  55 -13.431   9.743   3.921
  489   HH12  ARG  55          2HH1      ARG  55 -13.806  10.019   5.592
  490   HH21  ARG  55          1HH2      ARG  55 -17.033   8.674   5.404
  491   HH22  ARG  55          2HH2      ARG  55 -15.843   9.414   6.430
  492    H    VAL  56           H        VAL  56 -13.385   4.425   0.796
  493    HA   VAL  56           HA       VAL  56 -13.526   3.103   3.441
  494    HB   VAL  56           HB       VAL  56 -11.803   1.441   2.642
  495   HG11  VAL  56          1HG1      VAL  56 -13.343  -0.045   1.435
  496   HG12  VAL  56          2HG1      VAL  56 -14.431   1.313   1.133
  497   HG13  VAL  56          3HG1      VAL  56 -14.147   0.758   2.785
  498   HG21  VAL  56          3HG2      VAL  56 -10.917   2.681   0.700
  499   HG22  VAL  56          1HG2      VAL  56 -12.455   2.481  -0.147
  500   HG23  VAL  56          2HG2      VAL  56 -11.457   1.072   0.224
  501    H    ARG  57           H        ARG  57 -11.692   3.339   4.728
  502    HA   ARG  57           HA       ARG  57  -9.601   5.225   3.838
  503    HB2  ARG  57           2HB      ARG  57 -10.646   5.837   5.974
  504    HB3  ARG  57           3HB      ARG  57 -10.344   4.229   6.631
  505    HG2  ARG  57           2HG      ARG  57  -7.930   4.616   6.590
  506    HG3  ARG  57           3HG      ARG  57  -8.160   6.170   5.793
  507    HD2  ARG  57           2HD      ARG  57  -9.295   7.031   7.810
  508    HD3  ARG  57           3HD      ARG  57  -9.068   5.470   8.604
  509    HE   ARG  57           HE       ARG  57  -6.584   5.919   8.195
  510   HH11  ARG  57          1HH1      ARG  57  -8.873   8.511   8.867
  511   HH12  ARG  57          2HH1      ARG  57  -7.671   9.555   9.555
  512   HH21  ARG  57          1HH2      ARG  57  -5.022   7.297   9.073
  513   HH22  ARG  57          2HH2      ARG  57  -5.480   8.861   9.670
  514    H    ILE  58           H        ILE  58  -7.866   4.249   2.980
  515    HA   ILE  58           HA       ILE  58  -6.991   1.577   3.946
  516    HB   ILE  58           HB       ILE  58  -6.092   2.996   1.388
  517   HG12  ILE  58          2HG1      ILE  58  -8.312   0.905   1.553
  518   HG13  ILE  58          3HG1      ILE  58  -8.599   2.632   1.375
  519   HG21  ILE  58          1HG2      ILE  58  -5.398   0.731   0.667
  520   HG22  ILE  58          2HG2      ILE  58  -5.963   0.068   2.202
  521   HG23  ILE  58          3HG2      ILE  58  -4.608   1.198   2.175
  522   HD11  ILE  58          3HD1      ILE  58  -8.796   1.491  -0.743
  523   HD12  ILE  58          1HD1      ILE  58  -7.151   0.871  -0.605
  524   HD13  ILE  58          2HD1      ILE  58  -7.434   2.608  -0.772
  525    H    SER  59           H        SER  59  -5.570   2.072   5.655
  526    HA   SER  59           HA       SER  59  -3.514   4.152   5.258
  527    HB2  SER  59           2HB      SER  59  -4.450   2.748   7.800
  528    HB3  SER  59           3HB      SER  59  -3.198   3.991   7.723
  529    HG   SER  59           HG       SER  59  -4.812   5.402   6.860
  530    H    ILE  60           H        ILE  60  -1.838   3.279   4.246
  531    HA   ILE  60           HA       ILE  60  -0.985   0.493   4.692
  532    HB   ILE  60           HB       ILE  60  -0.131   2.499   2.561
  533   HG12  ILE  60          2HG1      ILE  60  -2.085   0.175   2.264
  534   HG13  ILE  60          3HG1      ILE  60  -2.554   1.866   2.397
  535   HG21  ILE  60          1HG2      ILE  60   0.826   0.553   1.361
  536   HG22  ILE  60          2HG2      ILE  60   0.414  -0.481   2.730
  537   HG23  ILE  60          3HG2      ILE  60   1.599   0.812   2.927
  538   HD11  ILE  60          3HD1      ILE  60  -2.640   1.134   0.104
  539   HD12  ILE  60          1HD1      ILE  60  -0.949   0.639   0.153
  540   HD13  ILE  60          2HD1      ILE  60  -1.376   2.348   0.294
  541    H    ARG  61           H        ARG  61   0.526   0.304   6.290
  542    HA   ARG  61           HA       ARG  61   2.476   2.415   6.845
  543    HB2  ARG  61           2HB      ARG  61   1.933  -0.244   8.259
  544    HB3  ARG  61           3HB      ARG  61   3.180   0.895   8.740
  545    HG2  ARG  61           2HG      ARG  61   1.389   1.231  10.246
  546    HG3  ARG  61           3HG      ARG  61   1.340   2.598   9.135
  547    HD2  ARG  61           2HD      ARG  61  -0.562   1.660   7.960
  548    HD3  ARG  61           3HD      ARG  61  -0.433   0.138   8.850
  549    HE   ARG  61           HE       ARG  61  -1.459   2.702   9.853
  550   HH11  ARG  61          1HH1      ARG  61  -0.743  -0.671  10.548
  551   HH12  ARG  61          2HH1      ARG  61  -1.697  -0.703  11.990
  552   HH21  ARG  61          1HH2      ARG  61  -2.676   2.651  11.766
  553   HH22  ARG  61          2HH2      ARG  61  -2.797   1.180  12.683
  554    H    VAL  62           H        VAL  62   4.543   2.270   6.150
  555    HA   VAL  62           HA       VAL  62   5.552  -0.254   4.969
  556    HB   VAL  62           HB       VAL  62   6.276   2.674   4.500
  557   HG11  VAL  62          1HG1      VAL  62   7.812   0.313   3.357
  558   HG12  VAL  62          2HG1      VAL  62   8.415   1.380   4.621
  559   HG13  VAL  62          3HG1      VAL  62   8.096   2.019   3.009
  560   HG21  VAL  62          3HG2      VAL  62   4.352   1.722   3.245
  561   HG22  VAL  62          1HG2      VAL  62   5.421   0.464   2.600
  562   HG23  VAL  62          2HG2      VAL  62   5.685   2.162   2.170
  563    H    LYS  63           H        LYS  63   6.714  -1.410   6.411
  564    HA   LYS  63           HA       LYS  63   7.748  -0.193   8.833
  565    HB2  LYS  63           2HB      LYS  63   6.562  -2.504   8.627
  566    HB3  LYS  63           3HB      LYS  63   8.069  -3.104   7.971
  567    HG2  LYS  63           2HG      LYS  63   7.862  -1.815  10.713
  568    HG3  LYS  63           3HG      LYS  63   7.615  -3.537  10.448
  569    HD2  LYS  63           2HD      LYS  63  10.193  -2.009   9.882
  570    HD3  LYS  63           3HD      LYS  63   9.892  -3.034  11.285
  571    HE2  LYS  63           2HE      LYS  63   9.578  -4.974   9.699
  572    HE3  LYS  63           3HE      LYS  63  10.100  -3.913   8.385
  573    HZ1  LYS  63           3HZ      LYS  63  11.952  -5.193   9.187
  574    HZ2  LYS  63           1HZ      LYS  63  11.687  -4.685  10.779
  575    HZ3  LYS  63           2HZ      LYS  63  12.194  -3.575   9.613
  576    H    HIS  64           H        HIS  64   9.523   0.934   8.489
  577    HA   HIS  64           HA       HIS  64  11.373   0.578   6.366
  578    HB2  HIS  64           2HB      HIS  64  11.380   2.280   8.888
  579    HB3  HIS  64           3HB      HIS  64  12.617   2.402   7.637
  580    HD1  HIS  64           HD1      HIS  64  11.133   4.900   8.152
  581    HD2  HIS  64           HD2      HIS  64   9.724   2.070   5.473
  582    HE1  HIS  64           HE1      HIS  64   9.686   6.158   6.537
  583    HE2  HIS  64           HE2      HIS  64   9.093   4.456   4.784
  584    H    SER  65           H        SER  65  12.762  -1.072   6.290
  585    HA   SER  65           HA       SER  65  13.360  -2.814   8.406
  586    HB2  SER  65           2HB      SER  65  13.399  -3.534   6.063
  587    HB3  SER  65           3HB      SER  65  14.759  -2.464   5.715
  588    HG   SER  65           HG       SER  65  16.086  -3.843   6.633
  589    H    ASP  66           H        ASP  66  15.539  -0.509   6.751
  590    HA   ASP  66           HA       ASP  66  17.451  -0.658   9.014
  591    HB2  ASP  66           2HB      ASP  66  17.886   0.231   6.125
  592    HB3  ASP  66           3HB      ASP  66  19.129   0.188   7.374
  593    H    ALA  67           H        ALA  67  18.232   1.211   9.958
  594    HA   ALA  67           HA       ALA  67  16.404   3.410  10.115
  595    HB1  ALA  67           3HB      ALA  67  17.904   4.259  11.872
  596    HB2  ALA  67           1HB      ALA  67  19.116   3.048  11.441
  597    HB3  ALA  67           2HB      ALA  67  17.560   2.545  12.107
  598    H    ALA  68           H        ALA  68  19.769   3.078   8.944
  599    HA   ALA  68           HA       ALA  68  20.126   5.806   8.220
  600    HB1  ALA  68           3HB      ALA  68  22.152   5.028   7.052
  601    HB2  ALA  68           1HB      ALA  68  21.614   3.352   7.223
  602    HB3  ALA  68           2HB      ALA  68  22.021   4.301   8.654
  603    H    GLU  69           H        GLU  69  18.753   3.059   6.546
  604    HA   GLU  69           HA       GLU  69  18.973   4.206   3.905
  605    HB2  GLU  69           2HB      GLU  69  17.466   1.733   4.835
  606    HB3  GLU  69           3HB      GLU  69  17.752   2.184   3.155
  607    HG2  GLU  69           2HG      GLU  69  19.836   1.395   5.211
  608    HG3  GLU  69           3HG      GLU  69  19.315   0.452   3.813
  609    H    GLU  70           H        GLU  70  16.514   4.138   6.407
  610    HA   GLU  70           HA       GLU  70  14.248   4.150   4.720
  611    HB2  GLU  70           2HB      GLU  70  12.933   4.519   6.691
  612    HB3  GLU  70           3HB      GLU  70  14.195   3.339   7.015
  613    HG2  GLU  70           2HG      GLU  70  15.495   5.050   8.211
  614    HG3  GLU  70           3HG      GLU  70  14.248   6.250   7.866
  615    H    LYS  71           H        LYS  71  16.270   6.770   5.625
  616    HA   LYS  71           HA       LYS  71  14.381   8.905   5.345
  617    HB2  LYS  71           2HB      LYS  71  17.428   8.873   5.155
  618    HB3  LYS  71           3HB      LYS  71  16.473  10.345   5.027
  619    HG2  LYS  71           2HG      LYS  71  17.274  10.279   7.266
  620    HG3  LYS  71           3HG      LYS  71  15.565   9.851   7.354
  621    HD2  LYS  71           2HD      LYS  71  16.281   7.412   7.428
  622    HD3  LYS  71           3HD      LYS  71  17.951   7.966   7.555
  623    HE2  LYS  71           2HE      LYS  71  17.113   7.422   9.769
  624    HE3  LYS  71           3HE      LYS  71  17.341   9.167   9.666
  625    HZ1  LYS  71           3HZ      LYS  71  15.254   8.596  10.743
  626    HZ2  LYS  71           1HZ      LYS  71  14.746   7.742   9.375
  627    HZ3  LYS  71           2HZ      LYS  71  14.961   9.415   9.295
  628    H    LYS  72           H        LYS  72  16.766   7.370   3.226
  629    HA   LYS  72           HA       LYS  72  16.083   8.730   0.811
  630    HB2  LYS  72           2HB      LYS  72  18.291   7.641   1.157
  631    HB3  LYS  72           3HB      LYS  72  17.509   6.075   1.312
  632    HG2  LYS  72           2HG      LYS  72  18.493   6.180  -0.876
  633    HG3  LYS  72           3HG      LYS  72  16.743   6.280  -1.084
  634    HD2  LYS  72           2HD      LYS  72  17.782   7.892  -2.567
  635    HD3  LYS  72           3HD      LYS  72  16.965   8.783  -1.280
  636    HE2  LYS  72           2HE      LYS  72  19.181   8.999  -0.105
  637    HE3  LYS  72           3HE      LYS  72  19.949   8.219  -1.489
  638    HZ1  LYS  72           3HZ      LYS  72  18.395  10.744  -1.620
  639    HZ2  LYS  72           1HZ      LYS  72  19.264  10.026  -2.883
  640    HZ3  LYS  72           2HZ      LYS  72  20.081  10.652  -1.543
  641    H    GLU  73           H        GLU  73  15.147   5.692   2.329
  642    HA   GLU  73           HA       GLU  73  13.966   4.450   0.104
  643    HB2  GLU  73           2HB      GLU  73  14.823   3.148   1.973
  644    HB3  GLU  73           3HB      GLU  73  13.676   3.886   3.071
  645    HG2  GLU  73           2HG      GLU  73  12.407   2.483   0.788
  646    HG3  GLU  73           3HG      GLU  73  13.357   1.429   1.827
  647    H    ALA  74           H        ALA  74  12.443   6.111   2.918
  648    HA   ALA  74           HA       ALA  74   9.771   5.648   2.276
  649    HB1  ALA  74           3HB      ALA  74  10.541   6.508   4.455
  650    HB2  ALA  74           1HB      ALA  74   9.235   7.493   3.790
  651    HB3  ALA  74           2HB      ALA  74  10.907   8.065   3.712
  652    H    LYS  75           H        LYS  75  11.727   8.517   1.551
  653    HA   LYS  75           HA       LYS  75   9.954  10.033   0.054
  654    HB2  LYS  75           2HB      LYS  75  12.105  10.879   0.866
  655    HB3  LYS  75           3HB      LYS  75  12.975   9.796  -0.213
  656    HG2  LYS  75           2HG      LYS  75  12.198  11.021  -2.171
  657    HG3  LYS  75           3HG      LYS  75  11.142  12.027  -1.177
  658    HD2  LYS  75           2HD      LYS  75  14.185  11.976  -0.982
  659    HD3  LYS  75           3HD      LYS  75  13.253  13.189  -1.865
  660    HE2  LYS  75           2HE      LYS  75  12.204  13.947   0.217
  661    HE3  LYS  75           3HE      LYS  75  13.010  12.667   1.123
  662    HZ1  LYS  75           3HZ      LYS  75  15.130  13.675   0.608
  663    HZ2  LYS  75           1HZ      LYS  75  14.121  14.786   1.385
  664    HZ3  LYS  75           2HZ      LYS  75  14.376  14.898  -0.281
  665    H    LYS  76           H        LYS  76  12.214   7.520  -1.092
  666    HA   LYS  76           HA       LYS  76  11.492   7.831  -3.882
  667    HB2  LYS  76           2HB      LYS  76  13.794   7.245  -3.123
  668    HB3  LYS  76           3HB      LYS  76  13.186   5.714  -2.499
  669    HG2  LYS  76           2HG      LYS  76  12.580   5.013  -4.776
  670    HG3  LYS  76           3HG      LYS  76  13.145   6.562  -5.414
  671    HD2  LYS  76           2HD      LYS  76  15.437   6.056  -4.784
  672    HD3  LYS  76           3HD      LYS  76  14.929   4.604  -3.920
  673    HE2  LYS  76           2HE      LYS  76  14.140   3.656  -6.102
  674    HE3  LYS  76           3HE      LYS  76  14.818   5.068  -6.913
  675    HZ1  LYS  76           3HZ      LYS  76  16.332   3.077  -5.317
  676    HZ2  LYS  76           1HZ      LYS  76  16.996   4.448  -6.047
  677    HZ3  LYS  76           2HZ      LYS  76  16.338   3.222  -6.999
  678    H    PHE  77           H        PHE  77  10.363   5.943  -1.222
  679    HA   PHE  77           HA       PHE  77   9.104   3.836  -2.762
  680    HB2  PHE  77           2HB      PHE  77  10.055   3.655  -0.308
  681    HB3  PHE  77           3HB      PHE  77   8.526   4.370   0.181
  682    HD1  PHE  77           HD2      PHE  77   6.404   3.067  -0.085
  683    HD2  PHE  77           HD1      PHE  77  10.183   1.356  -1.142
  684    HE1  PHE  77           HE2      PHE  77   5.384   0.836  -0.157
  685    HE2  PHE  77           HE1      PHE  77   9.140  -0.874  -1.210
  686    HZ   PHE  77           HZ       PHE  77   6.741  -1.129  -0.720
  687    H    ALA  78           H        ALA  78   8.317   6.960  -1.474
  688    HA   ALA  78           HA       ALA  78   5.514   7.000  -1.740
  689    HB1  ALA  78           3HB      ALA  78   7.490   9.246  -2.298
  690    HB2  ALA  78           1HB      ALA  78   6.790   8.851  -0.727
  691    HB3  ALA  78           2HB      ALA  78   5.756   9.446  -2.026
  692    H    ALA  79           H        ALA  79   8.112   7.304  -4.116
  693    HA   ALA  79           HA       ALA  79   6.470   7.788  -6.410
  694    HB1  ALA  79           3HB      ALA  79   8.813   8.506  -6.315
  695    HB2  ALA  79           1HB      ALA  79   8.544   7.422  -7.684
  696    HB3  ALA  79           2HB      ALA  79   9.340   6.824  -6.224
  697    H    ILE  80           H        ILE  80   7.910   4.894  -4.912
  698    HA   ILE  80           HA       ILE  80   7.224   2.957  -6.855
  699    HB   ILE  80           HB       ILE  80   7.696   2.740  -3.848
  700   HG12  ILE  80          2HG1      ILE  80   9.680   3.369  -5.166
  701   HG13  ILE  80          3HG1      ILE  80   9.882   1.749  -4.512
  702   HG21  ILE  80          1HG2      ILE  80   7.369   0.383  -5.736
  703   HG22  ILE  80          2HG2      ILE  80   6.254   0.844  -4.450
  704   HG23  ILE  80          3HG2      ILE  80   7.880   0.294  -4.048
  705   HD11  ILE  80          3HD1      ILE  80  10.710   1.903  -6.781
  706   HD12  ILE  80          1HD1      ILE  80   9.131   2.429  -7.360
  707   HD13  ILE  80          2HD1      ILE  80   9.338   0.799  -6.709
  708    H    LEU  81           H        LEU  81   5.487   4.155  -4.010
  709    HA   LEU  81           HA       LEU  81   3.149   2.570  -4.244
  710    HB2  LEU  81           2HB      LEU  81   3.775   5.178  -2.822
  711    HB3  LEU  81           3HB      LEU  81   2.179   4.446  -2.738
  712    HG   LEU  81           HG       LEU  81   4.678   2.949  -1.867
  713   HD11  LEU  81          1HD1      LEU  81   4.567   4.965  -0.516
  714   HD12  LEU  81          2HD1      LEU  81   4.147   3.552   0.453
  715   HD13  LEU  81          3HD1      LEU  81   2.878   4.640  -0.120
  716   HD21  LEU  81          3HD2      LEU  81   3.083   1.565  -0.598
  717   HD22  LEU  81          1HD2      LEU  81   2.727   1.539  -2.324
  718   HD23  LEU  81          2HD2      LEU  81   1.737   2.516  -1.234
  719    H    ASN  82           H        ASN  82   4.106   5.755  -5.466
  720    HA   ASN  82           HA       ASN  82   1.615   6.612  -6.496
  721    HB2  ASN  82           2HB      ASN  82   3.373   8.233  -6.134
  722    HB3  ASN  82           3HB      ASN  82   4.476   7.367  -7.197
  723   HD21  ASN  82          1HD2      ASN  82   1.480   9.231  -7.135
  724   HD22  ASN  82          2HD2      ASN  82   1.624   9.845  -8.742
  725    H    LYS  83           H        LYS  83   4.231   4.664  -7.907
  726    HA   LYS  83           HA       LYS  83   3.207   4.331 -10.510
  727    HB2  LYS  83           2HB      LYS  83   4.887   2.481  -8.780
  728    HB3  LYS  83           3HB      LYS  83   4.460   2.080 -10.439
  729    HG2  LYS  83           2HG      LYS  83   6.120   4.454  -9.538
  730    HG3  LYS  83           3HG      LYS  83   6.720   2.978 -10.305
  731    HD2  LYS  83           2HD      LYS  83   5.267   3.561 -12.321
  732    HD3  LYS  83           3HD      LYS  83   4.952   5.122 -11.551
  733    HE2  LYS  83           2HE      LYS  83   7.634   4.038 -12.476
  734    HE3  LYS  83           3HE      LYS  83   6.742   5.395 -13.159
  735    HZ1  LYS  83           3HZ      LYS  83   8.540   6.164 -11.778
  736    HZ2  LYS  83           1HZ      LYS  83   7.961   5.292 -10.452
  737    HZ3  LYS  83           2HZ      LYS  83   7.068   6.586 -11.066
  738    H    VAL  84           H        VAL  84   2.680   2.466  -7.527
  739    HA   VAL  84           HA       VAL  84   1.205   0.316  -8.636
  740    HB   VAL  84           HB       VAL  84   1.389   1.417  -5.792
  741   HG11  VAL  84          1HG1      VAL  84   0.152  -1.219  -6.661
  742   HG12  VAL  84          2HG1      VAL  84  -0.697   0.138  -5.926
  743   HG13  VAL  84          3HG1      VAL  84   0.497  -0.764  -4.993
  744   HG21  VAL  84          3HG2      VAL  84   2.950  -0.450  -5.421
  745   HG22  VAL  84          1HG2      VAL  84   3.508   0.587  -6.735
  746   HG23  VAL  84          2HG2      VAL  84   2.749  -0.964  -7.095
  747    H    PHE  85           H        PHE  85   0.229   3.268  -6.957
  748    HA   PHE  85           HA       PHE  85  -2.556   2.886  -6.964
  749    HB2  PHE  85           2HB      PHE  85  -1.006   5.516  -6.903
  750    HB3  PHE  85           3HB      PHE  85  -2.717   5.344  -6.517
  751    HD1  PHE  85           HD1      PHE  85  -2.329   2.624  -4.944
  752    HD2  PHE  85           HD2      PHE  85  -0.393   6.444  -4.734
  753    HE1  PHE  85           HE1      PHE  85  -1.734   2.205  -2.594
  754    HE2  PHE  85           HE2      PHE  85   0.193   6.006  -2.388
  755    HZ   PHE  85           HZ       PHE  85  -0.468   3.892  -1.319
  756    H    ALA  86           H        ALA  86  -0.372   4.315  -9.389
  757    HA   ALA  86           HA       ALA  86  -2.464   5.151 -11.199
  758    HB1  ALA  86           3HB      ALA  86   0.500   4.731 -11.702
  759    HB2  ALA  86           1HB      ALA  86  -0.265   6.246 -11.214
  760    HB3  ALA  86           2HB      ALA  86  -0.626   5.545 -12.793
  761    H    GLU  87           H        GLU  87  -0.650   2.191 -10.675
  762    HA   GLU  87           HA       GLU  87  -1.384   0.942 -13.195
  763    HB2  GLU  87           2HB      GLU  87  -0.043  -0.155 -10.680
  764    HB3  GLU  87           3HB      GLU  87  -0.343  -1.124 -12.121
  765    HG2  GLU  87           2HG      GLU  87   1.125   0.348 -13.438
  766    HG3  GLU  87           3HG      GLU  87   1.404   1.362 -12.029
  767    H    LEU  88           H        LEU  88  -2.942   1.517 -10.230
  768    HA   LEU  88           HA       LEU  88  -4.896  -0.682 -10.614
  769    HB2  LEU  88           2HB      LEU  88  -4.399   0.975  -8.107
  770    HB3  LEU  88           3HB      LEU  88  -5.541  -0.352  -8.266
  771    HG   LEU  88           HG       LEU  88  -2.508  -0.538  -8.278
  772   HD11  LEU  88          1HD1      LEU  88  -3.480  -0.299  -6.068
  773   HD12  LEU  88          2HD1      LEU  88  -2.789  -1.904  -6.282
  774   HD13  LEU  88          3HD1      LEU  88  -4.541  -1.681  -6.355
  775   HD21  LEU  88          3HD2      LEU  88  -3.297  -2.109  -9.941
  776   HD22  LEU  88          1HD2      LEU  88  -4.481  -2.778  -8.811
  777   HD23  LEU  88          2HD2      LEU  88  -2.752  -2.979  -8.512
  778    H    GLY  89           H        GLY  89  -4.433   2.783 -10.528
  779    HA2  GLY  89           2HA      GLY  89  -5.950   4.031 -11.985
  780    HA3  GLY  89           3HA      GLY  89  -7.298   3.223 -11.213
  781    H    TYR  90           H        TYR  90  -5.570   3.722  -8.584
  782    HA   TYR  90           HA       TYR  90  -7.144   5.828  -7.582
  783    HB2  TYR  90           2HB      TYR  90  -4.478   4.875  -6.454
  784    HB3  TYR  90           3HB      TYR  90  -5.728   5.742  -5.574
  785    HD1  TYR  90           HD2      TYR  90  -8.179   4.476  -5.842
  786    HD2  TYR  90           HD1      TYR  90  -4.336   2.586  -5.933
  787    HE1  TYR  90           HE2      TYR  90  -9.207   2.336  -5.205
  788    HE2  TYR  90           HE1      TYR  90  -5.372   0.455  -5.297
  789    HH   TYR  90           HH       TYR  90  -7.417  -0.341  -4.171
  790    H    ASN  91           H        ASN  91  -6.798   7.980  -7.274
  791    HA   ASN  91           HA       ASN  91  -4.779   9.240  -9.017
  792    HB2  ASN  91           2HB      ASN  91  -7.465  10.240  -7.961
  793    HB3  ASN  91           3HB      ASN  91  -6.355  11.232  -8.905
  794   HD21  ASN  91          1HD2      ASN  91  -8.600   8.568  -9.007
  795   HD22  ASN  91          2HD2      ASN  91  -8.670   8.444 -10.726
  796    H    ASP  92           H        ASP  92  -4.075  11.440  -8.370
  797    HA   ASP  92           HA       ASP  92  -2.487  11.460  -6.093
  798    HB2  ASP  92           2HB      ASP  92  -3.502  13.817  -7.749
  799    HB3  ASP  92           3HB      ASP  92  -2.180  13.915  -6.589
  800    H    SER  93           H        SER  93  -5.660  12.892  -6.602
  801    HA   SER  93           HA       SER  93  -5.974  14.410  -4.280
  802    HB2  SER  93           2HB      SER  93  -8.444  14.175  -4.795
  803    HB3  SER  93           3HB      SER  93  -7.464  14.674  -6.177
  804    HG   SER  93           HG       SER  93  -8.874  12.330  -5.755
  805    H    ASN  94           H        ASN  94  -6.282  10.971  -4.803
  806    HA   ASN  94           HA       ASN  94  -7.617  10.388  -2.291
  807    HB2  ASN  94           2HB      ASN  94  -6.387   8.568  -4.414
  808    HB3  ASN  94           3HB      ASN  94  -7.330   8.002  -3.035
  809   HD21  ASN  94          1HD2      ASN  94  -9.445   9.777  -2.967
  810   HD22  ASN  94          2HD2      ASN  94 -10.366   9.625  -4.418
  811    H    VAL  95           H        VAL  95  -4.308  10.640  -3.426
  812    HA   VAL  95           HA       VAL  95  -3.189   8.871  -1.378
  813    HB   VAL  95           HB       VAL  95  -1.726  10.681  -3.363
  814   HG11  VAL  95          1HG1      VAL  95  -0.681   8.303  -1.775
  815   HG12  VAL  95          2HG1      VAL  95  -0.309   9.998  -1.454
  816   HG13  VAL  95          3HG1      VAL  95   0.241   9.244  -2.952
  817   HG21  VAL  95          3HG2      VAL  95  -3.125   9.079  -4.594
  818   HG22  VAL  95          1HG2      VAL  95  -2.432   7.739  -3.673
  819   HG23  VAL  95          2HG2      VAL  95  -1.418   8.672  -4.775
  820    H    THR  96           H        THR  96  -3.353   9.750   0.649
  821    HA   THR  96           HA       THR  96  -2.108  12.403   1.151
  822    HB   THR  96           HB       THR  96  -4.673  11.315   2.403
  823    HG1  THR  96           HG1      THR  96  -4.272  12.751   0.223
  824   HG21  THR  96          3HG2      THR  96  -4.767  13.470   3.656
  825   HG22  THR  96          1HG2      THR  96  -3.159  13.874   3.062
  826   HG23  THR  96          2HG2      THR  96  -3.378  12.490   4.140
  827    H    TRP  97           H        TRP  97  -0.304  12.001   2.280
  828    HA   TRP  97           HA       TRP  97   0.095   9.655   3.910
  829    HB2  TRP  97           2HB      TRP  97   1.808  12.114   3.371
  830    HB3  TRP  97           3HB      TRP  97   2.323  10.800   4.422
  831    HD1  TRP  97           HD1      TRP  97   1.335  11.339   0.693
  832    HE1  TRP  97           HE1      TRP  97   2.629   9.628  -0.722
  833    HE3  TRP  97           HE3      TRP  97   3.589   8.697   4.463
  834    HZ2  TRP  97           HZ2      TRP  97   4.362   7.446  -0.306
  835    HZ3  TRP  97           HZ3      TRP  97   5.050   6.805   3.864
  836    HH2  TRP  97           HH2      TRP  97   5.429   6.191   1.523
  837    H    ASP  98           H        ASP  98  -0.789   9.495   5.852
  838    HA   ASP  98           HA       ASP  98  -0.917  11.793   7.724
  839    HB2  ASP  98           2HB      ASP  98  -3.179  11.175   6.954
  840    HB3  ASP  98           3HB      ASP  98  -2.880   9.481   7.309
  841    H    GLY  99           H        GLY  99   0.852  11.405   9.005
  842    HA2  GLY  99           2HA      GLY  99   1.887  10.604  10.887
  843    HA3  GLY  99           3HA      GLY  99   0.630   9.384  11.020
  844    H    ASP 100           H        ASP 100   3.269  10.102   8.689
  845    HA   ASP 100           HA       ASP 100   4.893   8.876   7.685
  846    HB2  ASP 100           2HB      ASP 100   4.818   7.262  10.274
  847    HB3  ASP 100           3HB      ASP 100   6.091   7.137   9.065
  848    H    THR 101           H        THR 101   2.123   8.160   7.291
  849    HA   THR 101           HA       THR 101   2.263   5.390   6.284
  850    HB   THR 101           HB       THR 101   0.163   6.549   8.179
  851    HG1  THR 101           HG1      THR 101   2.309   5.224   8.713
  852   HG21  THR 101          3HG2      THR 101   0.001   3.878   6.750
  853   HG22  THR 101          1HG2      THR 101  -1.028   5.280   6.420
  854   HG23  THR 101          2HG2      THR 101  -1.111   4.467   7.983
  855    H    VAL 102           H        VAL 102   0.990   5.152   4.343
  856    HA   VAL 102           HA       VAL 102   0.009   7.705   3.218
  857    HB   VAL 102           HB       VAL 102   1.641   6.638   1.777
  858   HG11  VAL 102          1HG1      VAL 102   1.464   4.309   2.498
  859   HG12  VAL 102          2HG1      VAL 102   1.339   4.431   0.741
  860   HG13  VAL 102          3HG1      VAL 102  -0.112   4.165   1.711
  861   HG21  VAL 102          3HG2      VAL 102  -0.185   7.836   0.662
  862   HG22  VAL 102          1HG2      VAL 102  -1.142   6.354   0.586
  863   HG23  VAL 102          2HG2      VAL 102   0.359   6.485  -0.338
  864    H    THR 103           H        THR 103  -2.046   8.048   3.636
  865    HA   THR 103           HA       THR 103  -3.969   5.857   3.913
  866    HB   THR 103           HB       THR 103  -4.164   8.772   4.782
  867    HG1  THR 103           HG1      THR 103  -3.294   8.068   6.567
  868   HG21  THR 103          3HG2      THR 103  -6.399   7.849   4.245
  869   HG22  THR 103          1HG2      THR 103  -6.212   8.087   5.982
  870   HG23  THR 103          2HG2      THR 103  -6.086   6.465   5.296
  871    H    VAL 104           H        VAL 104  -4.864   5.390   2.039
  872    HA   VAL 104           HA       VAL 104  -5.375   7.344  -0.060
  873    HB   VAL 104           HB       VAL 104  -5.689   4.298  -0.100
  874   HG11  VAL 104          1HG1      VAL 104  -5.593   6.270  -2.420
  875   HG12  VAL 104          2HG1      VAL 104  -7.023   5.400  -1.859
  876   HG13  VAL 104          3HG1      VAL 104  -5.673   4.511  -2.567
  877   HG21  VAL 104          3HG2      VAL 104  -3.343   4.912   0.343
  878   HG22  VAL 104          1HG2      VAL 104  -3.336   5.960  -1.079
  879   HG23  VAL 104          2HG2      VAL 104  -3.517   4.214  -1.269
  880    H    GLU 105           H        GLU 105  -7.399   8.109  -0.417
  881    HA   GLU 105           HA       GLU 105  -9.770   7.041   0.899
  882    HB2  GLU 105           2HB      GLU 105  -9.520   9.486   0.635
  883    HB3  GLU 105           3HB      GLU 105  -9.326   9.307  -1.105
  884    HG2  GLU 105           2HG      GLU 105 -11.720   8.361  -1.131
  885    HG3  GLU 105           3HG      GLU 105 -11.855   8.924   0.536
  886    H    GLY 106           H        GLY 106 -10.702   5.225  -0.017
  887    HA2  GLY 106           2HA      GLY 106 -10.406   4.783  -2.947
  888    HA3  GLY 106           3HA      GLY 106 -10.597   3.531  -1.730
  889    H    GLN 107           H        GLN 107 -12.181   4.767  -4.190
  890    HA   GLN 107           HA       GLN 107 -14.692   3.669  -3.096
  891    HB2  GLN 107           2HB      GLN 107 -15.034   6.130  -3.466
  892    HB3  GLN 107           3HB      GLN 107 -14.535   5.940  -5.144
  893    HG2  GLN 107           2HG      GLN 107 -16.470   4.402  -5.516
  894    HG3  GLN 107           3HG      GLN 107 -16.989   4.683  -3.857
  895   HE21  GLN 107          1HE2      GLN 107 -17.870   6.739  -3.314
  896   HE22  GLN 107          2HE2      GLN 107 -18.441   7.823  -4.528
  897    H    LEU 108           H        LEU 108 -14.695   1.725  -3.985
  898    HA   LEU 108           HA       LEU 108 -13.134   1.137  -6.359
  899    HB2  LEU 108           2HB      LEU 108 -13.902  -1.311  -5.807
  900    HB3  LEU 108           3HB      LEU 108 -12.705  -0.534  -4.806
  901    HG   LEU 108           HG       LEU 108 -14.436  -1.984  -3.616
  902   HD11  LEU 108          1HD1      LEU 108 -14.620  -0.572  -1.650
  903   HD12  LEU 108          2HD1      LEU 108 -14.151   0.840  -2.597
  904   HD13  LEU 108          3HD1      LEU 108 -13.015  -0.490  -2.372
  905   HD21  LEU 108          3HD2      LEU 108 -16.465  -1.292  -4.783
  906   HD22  LEU 108          1HD2      LEU 108 -16.327   0.333  -4.105
  907   HD23  LEU 108          2HD2      LEU 108 -16.622  -1.049  -3.044
  908    H    GLU 109           H        GLU 109 -13.959  -0.269  -8.042
  909    HA   GLU 109           HA       GLU 109 -16.529   0.582  -9.088
  910    HB2  GLU 109           2HB      GLU 109 -15.914  -0.668 -11.100
  911    HB3  GLU 109           3HB      GLU 109 -14.581   0.360 -10.601
  912    HG2  GLU 109           2HG      GLU 109 -14.444  -2.430  -9.566
  913    HG3  GLU 109           3HG      GLU 109 -14.350  -2.296 -11.318
  914    H    GLY 110           H        GLY 110 -17.432  -1.684 -10.414
  915    HA2  GLY 110           2HA      GLY 110 -18.259  -3.870 -10.188
  916    HA3  GLY 110           3HA      GLY 110 -17.889  -3.835  -8.468
  917    H    VAL 111           H        VAL 111 -19.207  -2.403  -7.113
  918    HA   VAL 111           HA       VAL 111 -21.999  -2.771  -7.503
  919    HB   VAL 111           HB       VAL 111 -20.554  -0.965  -5.497
  920   HG11  VAL 111          1HG1      VAL 111 -22.945  -0.342  -5.691
  921   HG12  VAL 111          2HG1      VAL 111 -22.592  -1.059  -4.118
  922   HG13  VAL 111          3HG1      VAL 111 -23.410  -2.014  -5.357
  923   HG21  VAL 111          3HG2      VAL 111 -21.510  -3.835  -5.196
  924   HG22  VAL 111          1HG2      VAL 111 -20.835  -2.843  -3.903
  925   HG23  VAL 111          2HG2      VAL 111 -19.833  -3.293  -5.280
  926    H    ASP 112           H        ASP 112 -19.818  -0.059  -7.980
  927    HA   ASP 112           HA       ASP 112 -21.982   1.585  -9.152
  928    HB2  ASP 112           2HB      ASP 112 -21.340   2.360  -6.850
  929    HB3  ASP 112           3HB      ASP 112 -19.681   2.566  -7.395
  930    H    LEU 113           H        LEU 113 -21.266   0.560 -11.116
  931    HA   LEU 113           HA       LEU 113 -18.645   1.013 -12.215
  932    HB2  LEU 113           2HB      LEU 113 -21.243   0.090 -13.508
  933    HB3  LEU 113           3HB      LEU 113 -19.717   0.204 -14.374
  934    HG   LEU 113           HG       LEU 113 -20.248  -1.639 -12.007
  935   HD11  LEU 113          1HD1      LEU 113 -20.166  -3.463 -13.640
  936   HD12  LEU 113          2HD1      LEU 113 -20.006  -2.298 -14.958
  937   HD13  LEU 113          3HD1      LEU 113 -21.484  -2.347 -13.992
  938   HD21  LEU 113          3HD2      LEU 113 -18.066  -2.644 -12.540
  939   HD22  LEU 113          1HD2      LEU 113 -17.894  -0.948 -12.093
  940   HD23  LEU 113          2HD2      LEU 113 -17.795  -1.427 -13.791
  941    H    GLU 114           H        GLU 114 -17.931   2.718 -13.286
  942    HA   GLU 114           HA       GLU 114 -17.707   4.558 -14.517
  943    HB2  GLU 114           2HB      GLU 114 -20.440   3.771 -15.576
  944    HB3  GLU 114           3HB      GLU 114 -19.493   5.098 -16.245
  945    HG2  GLU 114           2HG      GLU 114 -17.663   3.504 -16.777
  946    HG3  GLU 114           3HG      GLU 114 -18.649   2.178 -16.162
  947    H    HIS 115           H        HIS 115 -18.731   4.833 -11.809
  948    HA   HIS 115           HA       HIS 115 -19.929   7.464 -11.798
  949    HB2  HIS 115           2HB      HIS 115 -19.714   5.937  -9.753
  950    HB3  HIS 115           3HB      HIS 115 -17.992   6.293  -9.740
  951    HD1  HIS 115           HD1      HIS 115 -19.213   7.008  -7.239
  952    HD2  HIS 115           HD2      HIS 115 -19.483   9.636 -10.442
  953    HE1  HIS 115           HE1      HIS 115 -19.654   9.270  -6.233
  954    HE2  HIS 115           HE2      HIS 115 -20.021  10.783  -8.202
  955    H    HIS 116           H        HIS 116 -16.600   6.183 -11.527
  956    HA   HIS 116           HA       HIS 116 -15.380   8.461 -12.830
  957    HB2  HIS 116           2HB      HIS 116 -14.141   6.893 -11.262
  958    HB3  HIS 116           3HB      HIS 116 -14.287   5.625 -12.468
  959    HD1  HIS 116           HD1      HIS 116 -12.558   5.592 -14.317
  960    HD2  HIS 116           HD2      HIS 116 -12.411   9.077 -12.057
  961    HE1  HIS 116           HE1      HIS 116 -10.464   6.772 -15.029
  962    HE2  HIS 116           HE2      HIS 116 -10.354   8.815 -13.575
  963    H    HIS 117           H        HIS 117 -16.535   8.787 -14.705
  964    HA   HIS 117           HA       HIS 117 -17.775   6.605 -16.135
  965    HB2  HIS 117           2HB      HIS 117 -18.888   8.806 -15.512
  966    HB3  HIS 117           3HB      HIS 117 -17.913   9.587 -16.748
  967    HD1  HIS 117           HD1      HIS 117 -19.401  10.093 -18.659
  968    HD2  HIS 117           HD2      HIS 117 -20.323   6.400 -16.984
  969    HE1  HIS 117           HE1      HIS 117 -21.257   9.159 -20.062
  970    HE2  HIS 117           HE2      HIS 117 -21.843   6.962 -18.985
  971    H    HIS 118           H        HIS 118 -14.734   7.442 -16.395
  972    HA   HIS 118           HA       HIS 118 -14.573   6.511 -19.175
  973    HB2  HIS 118           2HB      HIS 118 -13.099   8.944 -18.068
  974    HB3  HIS 118           3HB      HIS 118 -12.532   8.070 -19.485
  975    HD1  HIS 118           HD1      HIS 118 -14.681  10.812 -18.533
  976    HD2  HIS 118           HD2      HIS 118 -14.574   8.058 -21.642
  977    HE1  HIS 118           HE1      HIS 118 -16.135  11.771 -20.338
  978    HE2  HIS 118           HE2      HIS 118 -16.174  10.015 -22.139
  979    H    HIS 119           H        HIS 119 -12.078   6.037 -19.575
  980    HA   HIS 119           HA       HIS 119 -11.351   4.001 -17.623
  981    HB2  HIS 119           2HB      HIS 119 -10.021   4.760 -20.266
  982    HB3  HIS 119           3HB      HIS 119  -9.676   3.319 -19.318
  983    HD1  HIS 119           HD1      HIS 119 -10.729   1.304 -20.291
  984    HD2  HIS 119           HD2      HIS 119 -12.975   4.712 -21.074
  985    HE1  HIS 119           HE1      HIS 119 -12.650   0.544 -21.709
  986    HE2  HIS 119           HE2      HIS 119 -14.065   2.589 -22.036
  987    H    HIS 120           H        HIS 120  -9.038   3.783 -16.978
  988    HA   HIS 120           HA       HIS 120  -7.900   6.292 -16.043
  989    HB2  HIS 120           2HB      HIS 120  -7.892   4.356 -14.510
  990    HB3  HIS 120           3HB      HIS 120  -6.962   3.405 -15.666
  991    HD1  HIS 120           HD1      HIS 120  -6.614   6.341 -13.305
  992    HD2  HIS 120           HD2      HIS 120  -4.217   3.852 -15.615
  993    HE1  HIS 120           HE1      HIS 120  -4.248   6.858 -12.641
  994    HE2  HIS 120           HE2      HIS 120  -2.837   5.262 -13.964
  Start of MODEL   18
    1    H1   MET   1           1H       MET   1  25.104  -7.909  -3.012
    2    H2   MET   1           2H       MET   1  24.811  -6.817  -1.760
    3    H3   MET   1           3H       MET   1  24.329  -6.440  -3.334
    4    HA   MET   1           HA       MET   1  22.758  -8.215  -3.348
    5    HB2  MET   1           2HB      MET   1  24.041  -9.707  -1.786
    6    HB3  MET   1           3HB      MET   1  23.581  -8.672  -0.442
    7    HG2  MET   1           2HG      MET   1  21.223  -9.257  -0.768
    8    HG3  MET   1           3HG      MET   1  21.637 -10.232  -2.178
    9    HE1  MET   1           3HE      MET   1  23.025 -12.548  -2.019
   10    HE2  MET   1           1HE      MET   1  23.634 -13.209  -0.500
   11    HE3  MET   1           2HE      MET   1  24.334 -11.733  -1.161
   12    H    SER   2           H        SER   2  22.034  -5.997  -3.716
   13    HA   SER   2           HA       SER   2  20.737  -4.580  -1.540
   14    HB2  SER   2           2HB      SER   2  21.709  -3.369  -3.522
   15    HB3  SER   2           3HB      SER   2  20.521  -4.150  -4.564
   16    HG   SER   2           HG       SER   2  19.980  -2.407  -2.386
   17    H    GLY   3           H        GLY   3  19.049  -5.608  -0.688
   18    HA2  GLY   3           2HA      GLY   3  16.654  -6.244  -2.032
   19    HA3  GLY   3           3HA      GLY   3  17.590  -7.724  -1.804
   20    H    LYS   4           H        LYS   4  15.841  -5.162  -0.216
   21    HA   LYS   4           HA       LYS   4  16.276  -6.304   2.466
   22    HB2  LYS   4           2HB      LYS   4  16.532  -3.825   2.104
   23    HB3  LYS   4           3HB      LYS   4  14.848  -3.739   1.625
   24    HG2  LYS   4           2HG      LYS   4  14.715  -3.013   3.816
   25    HG3  LYS   4           3HG      LYS   4  14.382  -4.727   4.031
   26    HD2  LYS   4           2HD      LYS   4  17.152  -3.510   4.404
   27    HD3  LYS   4           3HD      LYS   4  15.978  -3.632   5.709
   28    HE2  LYS   4           2HE      LYS   4  15.969  -6.115   5.405
   29    HE3  LYS   4           3HE      LYS   4  17.246  -5.940   4.198
   30    HZ1  LYS   4           3HZ      LYS   4  18.144  -6.491   6.379
   31    HZ2  LYS   4           1HZ      LYS   4  17.431  -5.114   7.051
   32    HZ3  LYS   4           2HZ      LYS   4  18.662  -4.954   5.907
   33    H    LYS   5           H        LYS   5  14.615  -7.317   3.596
   34    HA   LYS   5           HA       LYS   5  11.998  -7.644   2.375
   35    HB2  LYS   5           2HB      LYS   5  12.939  -9.507   3.707
   36    HB3  LYS   5           3HB      LYS   5  13.012  -8.470   5.133
   37    HG2  LYS   5           2HG      LYS   5  10.502  -8.246   5.031
   38    HG3  LYS   5           3HG      LYS   5  10.495  -9.387   3.685
   39    HD2  LYS   5           2HD      LYS   5   9.916 -10.497   5.780
   40    HD3  LYS   5           3HD      LYS   5  11.433 -11.129   5.138
   41    HE2  LYS   5           2HE      LYS   5  11.519 -10.816   7.594
   42    HE3  LYS   5           3HE      LYS   5  12.698  -9.787   6.780
   43    HZ1  LYS   5           3HZ      LYS   5  11.575  -8.545   8.473
   44    HZ2  LYS   5           1HZ      LYS   5  10.058  -8.961   7.854
   45    HZ3  LYS   5           2HZ      LYS   5  11.082  -7.948   6.971
   46    H    VAL   6           H        VAL   6  10.662  -5.957   2.436
   47    HA   VAL   6           HA       VAL   6  10.455  -4.256   4.853
   48    HB   VAL   6           HB       VAL   6   9.564  -2.541   3.570
   49   HG11  VAL   6          1HG1      VAL   6  10.715  -2.322   1.404
   50   HG12  VAL   6          2HG1      VAL   6  11.104  -4.047   1.438
   51   HG13  VAL   6          3HG1      VAL   6  11.786  -2.969   2.658
   52   HG21  VAL   6          3HG2      VAL   6   7.555  -3.670   2.795
   53   HG22  VAL   6          1HG2      VAL   6   8.459  -4.524   1.541
   54   HG23  VAL   6          2HG2      VAL   6   8.274  -2.766   1.455
   55    H    GLU   7           H        GLU   7   8.361  -4.129   5.861
   56    HA   GLU   7           HA       GLU   7   6.428  -6.236   5.059
   57    HB2  GLU   7           2HB      GLU   7   6.964  -5.217   7.876
   58    HB3  GLU   7           3HB      GLU   7   5.824  -6.480   7.423
   59    HG2  GLU   7           2HG      GLU   7   7.593  -7.963   6.755
   60    HG3  GLU   7           3HG      GLU   7   8.800  -6.686   6.878
   61    H    VAL   8           H        VAL   8   4.700  -5.457   4.253
   62    HA   VAL   8           HA       VAL   8   3.898  -2.647   4.551
   63    HB   VAL   8           HB       VAL   8   3.239  -4.785   2.466
   64   HG11  VAL   8          1HG1      VAL   8   2.025  -3.059   1.183
   65   HG12  VAL   8          2HG1      VAL   8   2.242  -1.918   2.511
   66   HG13  VAL   8          3HG1      VAL   8   1.250  -3.357   2.742
   67   HG21  VAL   8          3HG2      VAL   8   4.837  -2.204   2.238
   68   HG22  VAL   8          1HG2      VAL   8   4.507  -3.330   0.916
   69   HG23  VAL   8          2HG2      VAL   8   5.508  -3.837   2.279
   70    H    GLN   9           H        GLN   9   2.349  -2.265   5.994
   71    HA   GLN   9           HA       GLN   9   0.481  -4.351   6.903
   72    HB2  GLN   9           2HB      GLN   9   1.123  -1.615   8.119
   73    HB3  GLN   9           3HB      GLN   9   0.074  -2.837   8.836
   74    HG2  GLN   9           2HG      GLN   9   2.007  -4.343   9.105
   75    HG3  GLN   9           3HG      GLN   9   3.059  -3.139   8.357
   76   HE21  GLN   9          1HE2      GLN   9   3.195  -4.329  11.047
   77   HE22  GLN   9          2HE2      GLN   9   3.156  -2.996  12.149
   78    H    VAL  10           H        VAL  10  -1.277  -4.320   5.546
   79    HA   VAL  10           HA       VAL  10  -2.318  -1.755   4.514
   80    HB   VAL  10           HB       VAL  10  -3.036  -4.622   3.718
   81   HG11  VAL  10          1HG1      VAL  10  -4.930  -3.090   3.311
   82   HG12  VAL  10          2HG1      VAL  10  -4.216  -3.618   1.787
   83   HG13  VAL  10          3HG1      VAL  10  -3.872  -2.001   2.408
   84   HG21  VAL  10          3HG2      VAL  10  -1.749  -4.139   1.650
   85   HG22  VAL  10          1HG2      VAL  10  -0.733  -4.052   3.091
   86   HG23  VAL  10          2HG2      VAL  10  -1.287  -2.569   2.308
   87    H    LYS  11           H        LYS  11  -3.749  -0.807   5.807
   88    HA   LYS  11           HA       LYS  11  -5.681  -2.403   7.403
   89    HB2  LYS  11           2HB      LYS  11  -4.032  -1.100   8.733
   90    HB3  LYS  11           3HB      LYS  11  -4.496   0.374   7.892
   91    HG2  LYS  11           2HG      LYS  11  -6.775   0.192   8.886
   92    HG3  LYS  11           3HG      LYS  11  -6.259  -1.255   9.758
   93    HD2  LYS  11           2HD      LYS  11  -5.099   1.544  10.095
   94    HD3  LYS  11           3HD      LYS  11  -6.202   0.741  11.216
   95    HE2  LYS  11           2HE      LYS  11  -4.498  -0.979  11.680
   96    HE3  LYS  11           3HE      LYS  11  -3.396  -0.221  10.526
   97    HZ1  LYS  11           3HZ      LYS  11  -4.418   1.027  13.021
   98    HZ2  LYS  11           1HZ      LYS  11  -3.369   1.756  11.913
   99    HZ3  LYS  11           2HZ      LYS  11  -2.867   0.399  12.789
  100    H    ILE  12           H        ILE  12  -7.505  -2.433   6.127
  101    HA   ILE  12           HA       ILE  12  -8.460   0.113   4.924
  102    HB   ILE  12           HB       ILE  12  -7.844  -1.338   3.105
  103   HG12  ILE  12          2HG1      ILE  12 -10.884  -1.440   3.404
  104   HG13  ILE  12          3HG1      ILE  12  -9.965  -0.060   2.820
  105   HG21  ILE  12          1HG2      ILE  12  -8.703  -3.617   2.756
  106   HG22  ILE  12          2HG2      ILE  12  -9.539  -3.547   4.309
  107   HG23  ILE  12          3HG2      ILE  12  -7.776  -3.500   4.256
  108   HD11  ILE  12          3HD1      ILE  12 -11.005  -1.224   0.989
  109   HD12  ILE  12          1HD1      ILE  12 -10.226  -2.740   1.446
  110   HD13  ILE  12          2HD1      ILE  12  -9.255  -1.381   0.868
  111    H    THR  13           H        THR  13 -10.209   0.893   5.916
  112    HA   THR  13           HA       THR  13 -12.004  -0.860   7.432
  113    HB   THR  13           HB       THR  13 -12.004   2.184   7.196
  114    HG1  THR  13           HG1      THR  13 -10.162   1.396   8.290
  115   HG21  THR  13          3HG2      THR  13 -13.495   0.378   9.149
  116   HG22  THR  13          1HG2      THR  13 -14.239   1.291   7.830
  117   HG23  THR  13          2HG2      THR  13 -13.484   2.142   9.177
  118    H    CYS  14           H        CYS  14 -13.519  -1.820   6.258
  119    HA   CYS  14           HA       CYS  14 -14.911  -0.450   4.020
  120    HB2  CYS  14           2HB      CYS  14 -13.617  -2.501   3.421
  121    HB3  CYS  14           3HB      CYS  14 -14.556  -3.426   4.576
  122    H    ASN  15           H        ASN  15 -16.961   0.046   4.410
  123    HA   ASN  15           HA       ASN  15 -19.019   0.276   5.271
  124    HB2  ASN  15           2HB      ASN  15 -19.361  -2.140   4.921
  125    HB3  ASN  15           3HB      ASN  15 -18.571  -2.499   6.455
  126   HD21  ASN  15          1HD2      ASN  15 -20.366  -3.569   7.277
  127   HD22  ASN  15          2HD2      ASN  15 -21.819  -2.756   7.740
  128    H    GLY  16           H        GLY  16 -17.683  -1.556   8.004
  129    HA2  GLY  16           2HA      GLY  16 -16.956   0.817   9.523
  130    HA3  GLY  16           3HA      GLY  16 -18.364  -0.052  10.137
  131    H    LYS  17           H        LYS  17 -16.030  -1.951   8.516
  132    HA   LYS  17           HA       LYS  17 -14.933  -3.006  11.064
  133    HB2  LYS  17           2HB      LYS  17 -15.529  -4.464   8.442
  134    HB3  LYS  17           3HB      LYS  17 -14.744  -5.199   9.829
  135    HG2  LYS  17           2HG      LYS  17 -17.566  -4.082   9.958
  136    HG3  LYS  17           3HG      LYS  17 -17.216  -5.727   9.444
  137    HD2  LYS  17           2HD      LYS  17 -17.745  -6.006  11.709
  138    HD3  LYS  17           3HD      LYS  17 -15.984  -5.972  11.734
  139    HE2  LYS  17           2HE      LYS  17 -16.092  -3.565  12.422
  140    HE3  LYS  17           3HE      LYS  17 -17.852  -3.686  12.455
  141    HZ1  LYS  17           3HZ      LYS  17 -17.637  -5.407  14.163
  142    HZ2  LYS  17           1HZ      LYS  17 -16.960  -3.938  14.656
  143    HZ3  LYS  17           2HZ      LYS  17 -15.958  -5.211  14.167
  144    H    THR  18           H        THR  18 -12.781  -2.898  11.240
  145    HA   THR  18           HA       THR  18 -11.186  -1.808   9.017
  146    HB   THR  18           HB       THR  18 -10.489  -2.052  11.986
  147    HG1  THR  18           HG1      THR  18 -11.406   0.190  10.477
  148   HG21  THR  18          3HG2      THR  18  -8.479  -1.864  10.536
  149   HG22  THR  18          1HG2      THR  18  -8.727  -0.394  11.492
  150   HG23  THR  18          2HG2      THR  18  -9.167  -0.423   9.784
  151    H    TYR  19           H        TYR  19  -9.845  -3.105   7.920
  152    HA   TYR  19           HA       TYR  19  -9.206  -5.821   8.929
  153    HB2  TYR  19           2HB      TYR  19  -9.544  -4.862   6.046
  154    HB3  TYR  19           3HB      TYR  19  -9.184  -6.513   6.541
  155    HD1  TYR  19           HD1      TYR  19 -10.960  -7.575   8.234
  156    HD2  TYR  19           HD2      TYR  19 -11.811  -4.330   5.577
  157    HE1  TYR  19           HE1      TYR  19 -13.359  -8.092   8.359
  158    HE2  TYR  19           HE2      TYR  19 -14.213  -4.847   5.708
  159    HH   TYR  19           HH       TYR  19 -15.661  -6.770   6.230
  160    H    GLU  20           H        GLU  20  -7.173  -5.579   9.752
  161    HA   GLU  20           HA       GLU  20  -5.067  -4.372   8.047
  162    HB2  GLU  20           2HB      GLU  20  -3.883  -3.693  10.066
  163    HB3  GLU  20           3HB      GLU  20  -5.494  -3.004  10.049
  164    HG2  GLU  20           2HG      GLU  20  -6.250  -4.713  11.679
  165    HG3  GLU  20           3HG      GLU  20  -4.628  -5.403  11.698
  166    H    ARG  21           H        ARG  21  -3.049  -5.374   7.991
  167    HA   ARG  21           HA       ARG  21  -2.395  -7.774   9.402
  168    HB2  ARG  21           2HB      ARG  21  -4.020  -8.779   7.859
  169    HB3  ARG  21           3HB      ARG  21  -3.236  -8.031   6.473
  170    HG2  ARG  21           2HG      ARG  21  -1.341  -9.479   6.641
  171    HG3  ARG  21           3HG      ARG  21  -1.828 -10.051   8.235
  172    HD2  ARG  21           2HD      ARG  21  -2.253 -11.718   6.455
  173    HD3  ARG  21           3HD      ARG  21  -3.734 -11.228   7.282
  174    HE   ARG  21           HE       ARG  21  -3.554  -9.574   5.097
  175   HH11  ARG  21          1HH1      ARG  21  -3.747 -13.065   5.534
  176   HH12  ARG  21          2HH1      ARG  21  -4.536 -13.317   4.008
  177   HH21  ARG  21          1HH2      ARG  21  -4.550  -9.931   3.104
  178   HH22  ARG  21          2HH2      ARG  21  -4.990 -11.545   2.633
  179    H    THR  22           H        THR  22  -0.208  -8.079   9.368
  180    HA   THR  22           HA       THR  22   1.491  -6.273   7.835
  181    HB   THR  22           HB       THR  22   2.275  -8.418   9.879
  182    HG1  THR  22           HG1      THR  22   1.956  -6.955  11.400
  183   HG21  THR  22          3HG2      THR  22   4.170  -7.755   8.424
  184   HG22  THR  22          1HG2      THR  22   4.400  -7.167  10.077
  185   HG23  THR  22          2HG2      THR  22   3.877  -6.057   8.811
  186    H    TYR  23           H        TYR  23   1.840  -6.881   5.773
  187    HA   TYR  23           HA       TYR  23   2.201  -9.705   4.991
  188    HB2  TYR  23           2HB      TYR  23   2.119  -7.185   3.243
  189    HB3  TYR  23           3HB      TYR  23   2.150  -8.840   2.659
  190    HD1  TYR  23           HD1      TYR  23   0.049  -6.475   4.671
  191    HD2  TYR  23           HD2      TYR  23   0.082  -9.917   2.140
  192    HE1  TYR  23           HE1      TYR  23  -2.392  -6.417   4.577
  193    HE2  TYR  23           HE2      TYR  23  -2.380  -9.859   2.056
  194    HH   TYR  23           HH       TYR  23  -4.191  -7.190   3.110
  195    H    GLN  24           H        GLN  24   4.244 -10.467   4.422
  196    HA   GLN  24           HA       GLN  24   6.549  -8.643   4.785
  197    HB2  GLN  24           2HB      GLN  24   6.420 -11.686   4.566
  198    HB3  GLN  24           3HB      GLN  24   7.921 -10.778   4.650
  199    HG2  GLN  24           2HG      GLN  24   7.458 -11.720   6.818
  200    HG3  GLN  24           3HG      GLN  24   7.298  -9.971   6.910
  201   HE21  GLN  24          1HE2      GLN  24   5.308  -9.099   7.443
  202   HE22  GLN  24          2HE2      GLN  24   3.947 -10.049   7.920
  203    H    LEU  25           H        LEU  25   7.000  -7.566   2.926
  204    HA   LEU  25           HA       LEU  25   7.014  -9.030   0.346
  205    HB2  LEU  25           2HB      LEU  25   6.692  -6.038   0.856
  206    HB3  LEU  25           3HB      LEU  25   6.867  -6.762  -0.738
  207    HG   LEU  25           HG       LEU  25   4.542  -7.124   1.184
  208   HD11  LEU  25          1HD1      LEU  25   4.616  -5.845  -1.564
  209   HD12  LEU  25          2HD1      LEU  25   4.510  -4.996  -0.021
  210   HD13  LEU  25          3HD1      LEU  25   3.192  -6.043  -0.535
  211   HD21  LEU  25          3HD2      LEU  25   4.954  -9.261   0.075
  212   HD22  LEU  25          1HD2      LEU  25   4.959  -8.474  -1.508
  213   HD23  LEU  25          2HD2      LEU  25   3.479  -8.529  -0.544
  214    H    TYR  26           H        TYR  26   9.014  -9.858   0.458
  215    HA   TYR  26           HA       TYR  26  11.383  -8.158   0.719
  216    HB2  TYR  26           2HB      TYR  26  11.606 -10.261   1.858
  217    HB3  TYR  26           3HB      TYR  26  10.931 -11.163   0.507
  218    HD1  TYR  26           HD1      TYR  26  13.920  -9.056   1.407
  219    HD2  TYR  26           HD2      TYR  26  12.401 -12.236  -1.002
  220    HE1  TYR  26           HE1      TYR  26  16.177  -9.492   0.549
  221    HE2  TYR  26           HE2      TYR  26  14.653 -12.670  -1.859
  222    HH   TYR  26           HH       TYR  26  16.758 -11.564  -2.133
  223    H    ALA  27           H        ALA  27  12.559  -7.472  -1.037
  224    HA   ALA  27           HA       ALA  27  12.261  -8.743  -3.650
  225    HB1  ALA  27           3HB      ALA  27  11.678  -6.628  -4.802
  226    HB2  ALA  27           1HB      ALA  27  11.509  -5.827  -3.238
  227    HB3  ALA  27           2HB      ALA  27  10.416  -7.139  -3.683
  228    H    VAL  28           H        VAL  28  13.963  -8.461  -4.953
  229    HA   VAL  28           HA       VAL  28  16.463  -7.515  -4.041
  230    HB   VAL  28           HB       VAL  28  15.527  -8.113  -6.895
  231   HG11  VAL  28          1HG1      VAL  28  18.375  -7.909  -5.845
  232   HG12  VAL  28          2HG1      VAL  28  17.589  -6.777  -6.946
  233   HG13  VAL  28          3HG1      VAL  28  17.914  -8.430  -7.471
  234   HG21  VAL  28          3HG2      VAL  28  15.250 -10.063  -5.418
  235   HG22  VAL  28          1HG2      VAL  28  16.938  -9.939  -4.909
  236   HG23  VAL  28          2HG2      VAL  28  16.547 -10.350  -6.582
  237    H    ARG  29           H        ARG  29  14.029  -6.152  -6.256
  238    HA   ARG  29           HA       ARG  29  15.293  -3.470  -6.043
  239    HB2  ARG  29           2HB      ARG  29  13.842  -4.599  -8.489
  240    HB3  ARG  29           3HB      ARG  29  14.561  -2.997  -8.355
  241    HG2  ARG  29           2HG      ARG  29  16.802  -3.998  -8.193
  242    HG3  ARG  29           3HG      ARG  29  16.101  -5.616  -8.268
  243    HD2  ARG  29           2HD      ARG  29  15.268  -5.144 -10.553
  244    HD3  ARG  29           3HD      ARG  29  15.970  -3.523 -10.470
  245    HE   ARG  29           HE       ARG  29  18.171  -4.578 -10.302
  246   HH11  ARG  29          1HH1      ARG  29  15.589  -6.581 -11.655
  247   HH12  ARG  29          2HH1      ARG  29  16.689  -7.619 -12.501
  248   HH21  ARG  29          1HH2      ARG  29  19.578  -5.961 -11.380
  249   HH22  ARG  29          2HH2      ARG  29  18.962  -7.265 -12.344
  250    H    ASP  30           H        ASP  30  13.854  -1.691  -6.048
  251    HA   ASP  30           HA       ASP  30  11.276  -1.965  -4.885
  252    HB2  ASP  30           2HB      ASP  30  11.048   0.497  -5.410
  253    HB3  ASP  30           3HB      ASP  30  12.519   0.081  -4.536
  254    H    GLU  31           H        GLU  31  12.414  -1.765  -8.199
  255    HA   GLU  31           HA       GLU  31  10.115  -1.600  -9.718
  256    HB2  GLU  31           2HB      GLU  31  12.504  -3.459 -10.126
  257    HB3  GLU  31           3HB      GLU  31  11.330  -3.058 -11.377
  258    HG2  GLU  31           2HG      GLU  31  13.152  -1.051 -10.005
  259    HG3  GLU  31           3HG      GLU  31  13.494  -1.817 -11.556
  260    H    GLU  32           H        GLU  32  11.466  -4.431  -8.047
  261    HA   GLU  32           HA       GLU  32   9.545  -6.332  -9.012
  262    HB2  GLU  32           2HB      GLU  32  11.288  -6.672  -6.544
  263    HB3  GLU  32           3HB      GLU  32  10.608  -7.935  -7.564
  264    HG2  GLU  32           2HG      GLU  32  12.897  -6.060  -8.186
  265    HG3  GLU  32           3HG      GLU  32  12.971  -7.800  -7.959
  266    H    LEU  33           H        LEU  33   9.642  -4.095  -6.364
  267    HA   LEU  33           HA       LEU  33   7.750  -5.430  -4.656
  268    HB2  LEU  33           2HB      LEU  33   9.637  -3.481  -4.211
  269    HB3  LEU  33           3HB      LEU  33   8.209  -2.479  -4.314
  270    HG   LEU  33           HG       LEU  33   8.675  -2.953  -1.978
  271   HD11  LEU  33          1HD1      LEU  33   6.605  -3.955  -1.178
  272   HD12  LEU  33          2HD1      LEU  33   6.264  -4.583  -2.793
  273   HD13  LEU  33          3HD1      LEU  33   6.307  -2.841  -2.512
  274   HD21  LEU  33          3HD2      LEU  33   8.546  -5.913  -2.618
  275   HD22  LEU  33          1HD2      LEU  33   8.738  -5.200  -1.011
  276   HD23  LEU  33          2HD2      LEU  33  10.000  -4.994  -2.223
  277    H    LYS  34           H        LYS  34   7.543  -3.218  -7.367
  278    HA   LYS  34           HA       LYS  34   5.093  -1.926  -6.862
  279    HB2  LYS  34           2HB      LYS  34   6.349  -2.604  -9.556
  280    HB3  LYS  34           3HB      LYS  34   5.050  -1.436  -9.307
  281    HG2  LYS  34           2HG      LYS  34   6.561  -0.081  -7.879
  282    HG3  LYS  34           3HG      LYS  34   7.858  -1.240  -8.170
  283    HD2  LYS  34           2HD      LYS  34   8.162   0.699  -9.611
  284    HD3  LYS  34           3HD      LYS  34   7.767  -0.707 -10.602
  285    HE2  LYS  34           2HE      LYS  34   5.448   0.084 -10.828
  286    HE3  LYS  34           3HE      LYS  34   5.792   1.450  -9.761
  287    HZ1  LYS  34           3HZ      LYS  34   5.868   2.125 -12.062
  288    HZ2  LYS  34           1HZ      LYS  34   7.037   0.958 -12.415
  289    HZ3  LYS  34           2HZ      LYS  34   7.406   2.248 -11.384
  290    H    GLU  35           H        GLU  35   5.677  -4.892  -8.817
  291    HA   GLU  35           HA       GLU  35   3.012  -5.518  -9.425
  292    HB2  GLU  35           2HB      GLU  35   3.838  -7.821  -9.887
  293    HB3  GLU  35           3HB      GLU  35   4.883  -6.589 -10.591
  294    HG2  GLU  35           2HG      GLU  35   6.474  -6.860  -8.717
  295    HG3  GLU  35           3HG      GLU  35   5.436  -8.098  -8.014
  296    H    LYS  36           H        LYS  36   4.938  -6.209  -6.560
  297    HA   LYS  36           HA       LYS  36   3.244  -8.138  -5.336
  298    HB2  LYS  36           2HB      LYS  36   5.280  -6.250  -4.065
  299    HB3  LYS  36           3HB      LYS  36   4.559  -7.656  -3.272
  300    HG2  LYS  36           2HG      LYS  36   5.619  -9.152  -4.877
  301    HG3  LYS  36           3HG      LYS  36   6.269  -7.772  -5.775
  302    HD2  LYS  36           2HD      LYS  36   7.630  -7.136  -3.798
  303    HD3  LYS  36           3HD      LYS  36   6.978  -8.517  -2.904
  304    HE2  LYS  36           2HE      LYS  36   8.649  -8.663  -5.438
  305    HE3  LYS  36           3HE      LYS  36   9.212  -9.017  -3.802
  306    HZ1  LYS  36           3HZ      LYS  36   7.170 -10.511  -5.348
  307    HZ2  LYS  36           1HZ      LYS  36   7.494 -10.790  -3.715
  308    HZ3  LYS  36           2HZ      LYS  36   8.695 -11.062  -4.872
  309    H    LEU  37           H        LEU  37   3.594  -4.624  -4.975
  310    HA   LEU  37           HA       LEU  37   1.661  -4.143  -3.023
  311    HB2  LEU  37           2HB      LEU  37   2.637  -2.382  -5.303
  312    HB3  LEU  37           3HB      LEU  37   1.581  -1.798  -4.022
  313    HG   LEU  37           HG       LEU  37   4.354  -2.952  -3.535
  314   HD11  LEU  37          1HD1      LEU  37   3.551  -0.037  -3.675
  315   HD12  LEU  37          2HD1      LEU  37   4.563  -0.907  -4.832
  316   HD13  LEU  37          3HD1      LEU  37   5.129  -0.664  -3.181
  317   HD21  LEU  37          3HD2      LEU  37   2.494  -1.436  -1.670
  318   HD22  LEU  37          1HD2      LEU  37   4.136  -1.967  -1.292
  319   HD23  LEU  37          2HD2      LEU  37   2.877  -3.160  -1.593
  320    H    LYS  38           H        LYS  38   1.343  -4.160  -6.612
  321    HA   LYS  38           HA       LYS  38  -1.391  -3.706  -6.870
  322    HB2  LYS  38           2HB      LYS  38   0.420  -5.502  -8.538
  323    HB3  LYS  38           3HB      LYS  38  -1.239  -5.117  -8.995
  324    HG2  LYS  38           2HG      LYS  38  -0.670  -2.740  -9.153
  325    HG3  LYS  38           3HG      LYS  38   0.988  -3.086  -8.643
  326    HD2  LYS  38           2HD      LYS  38   1.334  -4.454 -10.674
  327    HD3  LYS  38           3HD      LYS  38  -0.335  -4.148 -11.176
  328    HE2  LYS  38           2HE      LYS  38   1.263  -2.705 -12.381
  329    HE3  LYS  38           3HE      LYS  38   0.161  -1.751 -11.394
  330    HZ1  LYS  38           3HZ      LYS  38   2.912  -2.514 -10.571
  331    HZ2  LYS  38           1HZ      LYS  38   1.867  -1.466  -9.755
  332    HZ3  LYS  38           2HZ      LYS  38   2.503  -1.031 -11.267
  333    H    LYS  39           H        LYS  39   0.298  -6.836  -6.358
  334    HA   LYS  39           HA       LYS  39  -1.960  -8.516  -6.485
  335    HB2  LYS  39           2HB      LYS  39   0.717  -8.929  -5.091
  336    HB3  LYS  39           3HB      LYS  39  -0.508 -10.192  -5.214
  337    HG2  LYS  39           2HG      LYS  39   0.868  -8.830  -7.547
  338    HG3  LYS  39           3HG      LYS  39   1.275 -10.422  -6.913
  339    HD2  LYS  39           2HD      LYS  39  -1.494  -9.783  -8.011
  340    HD3  LYS  39           3HD      LYS  39  -0.168 -10.298  -9.050
  341    HE2  LYS  39           2HE      LYS  39  -1.518 -12.222  -8.535
  342    HE3  LYS  39           3HE      LYS  39   0.023 -12.394  -7.699
  343    HZ1  LYS  39           3HZ      LYS  39  -1.032 -11.735  -5.652
  344    HZ2  LYS  39           1HZ      LYS  39  -1.888 -13.025  -6.333
  345    HZ3  LYS  39           2HZ      LYS  39  -2.498 -11.450  -6.442
  346    H    VAL  40           H        VAL  40  -0.213  -7.391  -3.571
  347    HA   VAL  40           HA       VAL  40  -1.755  -8.415  -1.536
  348    HB   VAL  40           HB       VAL  40  -0.197  -5.789  -1.646
  349   HG11  VAL  40          1HG1      VAL  40  -1.807  -5.584   0.188
  350   HG12  VAL  40          2HG1      VAL  40  -0.177  -5.787   0.829
  351   HG13  VAL  40          3HG1      VAL  40  -1.302  -7.146   0.834
  352   HG21  VAL  40          3HG2      VAL  40   1.160  -7.832  -1.971
  353   HG22  VAL  40          1HG2      VAL  40   0.551  -8.488  -0.452
  354   HG23  VAL  40          2HG2      VAL  40   1.563  -7.039  -0.446
  355    H    LEU  41           H        LEU  41  -2.204  -5.316  -3.213
  356    HA   LEU  41           HA       LEU  41  -4.485  -4.421  -1.799
  357    HB2  LEU  41           2HB      LEU  41  -3.365  -3.726  -4.536
  358    HB3  LEU  41           3HB      LEU  41  -4.765  -2.906  -3.860
  359    HG   LEU  41           HG       LEU  41  -2.071  -2.971  -2.442
  360   HD11  LEU  41          1HD1      LEU  41  -3.074  -0.782  -4.276
  361   HD12  LEU  41          2HD1      LEU  41  -1.756  -1.905  -4.622
  362   HD13  LEU  41          3HD1      LEU  41  -1.601  -0.748  -3.302
  363   HD21  LEU  41          3HD2      LEU  41  -4.488  -1.169  -2.079
  364   HD22  LEU  41          1HD2      LEU  41  -2.960  -1.044  -1.205
  365   HD23  LEU  41          2HD2      LEU  41  -3.973  -2.469  -0.995
  366    H    ASN  42           H        ASN  42  -4.192  -6.085  -4.983
  367    HA   ASN  42           HA       ASN  42  -6.979  -6.184  -5.499
  368    HB2  ASN  42           2HB      ASN  42  -4.691  -7.768  -6.725
  369    HB3  ASN  42           3HB      ASN  42  -6.340  -7.805  -7.340
  370   HD21  ASN  42          1HD2      ASN  42  -6.755  -4.876  -6.863
  371   HD22  ASN  42          2HD2      ASN  42  -5.830  -4.089  -8.088
  372    H    GLU  43           H        GLU  43  -4.943  -8.339  -3.624
  373    HA   GLU  43           HA       GLU  43  -6.780 -10.559  -3.600
  374    HB2  GLU  43           2HB      GLU  43  -4.685  -9.922  -1.465
  375    HB3  GLU  43           3HB      GLU  43  -5.481 -11.466  -1.737
  376    HG2  GLU  43           2HG      GLU  43  -3.312 -10.152  -3.376
  377    HG3  GLU  43           3HG      GLU  43  -3.268 -11.698  -2.547
  378    H    ARG  44           H        ARG  44  -5.959  -7.908  -1.372
  379    HA   ARG  44           HA       ARG  44  -7.840  -8.710   0.627
  380    HB2  ARG  44           2HB      ARG  44  -5.566  -7.503   0.978
  381    HB3  ARG  44           3HB      ARG  44  -6.402  -6.023   0.522
  382    HG2  ARG  44           2HG      ARG  44  -6.298  -6.212   2.955
  383    HG3  ARG  44           3HG      ARG  44  -7.976  -6.335   2.418
  384    HD2  ARG  44           2HD      ARG  44  -7.695  -8.881   2.535
  385    HD3  ARG  44           3HD      ARG  44  -6.152  -8.584   3.340
  386    HE   ARG  44           HE       ARG  44  -8.231  -7.185   4.662
  387   HH11  ARG  44          1HH1      ARG  44  -7.036 -10.474   4.222
  388   HH12  ARG  44          2HH1      ARG  44  -7.663 -11.044   5.733
  389   HH21  ARG  44          1HH2      ARG  44  -9.114  -7.983   6.632
  390   HH22  ARG  44          2HH2      ARG  44  -8.844  -9.625   7.094
  391    H    MET  45           H        MET  45  -7.968  -6.527  -2.107
  392    HA   MET  45           HA       MET  45 -10.385  -5.171  -1.157
  393    HB2  MET  45           2HB      MET  45  -8.675  -4.690  -3.613
  394    HB3  MET  45           3HB      MET  45 -10.206  -3.871  -3.346
  395    HG2  MET  45           2HG      MET  45  -9.194  -3.062  -1.120
  396    HG3  MET  45           3HG      MET  45  -7.645  -3.593  -1.782
  397    HE1  MET  45           3HE      MET  45 -10.716  -2.058  -3.800
  398    HE2  MET  45           1HE      MET  45 -10.295  -0.348  -3.752
  399    HE3  MET  45           2HE      MET  45 -10.737  -1.185  -2.264
  400    H    ASP  46           H        ASP  46  -9.714  -7.974  -2.892
  401    HA   ASP  46           HA       ASP  46 -11.729  -7.988  -4.838
  402    HB2  ASP  46           2HB      ASP  46  -9.989  -9.688  -4.882
  403    HB3  ASP  46           3HB      ASP  46 -10.520 -10.345  -3.339
  404    HA   PRO  47           HA       PRO  47 -14.871  -9.785  -1.486
  405    HB2  PRO  47           2HB      PRO  47 -14.279  -9.236   1.171
  406    HB3  PRO  47           3HB      PRO  47 -13.855 -10.765   0.371
  407    HG2  PRO  47           2HG      PRO  47 -12.125  -8.342   0.825
  408    HG3  PRO  47           3HG      PRO  47 -11.745 -10.060   1.098
  409    HD2  PRO  47           2HD      PRO  47 -10.880  -8.810  -1.103
  410    HD3  PRO  47           3HD      PRO  47 -11.432 -10.495  -1.180
  411    H    ILE  48           H        ILE  48 -13.061  -6.782  -1.139
  412    HA   ILE  48           HA       ILE  48 -14.949  -5.300   0.425
  413    HB   ILE  48           HB       ILE  48 -12.649  -4.305  -1.314
  414   HG12  ILE  48          2HG1      ILE  48 -11.827  -5.845   0.383
  415   HG13  ILE  48          3HG1      ILE  48 -11.354  -4.214   0.830
  416   HG21  ILE  48          1HG2      ILE  48 -14.100  -2.801   0.891
  417   HG22  ILE  48          2HG2      ILE  48 -14.187  -2.452  -0.835
  418   HG23  ILE  48          3HG2      ILE  48 -12.667  -2.237   0.032
  419   HD11  ILE  48          3HD1      ILE  48 -12.031  -5.475   2.757
  420   HD12  ILE  48          1HD1      ILE  48 -13.600  -5.821   2.037
  421   HD13  ILE  48          2HD1      ILE  48 -13.171  -4.168   2.476
  422    H    LYS  49           H        LYS  49 -14.344  -5.592  -3.054
  423    HA   LYS  49           HA       LYS  49 -16.115  -3.546  -3.952
  424    HB2  LYS  49           2HB      LYS  49 -15.262  -6.076  -5.417
  425    HB3  LYS  49           3HB      LYS  49 -15.933  -4.621  -6.156
  426    HG2  LYS  49           2HG      LYS  49 -13.942  -3.349  -5.604
  427    HG3  LYS  49           3HG      LYS  49 -13.282  -4.698  -4.673
  428    HD2  LYS  49           2HD      LYS  49 -13.796  -4.702  -7.679
  429    HD3  LYS  49           3HD      LYS  49 -12.218  -4.514  -6.910
  430    HE2  LYS  49           2HE      LYS  49 -12.416  -6.784  -5.944
  431    HE3  LYS  49           3HE      LYS  49 -14.002  -6.973  -6.694
  432    HZ1  LYS  49           3HZ      LYS  49 -12.362  -8.057  -8.024
  433    HZ2  LYS  49           1HZ      LYS  49 -11.406  -6.664  -8.104
  434    HZ3  LYS  49           2HZ      LYS  49 -12.912  -6.704  -8.866
  435    H    LYS  50           H        LYS  50 -16.419  -6.997  -3.351
  436    HA   LYS  50           HA       LYS  50 -19.131  -7.313  -4.185
  437    HB2  LYS  50           2HB      LYS  50 -17.276  -9.062  -4.139
  438    HB3  LYS  50           3HB      LYS  50 -17.445  -9.126  -2.396
  439    HG2  LYS  50           2HG      LYS  50 -19.816  -9.707  -4.186
  440    HG3  LYS  50           3HG      LYS  50 -18.588 -10.942  -3.917
  441    HD2  LYS  50           2HD      LYS  50 -20.280  -9.608  -1.761
  442    HD3  LYS  50           3HD      LYS  50 -20.504 -11.240  -2.398
  443    HE2  LYS  50           2HE      LYS  50 -18.315 -11.915  -1.511
  444    HE3  LYS  50           3HE      LYS  50 -18.023 -10.275  -0.923
  445    HZ1  LYS  50           3HZ      LYS  50 -20.264 -11.999  -0.025
  446    HZ2  LYS  50           1HZ      LYS  50 -19.826 -10.501   0.615
  447    HZ3  LYS  50           2HZ      LYS  50 -18.802 -11.834   0.804
  448    H    LEU  51           H        LEU  51 -17.576  -6.321  -1.192
  449    HA   LEU  51           HA       LEU  51 -19.910  -6.557   0.509
  450    HB2  LEU  51           2HB      LEU  51 -17.316  -4.993   0.872
  451    HB3  LEU  51           3HB      LEU  51 -18.588  -5.045   2.082
  452    HG   LEU  51           HG       LEU  51 -16.930  -7.415   1.135
  453   HD11  LEU  51          1HD1      LEU  51 -16.908  -5.982   3.807
  454   HD12  LEU  51          2HD1      LEU  51 -15.651  -5.910   2.568
  455   HD13  LEU  51          3HD1      LEU  51 -15.983  -7.431   3.393
  456   HD21  LEU  51          3HD2      LEU  51 -19.194  -8.150   1.647
  457   HD22  LEU  51          1HD2      LEU  51 -19.130  -7.348   3.219
  458   HD23  LEU  51          2HD2      LEU  51 -18.072  -8.719   2.876
  459    H    GLY  52           H        GLY  52 -18.511  -4.100  -1.579
  460    HA2  GLY  52           2HA      GLY  52 -19.414  -2.234  -2.539
  461    HA3  GLY  52           3HA      GLY  52 -20.967  -2.654  -1.830
  462    H    CYS  53           H        CYS  53 -17.779  -1.745  -0.521
  463    HA   CYS  53           HA       CYS  53 -18.983   0.312   1.199
  464    HB2  CYS  53           2HB      CYS  53 -16.105  -0.687   1.010
  465    HB3  CYS  53           3HB      CYS  53 -16.737   0.426   2.229
  466    H    LYS  54           H        LYS  54 -19.248   2.278   0.251
  467    HA   LYS  54           HA       LYS  54 -18.007   3.107  -2.154
  468    HB2  LYS  54           2HB      LYS  54 -19.526   4.695  -0.046
  469    HB3  LYS  54           3HB      LYS  54 -18.980   5.389  -1.570
  470    HG2  LYS  54           2HG      LYS  54 -20.413   3.898  -2.835
  471    HG3  LYS  54           3HG      LYS  54 -20.844   3.005  -1.380
  472    HD2  LYS  54           2HD      LYS  54 -22.701   4.424  -1.974
  473    HD3  LYS  54           3HD      LYS  54 -21.980   5.054  -0.496
  474    HE2  LYS  54           2HE      LYS  54 -21.395   6.194  -3.250
  475    HE3  LYS  54           3HE      LYS  54 -22.702   6.773  -2.222
  476    HZ1  LYS  54           3HZ      LYS  54 -20.946   7.212  -0.503
  477    HZ2  LYS  54           1HZ      LYS  54 -20.893   8.197  -1.874
  478    HZ3  LYS  54           2HZ      LYS  54 -19.792   6.934  -1.706
  479    H    ARG  55           H        ARG  55 -17.687   4.951   0.918
  480    HA   ARG  55           HA       ARG  55 -14.991   5.739   0.142
  481    HB2  ARG  55           2HB      ARG  55 -16.485   7.440   1.107
  482    HB3  ARG  55           3HB      ARG  55 -16.648   6.498   2.585
  483    HG2  ARG  55           2HG      ARG  55 -14.337   6.885   3.186
  484    HG3  ARG  55           3HG      ARG  55 -13.982   7.584   1.603
  485    HD2  ARG  55           2HD      ARG  55 -15.881   8.791   3.641
  486    HD3  ARG  55           3HD      ARG  55 -14.198   9.282   3.421
  487    HE   ARG  55           HE       ARG  55 -16.244   9.515   1.284
  488   HH11  ARG  55          1HH1      ARG  55 -13.559  10.945   3.090
  489   HH12  ARG  55          2HH1      ARG  55 -13.549  12.401   2.137
  490   HH21  ARG  55          1HH2      ARG  55 -16.206  11.427   0.061
  491   HH22  ARG  55          2HH2      ARG  55 -15.049  12.666   0.425
  492    H    VAL  56           H        VAL  56 -13.308   4.558   0.652
  493    HA   VAL  56           HA       VAL  56 -13.159   3.148   3.253
  494    HB   VAL  56           HB       VAL  56 -11.644   1.450   2.207
  495   HG11  VAL  56          1HG1      VAL  56 -14.386   1.529   0.901
  496   HG12  VAL  56          2HG1      VAL  56 -14.009   0.879   2.499
  497   HG13  VAL  56          3HG1      VAL  56 -13.350   0.104   1.058
  498   HG21  VAL  56          3HG2      VAL  56 -11.503   1.190  -0.248
  499   HG22  VAL  56          1HG2      VAL  56 -10.827   2.736   0.274
  500   HG23  VAL  56          2HG2      VAL  56 -12.428   2.680  -0.466
  501    H    ARG  57           H        ARG  57 -11.389   3.626   4.434
  502    HA   ARG  57           HA       ARG  57  -9.214   5.215   3.238
  503    HB2  ARG  57           2HB      ARG  57 -10.217   6.201   5.282
  504    HB3  ARG  57           3HB      ARG  57  -9.873   4.722   6.182
  505    HG2  ARG  57           2HG      ARG  57  -7.435   5.088   5.780
  506    HG3  ARG  57           3HG      ARG  57  -7.821   6.600   4.961
  507    HD2  ARG  57           2HD      ARG  57  -8.721   7.523   7.054
  508    HD3  ARG  57           3HD      ARG  57  -8.418   5.987   7.878
  509    HE   ARG  57           HE       ARG  57  -5.975   6.568   6.953
  510   HH11  ARG  57          1HH1      ARG  57  -8.230   8.591   8.767
  511   HH12  ARG  57          2HH1      ARG  57  -6.972   9.534   9.499
  512   HH21  ARG  57          1HH2      ARG  57  -4.355   7.861   7.842
  513   HH22  ARG  57          2HH2      ARG  57  -4.763   9.114   8.967
  514    H    ILE  58           H        ILE  58  -7.751   3.900   2.406
  515    HA   ILE  58           HA       ILE  58  -6.926   1.406   3.723
  516    HB   ILE  58           HB       ILE  58  -5.930   2.559   1.062
  517   HG12  ILE  58          2HG1      ILE  58  -8.167   0.506   1.434
  518   HG13  ILE  58          3HG1      ILE  58  -8.408   2.183   0.962
  519   HG21  ILE  58          1HG2      ILE  58  -5.792  -0.272   2.173
  520   HG22  ILE  58          2HG2      ILE  58  -4.451   0.871   2.085
  521   HG23  ILE  58          3HG2      ILE  58  -5.177   0.251   0.602
  522   HD11  ILE  58          3HD1      ILE  58  -8.559   0.697  -0.940
  523   HD12  ILE  58          1HD1      ILE  58  -6.926   0.097  -0.645
  524   HD13  ILE  58          2HD1      ILE  58  -7.182   1.782  -1.112
  525    H    SER  59           H        SER  59  -5.593   1.999   5.397
  526    HA   SER  59           HA       SER  59  -3.544   4.078   5.083
  527    HB2  SER  59           2HB      SER  59  -4.551   2.661   7.607
  528    HB3  SER  59           3HB      SER  59  -3.460   4.050   7.550
  529    HG   SER  59           HG       SER  59  -6.215   3.909   7.002
  530    H    ILE  60           H        ILE  60  -1.841   3.112   4.117
  531    HA   ILE  60           HA       ILE  60  -0.960   0.418   4.952
  532    HB   ILE  60           HB       ILE  60  -0.337   2.070   2.473
  533   HG12  ILE  60          2HG1      ILE  60  -1.807  -0.580   2.800
  534   HG13  ILE  60          3HG1      ILE  60  -2.556   0.979   2.470
  535   HG21  ILE  60          1HG2      ILE  60   1.021   0.172   1.647
  536   HG22  ILE  60          2HG2      ILE  60   0.827  -0.634   3.205
  537   HG23  ILE  60          3HG2      ILE  60   1.711   0.888   3.104
  538   HD11  ILE  60          3HD1      ILE  60  -1.408   1.049   0.295
  539   HD12  ILE  60          1HD1      ILE  60  -2.459  -0.355   0.476
  540   HD13  ILE  60          2HD1      ILE  60  -0.714  -0.543   0.627
  541    H    ARG  61           H        ARG  61   0.604   0.374   6.408
  542    HA   ARG  61           HA       ARG  61   2.626   2.537   6.557
  543    HB2  ARG  61           2HB      ARG  61   1.797   0.460   8.635
  544    HB3  ARG  61           3HB      ARG  61   3.065   1.667   8.856
  545    HG2  ARG  61           2HG      ARG  61   1.323   3.451   8.546
  546    HG3  ARG  61           3HG      ARG  61   0.098   2.179   8.497
  547    HD2  ARG  61           2HD      ARG  61   1.944   2.804  10.828
  548    HD3  ARG  61           3HD      ARG  61   0.220   3.181  10.722
  549    HE   ARG  61           HE       ARG  61   0.880   0.372  10.410
  550   HH11  ARG  61          1HH1      ARG  61  -0.017   2.865  12.734
  551   HH12  ARG  61          2HH1      ARG  61  -0.587   1.722  13.908
  552   HH21  ARG  61          1HH2      ARG  61   0.193  -1.091  11.972
  553   HH22  ARG  61          2HH2      ARG  61  -0.466  -0.521  13.473
  554    H    VAL  62           H        VAL  62   4.501   2.015   5.644
  555    HA   VAL  62           HA       VAL  62   5.234  -0.799   5.217
  556    HB   VAL  62           HB       VAL  62   5.460   0.698   3.261
  557   HG11  VAL  62          1HG1      VAL  62   7.495   2.275   4.875
  558   HG12  VAL  62          2HG1      VAL  62   5.895   2.837   4.379
  559   HG13  VAL  62          3HG1      VAL  62   7.127   2.508   3.159
  560   HG21  VAL  62          3HG2      VAL  62   6.985  -1.216   3.400
  561   HG22  VAL  62          1HG2      VAL  62   8.163  -0.251   4.295
  562   HG23  VAL  62          2HG2      VAL  62   7.794   0.141   2.612
  563    H    LYS  63           H        LYS  63   6.895  -1.743   6.290
  564    HA   LYS  63           HA       LYS  63   8.107  -0.421   8.561
  565    HB2  LYS  63           2HB      LYS  63   8.437  -3.189   7.337
  566    HB3  LYS  63           3HB      LYS  63   9.304  -2.660   8.777
  567    HG2  LYS  63           2HG      LYS  63   6.294  -3.003   8.505
  568    HG3  LYS  63           3HG      LYS  63   7.397  -4.076   9.351
  569    HD2  LYS  63           2HD      LYS  63   6.607  -2.924  11.172
  570    HD3  LYS  63           3HD      LYS  63   7.920  -1.830  10.752
  571    HE2  LYS  63           2HE      LYS  63   6.325  -0.364   9.577
  572    HE3  LYS  63           3HE      LYS  63   5.016  -1.495   9.925
  573    HZ1  LYS  63           3HZ      LYS  63   5.446  -1.115  12.314
  574    HZ2  LYS  63           1HZ      LYS  63   4.943   0.273  11.499
  575    HZ3  LYS  63           2HZ      LYS  63   6.568   0.092  11.903
  576    H    HIS  64           H        HIS  64   9.708   0.934   8.204
  577    HA   HIS  64           HA       HIS  64  11.190   1.036   5.734
  578    HB2  HIS  64           2HB      HIS  64  11.533   2.688   8.285
  579    HB3  HIS  64           3HB      HIS  64  12.180   3.081   6.691
  580    HD1  HIS  64           HD1      HIS  64   9.062   3.221   8.734
  581    HD2  HIS  64           HD2      HIS  64  10.255   4.067   4.839
  582    HE1  HIS  64           HE1      HIS  64   7.180   4.540   7.725
  583    HE2  HIS  64           HE2      HIS  64   8.042   5.249   5.474
  584    H    SER  65           H        SER  65  13.392   0.686   5.489
  585    HA   SER  65           HA       SER  65  14.354  -1.691   6.475
  586    HB2  SER  65           2HB      SER  65  15.932   0.587   5.212
  587    HB3  SER  65           3HB      SER  65  16.439  -1.106   5.269
  588    HG   SER  65           HG       SER  65  15.181  -0.128   3.341
  589    H    ASP  66           H        ASP  66  15.144   1.557   7.614
  590    HA   ASP  66           HA       ASP  66  16.149   0.775  10.165
  591    HB2  ASP  66           2HB      ASP  66  18.118   0.025   8.963
  592    HB3  ASP  66           3HB      ASP  66  18.153   1.476   7.976
  593    H    ALA  67           H        ALA  67  16.998   2.784  11.358
  594    HA   ALA  67           HA       ALA  67  15.222   4.987  10.838
  595    HB1  ALA  67           3HB      ALA  67  15.714   4.227  13.132
  596    HB2  ALA  67           1HB      ALA  67  16.071   5.941  12.917
  597    HB3  ALA  67           2HB      ALA  67  17.389   4.760  12.958
  598    H    ALA  68           H        ALA  68  18.675   4.443  10.219
  599    HA   ALA  68           HA       ALA  68  19.178   7.191   9.384
  600    HB1  ALA  68           3HB      ALA  68  20.814   4.669   8.892
  601    HB2  ALA  68           1HB      ALA  68  21.025   5.794  10.233
  602    HB3  ALA  68           2HB      ALA  68  21.345   6.327   8.581
  603    H    GLU  69           H        GLU  69  18.485   4.059   7.853
  604    HA   GLU  69           HA       GLU  69  18.449   4.978   5.149
  605    HB2  GLU  69           2HB      GLU  69  17.151   2.495   6.367
  606    HB3  GLU  69           3HB      GLU  69  17.288   2.814   4.638
  607    HG2  GLU  69           2HG      GLU  69  19.790   2.841   4.905
  608    HG3  GLU  69           3HG      GLU  69  19.570   2.344   6.584
  609    H    GLU  70           H        GLU  70  16.216   5.315   7.718
  610    HA   GLU  70           HA       GLU  70  13.674   5.284   6.673
  611    HB2  GLU  70           2HB      GLU  70  14.143   5.616   9.040
  612    HB3  GLU  70           3HB      GLU  70  14.940   7.144   8.723
  613    HG2  GLU  70           2HG      GLU  70  12.767   7.495   9.757
  614    HG3  GLU  70           3HG      GLU  70  12.800   8.176   8.127
  615    H    LYS  71           H        LYS  71  16.015   7.913   6.546
  616    HA   LYS  71           HA       LYS  71  14.443   9.965   5.441
  617    HB2  LYS  71           2HB      LYS  71  17.457   9.481   5.327
  618    HB3  LYS  71           3HB      LYS  71  16.678  11.006   4.906
  619    HG2  LYS  71           2HG      LYS  71  15.964  11.372   7.182
  620    HG3  LYS  71           3HG      LYS  71  16.426   9.734   7.651
  621    HD2  LYS  71           2HD      LYS  71  18.046  11.448   8.439
  622    HD3  LYS  71           3HD      LYS  71  18.785  10.254   7.370
  623    HE2  LYS  71           2HE      LYS  71  19.562  12.565   6.907
  624    HE3  LYS  71           3HE      LYS  71  18.752  11.851   5.513
  625    HZ1  LYS  71           3HZ      LYS  71  16.765  13.097   6.062
  626    HZ2  LYS  71           1HZ      LYS  71  18.079  14.146   5.901
  627    HZ3  LYS  71           2HZ      LYS  71  17.509  13.744   7.437
  628    H    LYS  72           H        LYS  72  16.382   7.424   3.953
  629    HA   LYS  72           HA       LYS  72  15.957   8.321   1.234
  630    HB2  LYS  72           2HB      LYS  72  18.081   7.194   1.975
  631    HB3  LYS  72           3HB      LYS  72  17.169   5.737   2.311
  632    HG2  LYS  72           2HG      LYS  72  18.192   5.271   0.271
  633    HG3  LYS  72           3HG      LYS  72  16.567   5.743  -0.213
  634    HD2  LYS  72           2HD      LYS  72  18.942   7.650  -0.247
  635    HD3  LYS  72           3HD      LYS  72  18.502   6.644  -1.622
  636    HE2  LYS  72           2HE      LYS  72  16.307   7.782  -1.743
  637    HE3  LYS  72           3HE      LYS  72  16.758   8.790  -0.368
  638    HZ1  LYS  72           3HZ      LYS  72  18.082   8.749  -3.025
  639    HZ2  LYS  72           1HZ      LYS  72  18.628   9.633  -1.692
  640    HZ3  LYS  72           2HZ      LYS  72  17.130   9.989  -2.387
  641    H    GLU  73           H        GLU  73  14.546   5.969   3.452
  642    HA   GLU  73           HA       GLU  73  13.678   4.149   1.397
  643    HB2  GLU  73           2HB      GLU  73  14.505   3.431   3.676
  644    HB3  GLU  73           3HB      GLU  73  13.043   4.104   4.380
  645    HG2  GLU  73           2HG      GLU  73  12.956   1.640   4.118
  646    HG3  GLU  73           3HG      GLU  73  11.664   2.469   3.240
  647    H    ALA  74           H        ALA  74  12.110   6.375   3.684
  648    HA   ALA  74           HA       ALA  74   9.420   5.794   3.035
  649    HB1  ALA  74           3HB      ALA  74  10.058   6.939   5.092
  650    HB2  ALA  74           1HB      ALA  74   8.926   7.933   4.177
  651    HB3  ALA  74           2HB      ALA  74  10.654   8.327   4.175
  652    H    LYS  75           H        LYS  75  11.610   8.364   1.961
  653    HA   LYS  75           HA       LYS  75   9.923   9.719   0.190
  654    HB2  LYS  75           2HB      LYS  75  12.128  10.539   1.147
  655    HB3  LYS  75           3HB      LYS  75  12.962   9.492   0.010
  656    HG2  LYS  75           2HG      LYS  75  12.937  11.810  -0.796
  657    HG3  LYS  75           3HG      LYS  75  12.013  10.763  -1.883
  658    HD2  LYS  75           2HD      LYS  75   9.905  11.535  -0.809
  659    HD3  LYS  75           3HD      LYS  75  10.834  12.596   0.252
  660    HE2  LYS  75           2HE      LYS  75  11.537  13.946  -1.639
  661    HE3  LYS  75           3HE      LYS  75  10.811  12.807  -2.777
  662    HZ1  LYS  75           3HZ      LYS  75   9.410  14.754  -2.405
  663    HZ2  LYS  75           1HZ      LYS  75   9.310  14.387  -0.759
  664    HZ3  LYS  75           2HZ      LYS  75   8.640  13.336  -1.897
  665    H    LYS  76           H        LYS  76  12.214   7.076  -0.408
  666    HA   LYS  76           HA       LYS  76  12.009   6.884  -3.221
  667    HB2  LYS  76           2HB      LYS  76  13.846   5.948  -1.776
  668    HB3  LYS  76           3HB      LYS  76  12.745   4.720  -1.188
  669    HG2  LYS  76           2HG      LYS  76  13.495   4.954  -4.122
  670    HG3  LYS  76           3HG      LYS  76  14.495   4.068  -2.976
  671    HD2  LYS  76           2HD      LYS  76  11.648   3.426  -3.827
  672    HD3  LYS  76           3HD      LYS  76  13.108   2.500  -4.176
  673    HE2  LYS  76           2HE      LYS  76  11.800   2.853  -1.451
  674    HE3  LYS  76           3HE      LYS  76  11.817   1.390  -2.436
  675    HZ1  LYS  76           3HZ      LYS  76  13.436   1.339  -0.622
  676    HZ2  LYS  76           1HZ      LYS  76  14.236   2.676  -1.288
  677    HZ3  LYS  76           2HZ      LYS  76  14.177   1.213  -2.133
  678    H    PHE  77           H        PHE  77  10.355   5.153  -0.580
  679    HA   PHE  77           HA       PHE  77   8.978   3.343  -2.342
  680    HB2  PHE  77           2HB      PHE  77   9.821   2.863   0.057
  681    HB3  PHE  77           3HB      PHE  77   8.410   3.745   0.628
  682    HD1  PHE  77           HD1      PHE  77   9.432   0.836  -1.496
  683    HD2  PHE  77           HD2      PHE  77   6.336   2.580   0.886
  684    HE1  PHE  77           HE1      PHE  77   8.114  -1.225  -1.682
  685    HE2  PHE  77           HE2      PHE  77   5.027   0.508   0.690
  686    HZ   PHE  77           HZ       PHE  77   5.910  -1.394  -0.595
  687    H    ALA  78           H        ALA  78   8.268   6.415  -0.873
  688    HA   ALA  78           HA       ALA  78   5.453   6.512  -1.094
  689    HB1  ALA  78           3HB      ALA  78   5.737   8.964  -1.022
  690    HB2  ALA  78           1HB      ALA  78   7.471   8.775  -1.327
  691    HB3  ALA  78           2HB      ALA  78   6.764   8.166   0.170
  692    H    ALA  79           H        ALA  79   8.052   7.348  -3.366
  693    HA   ALA  79           HA       ALA  79   6.450   8.232  -5.526
  694    HB1  ALA  79           3HB      ALA  79   9.264   7.085  -5.535
  695    HB2  ALA  79           1HB      ALA  79   8.834   8.782  -5.315
  696    HB3  ALA  79           2HB      ALA  79   8.518   7.985  -6.860
  697    H    ILE  80           H        ILE  80   7.705   5.045  -4.601
  698    HA   ILE  80           HA       ILE  80   6.973   3.537  -6.875
  699    HB   ILE  80           HB       ILE  80   7.262   2.666  -3.959
  700   HG12  ILE  80          2HG1      ILE  80   9.344   3.613  -4.821
  701   HG13  ILE  80          3HG1      ILE  80   9.534   1.873  -4.661
  702   HG21  ILE  80          1HG2      ILE  80   7.569   0.352  -4.777
  703   HG22  ILE  80          2HG2      ILE  80   7.190   0.882  -6.418
  704   HG23  ILE  80          3HG2      ILE  80   5.959   0.971  -5.158
  705   HD11  ILE  80          3HD1      ILE  80   9.071   3.402  -7.218
  706   HD12  ILE  80          1HD1      ILE  80   9.178   1.641  -7.094
  707   HD13  ILE  80          2HD1      ILE  80  10.567   2.643  -6.680
  708    H    LEU  81           H        LEU  81   5.246   4.228  -3.840
  709    HA   LEU  81           HA       LEU  81   2.999   2.568  -4.266
  710    HB2  LEU  81           2HB      LEU  81   3.528   4.952  -2.465
  711    HB3  LEU  81           3HB      LEU  81   1.983   4.116  -2.444
  712    HG   LEU  81           HG       LEU  81   4.613   2.686  -1.897
  713   HD11  LEU  81          1HD1      LEU  81   2.730   3.884   0.142
  714   HD12  LEU  81          2HD1      LEU  81   4.353   4.458  -0.242
  715   HD13  LEU  81          3HD1      LEU  81   4.133   2.869   0.487
  716   HD21  LEU  81          3HD2      LEU  81   3.184   0.984  -0.857
  717   HD22  LEU  81          1HD2      LEU  81   2.756   1.223  -2.550
  718   HD23  LEU  81          2HD2      LEU  81   1.741   1.910  -1.279
  719    H    ASN  82           H        ASN  82   3.594   6.020  -4.869
  720    HA   ASN  82           HA       ASN  82   0.956   6.840  -5.476
  721    HB2  ASN  82           2HB      ASN  82   3.086   8.261  -4.954
  722    HB3  ASN  82           3HB      ASN  82   3.448   8.137  -6.664
  723   HD21  ASN  82          1HD2      ASN  82   0.663   8.488  -7.604
  724   HD22  ASN  82          2HD2      ASN  82   0.262  10.118  -7.277
  725    H    LYS  83           H        LYS  83   3.510   5.420  -7.464
  726    HA   LYS  83           HA       LYS  83   2.237   5.642 -10.001
  727    HB2  LYS  83           2HB      LYS  83   4.386   3.713  -9.025
  728    HB3  LYS  83           3HB      LYS  83   3.861   3.831 -10.705
  729    HG2  LYS  83           2HG      LYS  83   5.154   6.057  -9.093
  730    HG3  LYS  83           3HG      LYS  83   5.961   5.062 -10.309
  731    HD2  LYS  83           2HD      LYS  83   4.471   5.971 -12.061
  732    HD3  LYS  83           3HD      LYS  83   3.611   6.932 -10.852
  733    HE2  LYS  83           2HE      LYS  83   5.223   8.309 -12.107
  734    HE3  LYS  83           3HE      LYS  83   5.663   8.222 -10.402
  735    HZ1  LYS  83           3HZ      LYS  83   7.341   6.597 -10.934
  736    HZ2  LYS  83           1HZ      LYS  83   7.567   7.971 -11.894
  737    HZ3  LYS  83           2HZ      LYS  83   6.879   6.575 -12.560
  738    H    VAL  84           H        VAL  84   2.266   3.053  -7.516
  739    HA   VAL  84           HA       VAL  84   1.063   1.050  -9.157
  740    HB   VAL  84           HB       VAL  84   1.334   1.219  -6.119
  741   HG11  VAL  84          1HG1      VAL  84  -0.523  -0.300  -6.641
  742   HG12  VAL  84          2HG1      VAL  84   0.866  -1.226  -6.076
  743   HG13  VAL  84          3HG1      VAL  84   0.485  -1.174  -7.796
  744   HG21  VAL  84          3HG2      VAL  84   3.197  -0.388  -6.432
  745   HG22  VAL  84          1HG2      VAL  84   3.490   1.119  -7.304
  746   HG23  VAL  84          2HG2      VAL  84   2.964  -0.319  -8.181
  747    H    PHE  85           H        PHE  85  -0.240   3.184  -6.624
  748    HA   PHE  85           HA       PHE  85  -2.946   2.397  -6.743
  749    HB2  PHE  85           2HB      PHE  85  -1.824   5.136  -5.995
  750    HB3  PHE  85           3HB      PHE  85  -3.464   4.588  -5.655
  751    HD1  PHE  85           HD1      PHE  85  -3.301   1.978  -4.531
  752    HD2  PHE  85           HD2      PHE  85  -0.528   5.200  -4.025
  753    HE1  PHE  85           HE1      PHE  85  -2.538   1.008  -2.400
  754    HE2  PHE  85           HE2      PHE  85   0.226   4.213  -1.908
  755    HZ   PHE  85           HZ       PHE  85  -0.773   2.120  -1.092
  756    H    ALA  86           H        ALA  86  -1.134   4.763  -8.662
  757    HA   ALA  86           HA       ALA  86  -3.304   5.798 -10.191
  758    HB1  ALA  86           3HB      ALA  86  -0.356   5.668 -10.900
  759    HB2  ALA  86           1HB      ALA  86  -1.144   6.962  -9.997
  760    HB3  ALA  86           2HB      ALA  86  -1.566   6.685 -11.690
  761    H    GLU  87           H        GLU  87  -1.321   2.935 -10.462
  762    HA   GLU  87           HA       GLU  87  -2.121   2.215 -13.165
  763    HB2  GLU  87           2HB      GLU  87  -0.512   0.741 -11.035
  764    HB3  GLU  87           3HB      GLU  87  -0.812   0.100 -12.650
  765    HG2  GLU  87           2HG      GLU  87   0.448   1.934 -13.661
  766    HG3  GLU  87           3HG      GLU  87   0.659   2.698 -12.088
  767    H    LEU  88           H        LEU  88  -3.663   2.117 -10.227
  768    HA   LEU  88           HA       LEU  88  -5.338  -0.238 -10.884
  769    HB2  LEU  88           2HB      LEU  88  -5.212   1.397  -8.309
  770    HB3  LEU  88           3HB      LEU  88  -6.228  -0.011  -8.576
  771    HG   LEU  88           HG       LEU  88  -3.187  -0.015  -8.443
  772   HD11  LEU  88          1HD1      LEU  88  -3.471  -1.242  -6.345
  773   HD12  LEU  88          2HD1      LEU  88  -5.225  -1.070  -6.465
  774   HD13  LEU  88          3HD1      LEU  88  -4.204   0.358  -6.263
  775   HD21  LEU  88          3HD2      LEU  88  -5.077  -2.373  -8.769
  776   HD22  LEU  88          1HD2      LEU  88  -3.331  -2.469  -8.510
  777   HD23  LEU  88          2HD2      LEU  88  -3.961  -1.751  -9.989
  778    H    GLY  89           H        GLY  89  -5.231   3.229 -10.683
  779    HA2  GLY  89           2HA      GLY  89  -6.876   4.305 -12.209
  780    HA3  GLY  89           3HA      GLY  89  -8.130   3.471 -11.307
  781    H    TYR  90           H        TYR  90  -6.256   4.070  -8.826
  782    HA   TYR  90           HA       TYR  90  -7.650   6.309  -7.820
  783    HB2  TYR  90           2HB      TYR  90  -4.964   5.184  -6.904
  784    HB3  TYR  90           3HB      TYR  90  -5.903   6.368  -6.010
  785    HD1  TYR  90           HD2      TYR  90  -8.304   5.653  -5.265
  786    HD2  TYR  90           HD1      TYR  90  -5.280   2.866  -6.463
  787    HE1  TYR  90           HE2      TYR  90  -9.471   3.859  -4.059
  788    HE2  TYR  90           HE1      TYR  90  -6.448   1.076  -5.242
  789    HH   TYR  90           HH       TYR  90  -8.053   0.812  -3.444
  790    H    ASN  91           H        ASN  91  -7.198   8.454  -7.773
  791    HA   ASN  91           HA       ASN  91  -5.195   9.555  -9.581
  792    HB2  ASN  91           2HB      ASN  91  -7.328  10.867  -7.827
  793    HB3  ASN  91           3HB      ASN  91  -6.228  11.772  -8.858
  794   HD21  ASN  91          1HD2      ASN  91  -7.791   8.697  -9.780
  795   HD22  ASN  91          2HD2      ASN  91  -8.779   9.393 -11.003
  796    H    ASP  92           H        ASP  92  -3.887  11.474  -8.735
  797    HA   ASP  92           HA       ASP  92  -2.052  10.574  -6.802
  798    HB2  ASP  92           2HB      ASP  92  -2.453  13.404  -7.880
  799    HB3  ASP  92           3HB      ASP  92  -1.038  12.855  -6.984
  800    H    SER  93           H        SER  93  -4.755  12.830  -6.568
  801    HA   SER  93           HA       SER  93  -4.358  13.853  -3.987
  802    HB2  SER  93           2HB      SER  93  -6.827  14.437  -4.126
  803    HB3  SER  93           3HB      SER  93  -5.861  14.962  -5.507
  804    HG   SER  93           HG       SER  93  -7.627  12.745  -5.352
  805    H    ASN  94           H        ASN  94  -5.774  10.772  -4.987
  806    HA   ASN  94           HA       ASN  94  -6.979  10.008  -2.537
  807    HB2  ASN  94           2HB      ASN  94  -5.660   8.296  -4.696
  808    HB3  ASN  94           3HB      ASN  94  -6.589   7.634  -3.353
  809   HD21  ASN  94          1HD2      ASN  94  -8.801   7.609  -3.495
  810   HD22  ASN  94          2HD2      ASN  94  -9.685   8.178  -4.866
  811    H    VAL  95           H        VAL  95  -3.647   9.956  -3.677
  812    HA   VAL  95           HA       VAL  95  -2.654   8.203  -1.572
  813    HB   VAL  95           HB       VAL  95  -1.115   9.672  -3.773
  814   HG11  VAL  95          1HG1      VAL  95  -0.305   7.225  -2.160
  815   HG12  VAL  95          2HG1      VAL  95   0.343   8.854  -1.960
  816   HG13  VAL  95          3HG1      VAL  95   0.634   7.966  -3.458
  817   HG21  VAL  95          3HG2      VAL  95  -2.289   6.865  -3.881
  818   HG22  VAL  95          1HG2      VAL  95  -1.256   7.596  -5.113
  819   HG23  VAL  95          2HG2      VAL  95  -2.860   8.266  -4.794
  820    H    THR  96           H        THR  96  -2.584   9.241   0.392
  821    HA   THR  96           HA       THR  96  -1.369  11.953   0.615
  822    HB   THR  96           HB       THR  96  -3.112  10.543   2.698
  823    HG1  THR  96           HG1      THR  96  -4.364  10.731   0.853
  824   HG21  THR  96          3HG2      THR  96  -1.806  12.503   3.529
  825   HG22  THR  96          1HG2      THR  96  -3.549  12.822   3.543
  826   HG23  THR  96          2HG2      THR  96  -2.534  13.507   2.274
  827    H    TRP  97           H        TRP  97   0.224  12.249   2.348
  828    HA   TRP  97           HA       TRP  97   1.221   9.781   3.653
  829    HB2  TRP  97           2HB      TRP  97   2.787  11.724   1.967
  830    HB3  TRP  97           3HB      TRP  97   3.573  11.140   3.427
  831    HD1  TRP  97           HD1      TRP  97   2.414   9.894  -0.026
  832    HE1  TRP  97           HE1      TRP  97   3.435   7.564  -0.427
  833    HE3  TRP  97           HE3      TRP  97   4.356   9.010   4.639
  834    HZ2  TRP  97           HZ2      TRP  97   4.873   5.621   1.026
  835    HZ3  TRP  97           HZ3      TRP  97   5.534   6.884   5.046
  836    HH2  TRP  97           HH2      TRP  97   5.786   5.220   3.272
  837    H    ASP  98           H        ASP  98   1.036   9.931   5.715
  838    HA   ASP  98           HA       ASP  98   1.658  12.285   7.289
  839    HB2  ASP  98           2HB      ASP  98  -0.663  12.389   8.315
  840    HB3  ASP  98           3HB      ASP  98  -0.607  12.895   6.629
  841    H    GLY  99           H        GLY  99   2.533  11.591   9.163
  842    HA2  GLY  99           2HA      GLY  99   3.140  10.313  10.969
  843    HA3  GLY  99           3HA      GLY  99   1.542   9.575  10.879
  844    H    ASP 100           H        ASP 100   4.320   9.566   8.679
  845    HA   ASP 100           HA       ASP 100   5.452   8.059   7.494
  846    HB2  ASP 100           2HB      ASP 100   6.672   6.447   8.627
  847    HB3  ASP 100           3HB      ASP 100   6.152   7.459   9.956
  848    H    THR 101           H        THR 101   2.393   7.869   7.590
  849    HA   THR 101           HA       THR 101   1.942   5.150   6.505
  850    HB   THR 101           HB       THR 101  -0.068   7.141   7.668
  851    HG1  THR 101           HG1      THR 101   1.617   6.011   9.082
  852   HG21  THR 101          3HG2      THR 101  -1.634   5.233   7.738
  853   HG22  THR 101          1HG2      THR 101  -0.421   4.201   6.966
  854   HG23  THR 101          2HG2      THR 101  -1.122   5.558   6.081
  855    H    VAL 102           H        VAL 102   1.040   5.007   4.408
  856    HA   VAL 102           HA       VAL 102   0.368   7.508   3.010
  857    HB   VAL 102           HB       VAL 102   1.852   6.082   1.713
  858   HG11  VAL 102          1HG1      VAL 102   1.240   3.842   0.904
  859   HG12  VAL 102          2HG1      VAL 102  -0.220   3.877   1.894
  860   HG13  VAL 102          3HG1      VAL 102   1.368   3.888   2.664
  861   HG21  VAL 102          3HG2      VAL 102   0.560   5.875  -0.381
  862   HG22  VAL 102          1HG2      VAL 102   0.191   7.384   0.463
  863   HG23  VAL 102          2HG2      VAL 102  -0.945   6.035   0.529
  864    H    THR 103           H        THR 103  -1.654   8.140   3.378
  865    HA   THR 103           HA       THR 103  -3.811   6.248   3.963
  866    HB   THR 103           HB       THR 103  -3.665   9.293   4.147
  867    HG1  THR 103           HG1      THR 103  -2.814   8.802   6.010
  868   HG21  THR 103          3HG2      THR 103  -5.861   9.172   5.300
  869   HG22  THR 103          1HG2      THR 103  -5.957   7.448   4.924
  870   HG23  THR 103          2HG2      THR 103  -5.978   8.640   3.622
  871    H    VAL 104           H        VAL 104  -4.438   5.410   2.010
  872    HA   VAL 104           HA       VAL 104  -5.051   7.183  -0.247
  873    HB   VAL 104           HB       VAL 104  -5.184   4.128  -0.082
  874   HG11  VAL 104          1HG1      VAL 104  -5.312   5.954  -2.518
  875   HG12  VAL 104          2HG1      VAL 104  -6.658   5.031  -1.846
  876   HG13  VAL 104          3HG1      VAL 104  -5.279   4.188  -2.556
  877   HG21  VAL 104          3HG2      VAL 104  -2.881   4.937   0.225
  878   HG22  VAL 104          1HG2      VAL 104  -3.006   5.898  -1.253
  879   HG23  VAL 104          2HG2      VAL 104  -3.063   4.137  -1.337
  880    H    GLU 105           H        GLU 105  -6.981   8.138  -0.023
  881    HA   GLU 105           HA       GLU 105  -9.297   6.573   0.961
  882    HB2  GLU 105           2HB      GLU 105  -8.764   8.320   2.600
  883    HB3  GLU 105           3HB      GLU 105  -8.732   9.552   1.338
  884    HG2  GLU 105           2HG      GLU 105 -11.151   9.239   0.947
  885    HG3  GLU 105           3HG      GLU 105 -11.188   7.950   2.154
  886    H    GLY 106           H        GLY 106 -10.911   6.418  -0.430
  887    HA2  GLY 106           2HA      GLY 106 -11.421   8.308  -2.562
  888    HA3  GLY 106           3HA      GLY 106 -10.756   6.767  -3.107
  889    H    GLN 107           H        GLN 107 -12.850   6.720  -4.232
  890    HA   GLN 107           HA       GLN 107 -14.901   5.425  -2.539
  891    HB2  GLN 107           2HB      GLN 107 -15.753   7.628  -3.188
  892    HB3  GLN 107           3HB      GLN 107 -15.395   7.305  -4.884
  893    HG2  GLN 107           2HG      GLN 107 -17.068   5.449  -4.857
  894    HG3  GLN 107           3HG      GLN 107 -17.434   5.834  -3.173
  895   HE21  GLN 107          1HE2      GLN 107 -17.533   7.040  -6.459
  896   HE22  GLN 107          2HE2      GLN 107 -18.815   8.176  -6.214
  897    H    LEU 108           H        LEU 108 -14.916   3.382  -3.038
  898    HA   LEU 108           HA       LEU 108 -14.424   2.193  -5.590
  899    HB2  LEU 108           2HB      LEU 108 -14.328   1.204  -3.153
  900    HB3  LEU 108           3HB      LEU 108 -16.055   0.987  -3.317
  901    HG   LEU 108           HG       LEU 108 -14.048  -0.300  -5.213
  902   HD11  LEU 108          1HD1      LEU 108 -14.251  -2.337  -3.883
  903   HD12  LEU 108          2HD1      LEU 108 -15.278  -1.507  -2.715
  904   HD13  LEU 108          3HD1      LEU 108 -13.588  -1.028  -2.907
  905   HD21  LEU 108          3HD2      LEU 108 -15.892  -1.860  -5.724
  906   HD22  LEU 108          1HD2      LEU 108 -16.349  -0.196  -6.098
  907   HD23  LEU 108          2HD2      LEU 108 -16.962  -0.972  -4.635
  908    H    GLU 109           H        GLU 109 -15.869   1.972  -7.248
  909    HA   GLU 109           HA       GLU 109 -18.089   3.642  -7.458
  910    HB2  GLU 109           2HB      GLU 109 -16.815   2.876  -9.406
  911    HB3  GLU 109           3HB      GLU 109 -17.372   1.223  -9.160
  912    HG2  GLU 109           2HG      GLU 109 -19.667   1.876  -9.682
  913    HG3  GLU 109           3HG      GLU 109 -19.194   3.569  -9.801
  914    H    GLY 110           H        GLY 110 -19.796   3.455  -6.187
  915    HA2  GLY 110           2HA      GLY 110 -21.706   1.337  -6.438
  916    HA3  GLY 110           3HA      GLY 110 -20.899   1.308  -4.868
  917    H    VAL 111           H        VAL 111 -21.913   4.006  -6.968
  918    HA   VAL 111           HA       VAL 111 -22.666   5.584  -4.664
  919    HB   VAL 111           HB       VAL 111 -23.040   6.456  -7.555
  920   HG11  VAL 111          1HG1      VAL 111 -24.013   7.943  -5.853
  921   HG12  VAL 111          2HG1      VAL 111 -22.642   8.726  -6.641
  922   HG13  VAL 111          3HG1      VAL 111 -22.457   8.043  -5.023
  923   HG21  VAL 111          3HG2      VAL 111 -20.452   6.590  -5.967
  924   HG22  VAL 111          1HG2      VAL 111 -20.732   7.339  -7.544
  925   HG23  VAL 111          2HG2      VAL 111 -20.753   5.581  -7.385
  926    H    ASP 112           H        ASP 112 -24.376   4.251  -3.959
  927    HA   ASP 112           HA       ASP 112 -26.943   5.256  -4.501
  928    HB2  ASP 112           2HB      ASP 112 -26.868   3.699  -6.460
  929    HB3  ASP 112           3HB      ASP 112 -26.521   2.355  -5.381
  930    H    LEU 113           H        LEU 113 -24.926   2.724  -3.217
  931    HA   LEU 113           HA       LEU 113 -26.528   1.951  -0.997
  932    HB2  LEU 113           2HB      LEU 113 -23.507   1.724  -1.320
  933    HB3  LEU 113           3HB      LEU 113 -24.495   0.830  -0.170
  934    HG   LEU 113           HG       LEU 113 -24.555   0.532  -3.205
  935   HD11  LEU 113          1HD1      LEU 113 -23.648  -1.707  -2.825
  936   HD12  LEU 113          2HD1      LEU 113 -23.554  -1.396  -1.089
  937   HD13  LEU 113          3HD1      LEU 113 -22.562  -0.460  -2.212
  938   HD21  LEU 113          3HD2      LEU 113 -26.798   0.204  -2.331
  939   HD22  LEU 113          1HD2      LEU 113 -26.205  -0.934  -1.117
  940   HD23  LEU 113          2HD2      LEU 113 -26.121  -1.341  -2.834
  941    H    GLU 114           H        GLU 114 -27.220   3.913  -0.120
  942    HA   GLU 114           HA       GLU 114 -25.477   5.979   0.813
  943    HB2  GLU 114           2HB      GLU 114 -27.791   6.606   2.108
  944    HB3  GLU 114           3HB      GLU 114 -27.489   6.997   0.427
  945    HG2  GLU 114           2HG      GLU 114 -29.735   6.124   0.694
  946    HG3  GLU 114           3HG      GLU 114 -28.771   5.033  -0.295
  947    H    HIS 115           H        HIS 115 -24.931   6.552   2.903
  948    HA   HIS 115           HA       HIS 115 -24.194   4.401   4.585
  949    HB2  HIS 115           2HB      HIS 115 -23.120   6.089   6.012
  950    HB3  HIS 115           3HB      HIS 115 -22.794   6.452   4.325
  951    HD1  HIS 115           HD1      HIS 115 -23.531   8.156   7.315
  952    HD2  HIS 115           HD2      HIS 115 -24.917   8.551   3.418
  953    HE1  HIS 115           HE1      HIS 115 -24.553  10.439   7.188
  954    HE2  HIS 115           HE2      HIS 115 -25.209  10.715   4.779
  955    H    HIS 116           H        HIS 116 -25.984   3.308   5.389
  956    HA   HIS 116           HA       HIS 116 -28.096   4.515   6.894
  957    HB2  HIS 116           2HB      HIS 116 -27.098   1.645   6.752
  958    HB3  HIS 116           3HB      HIS 116 -28.394   2.114   7.847
  959    HD1  HIS 116           HD1      HIS 116 -30.696   2.532   6.856
  960    HD2  HIS 116           HD2      HIS 116 -27.799   1.742   3.997
  961    HE1  HIS 116           HE1      HIS 116 -31.951   2.131   4.725
  962    HE2  HIS 116           HE2      HIS 116 -30.149   1.981   2.983
  963    H    HIS 117           H        HIS 117 -24.815   3.651   7.684
  964    HA   HIS 117           HA       HIS 117 -24.970   4.192  10.481
  965    HB2  HIS 117           2HB      HIS 117 -22.679   4.422   8.485
  966    HB3  HIS 117           3HB      HIS 117 -22.481   4.846  10.181
  967    HD1  HIS 117           HD1      HIS 117 -22.211   2.951  11.853
  968    HD2  HIS 117           HD2      HIS 117 -23.075   1.603   8.021
  969    HE1  HIS 117           HE1      HIS 117 -21.808   0.475  11.896
  970    HE2  HIS 117           HE2      HIS 117 -22.508  -0.334   9.622
  971    H    HIS 118           H        HIS 118 -26.422   5.862  10.646
  972    HA   HIS 118           HA       HIS 118 -25.326   8.517  10.725
  973    HB2  HIS 118           2HB      HIS 118 -26.900   9.673   9.283
  974    HB3  HIS 118           3HB      HIS 118 -26.188   8.387   8.316
  975    HD1  HIS 118           HD1      HIS 118 -29.418   9.458   9.913
  976    HD2  HIS 118           HD2      HIS 118 -28.015   6.421   7.454
  977    HE1  HIS 118           HE1      HIS 118 -31.452   8.260   9.073
  978    HE2  HIS 118           HE2      HIS 118 -30.559   6.318   7.767
  979    H    HIS 119           H        HIS 119 -27.105  10.040  11.631
  980    HA   HIS 119           HA       HIS 119 -28.206   8.736  13.958
  981    HB2  HIS 119           2HB      HIS 119 -27.096  10.945  14.115
  982    HB3  HIS 119           3HB      HIS 119 -28.347  11.653  13.099
  983    HD1  HIS 119           HD1      HIS 119 -30.292  12.643  14.316
  984    HD2  HIS 119           HD2      HIS 119 -28.225   9.908  16.677
  985    HE1  HIS 119           HE1      HIS 119 -31.359  12.754  16.589
  986    HE2  HIS 119           HE2      HIS 119 -30.009  11.185  18.019
  987    H    HIS 120           H        HIS 120 -30.210   8.005  14.185
  988    HA   HIS 120           HA       HIS 120 -32.518   9.273  12.933
  989    HB2  HIS 120           2HB      HIS 120 -32.045   7.563  11.265
  990    HB3  HIS 120           3HB      HIS 120 -31.814   6.330  12.500
  991    HD1  HIS 120           HD1      HIS 120 -33.753   4.831  12.784
  992    HD2  HIS 120           HD2      HIS 120 -34.937   8.549  11.344
  993    HE1  HIS 120           HE1      HIS 120 -36.226   4.656  12.406
  994    HE2  HIS 120           HE2      HIS 120 -36.936   6.952  11.671
  Start of MODEL   19
    1    H1   MET   1           1H       MET   1  23.842  -9.098   0.358
    2    H2   MET   1           2H       MET   1  23.969  -8.556  -1.238
    3    H3   MET   1           3H       MET   1  23.090  -9.957  -0.886
    4    HA   MET   1           HA       MET   1  21.459  -8.729   0.311
    5    HB2  MET   1           2HB      MET   1  23.033  -6.997   1.183
    6    HB3  MET   1           3HB      MET   1  23.123  -6.278  -0.418
    7    HG2  MET   1           2HG      MET   1  21.659  -4.957   0.989
    8    HG3  MET   1           3HG      MET   1  20.700  -5.727  -0.272
    9    HE1  MET   1           3HE      MET   1  20.739  -7.144   4.142
   10    HE2  MET   1           1HE      MET   1  21.653  -5.752   3.567
   11    HE3  MET   1           2HE      MET   1  22.120  -7.380   3.070
   12    H    SER   2           H        SER   2  20.752  -9.934  -1.603
   13    HA   SER   2           HA       SER   2  20.634  -8.596  -4.182
   14    HB2  SER   2           2HB      SER   2  19.528 -11.287  -3.284
   15    HB3  SER   2           3HB      SER   2  19.615 -10.716  -4.953
   16    HG   SER   2           HG       SER   2  21.537 -11.533  -4.970
   17    H    GLY   3           H        GLY   3  19.337  -6.928  -2.598
   18    HA2  GLY   3           2HA      GLY   3  17.266  -5.849  -3.437
   19    HA3  GLY   3           3HA      GLY   3  16.442  -7.364  -3.110
   20    H    LYS   4           H        LYS   4  14.998  -6.741  -1.593
   21    HA   LYS   4           HA       LYS   4  15.849  -5.805   1.019
   22    HB2  LYS   4           2HB      LYS   4  15.701  -3.686  -0.265
   23    HB3  LYS   4           3HB      LYS   4  14.084  -4.099  -0.808
   24    HG2  LYS   4           2HG      LYS   4  13.690  -2.515   0.849
   25    HG3  LYS   4           3HG      LYS   4  13.430  -4.029   1.708
   26    HD2  LYS   4           2HD      LYS   4  16.040  -2.463   1.806
   27    HD3  LYS   4           3HD      LYS   4  14.728  -2.230   2.954
   28    HE2  LYS   4           2HE      LYS   4  14.948  -4.577   3.683
   29    HE3  LYS   4           3HE      LYS   4  16.268  -4.808   2.535
   30    HZ1  LYS   4           3HZ      LYS   4  17.083  -4.382   4.779
   31    HZ2  LYS   4           1HZ      LYS   4  16.285  -2.894   4.809
   32    HZ3  LYS   4           2HZ      LYS   4  17.554  -3.148   3.725
   33    H    LYS   5           H        LYS   5  14.571  -6.807   2.501
   34    HA   LYS   5           HA       LYS   5  11.852  -7.707   1.809
   35    HB2  LYS   5           2HB      LYS   5  13.395  -9.308   3.008
   36    HB3  LYS   5           3HB      LYS   5  13.439  -8.198   4.373
   37    HG2  LYS   5           2HG      LYS   5  10.857  -8.462   4.440
   38    HG3  LYS   5           3HG      LYS   5  11.095  -9.836   3.358
   39    HD2  LYS   5           2HD      LYS   5  10.933 -10.652   5.644
   40    HD3  LYS   5           3HD      LYS   5  12.593 -10.882   5.086
   41    HE2  LYS   5           2HE      LYS   5  13.348  -8.969   6.369
   42    HE3  LYS   5           3HE      LYS   5  11.691  -8.514   6.755
   43    HZ1  LYS   5           3HZ      LYS   5  11.472 -10.562   8.033
   44    HZ2  LYS   5           1HZ      LYS   5  12.721  -9.596   8.630
   45    HZ3  LYS   5           2HZ      LYS   5  13.075 -10.963   7.706
   46    H    VAL   6           H        VAL   6  10.069  -6.804   2.768
   47    HA   VAL   6           HA       VAL   6  10.330  -4.808   4.912
   48    HB   VAL   6           HB       VAL   6  10.440  -3.405   2.909
   49   HG11  VAL   6          1HG1      VAL   6   9.434  -4.941   1.265
   50   HG12  VAL   6          2HG1      VAL   6   8.700  -3.339   1.189
   51   HG13  VAL   6          3HG1      VAL   6   7.841  -4.668   1.975
   52   HG21  VAL   6          3HG2      VAL   6   9.160  -2.549   4.817
   53   HG22  VAL   6          1HG2      VAL   6   7.677  -3.214   4.128
   54   HG23  VAL   6          2HG2      VAL   6   8.544  -1.925   3.287
   55    H    GLU   7           H        GLU   7   8.433  -4.622   6.197
   56    HA   GLU   7           HA       GLU   7   6.284  -6.569   5.600
   57    HB2  GLU   7           2HB      GLU   7   6.935  -5.349   8.317
   58    HB3  GLU   7           3HB      GLU   7   5.673  -6.519   7.975
   59    HG2  GLU   7           2HG      GLU   7   7.376  -7.793   8.955
   60    HG3  GLU   7           3HG      GLU   7   7.544  -8.101   7.231
   61    H    VAL   8           H        VAL   8   4.527  -5.707   4.870
   62    HA   VAL   8           HA       VAL   8   3.957  -2.817   5.134
   63    HB   VAL   8           HB       VAL   8   3.026  -4.872   3.054
   64   HG11  VAL   8          1HG1      VAL   8   2.021  -2.994   1.819
   65   HG12  VAL   8          2HG1      VAL   8   2.458  -1.888   3.122
   66   HG13  VAL   8          3HG1      VAL   8   1.278  -3.168   3.413
   67   HG21  VAL   8          3HG2      VAL   8   4.446  -3.622   1.468
   68   HG22  VAL   8          1HG2      VAL   8   5.404  -4.256   2.812
   69   HG23  VAL   8          2HG2      VAL   8   4.964  -2.546   2.768
   70    H    GLN   9           H        GLN   9   2.200  -2.258   6.395
   71    HA   GLN   9           HA       GLN   9   0.171  -4.329   7.034
   72    HB2  GLN   9           2HB      GLN   9   0.872  -1.812   8.621
   73    HB3  GLN   9           3HB      GLN   9  -0.358  -2.997   9.054
   74    HG2  GLN   9           2HG      GLN   9   1.489  -4.725   9.197
   75    HG3  GLN   9           3HG      GLN   9   2.642  -3.404   9.003
   76   HE21  GLN   9          1HE2      GLN   9   0.367  -4.925  11.148
   77   HE22  GLN   9          2HE2      GLN   9   0.780  -4.027  12.564
   78    H    VAL  10           H        VAL  10  -1.384  -4.075   5.522
   79    HA   VAL  10           HA       VAL  10  -2.279  -1.398   4.682
   80    HB   VAL  10           HB       VAL  10  -3.007  -4.177   3.620
   81   HG11  VAL  10          1HG1      VAL  10  -4.129  -3.025   1.742
   82   HG12  VAL  10          2HG1      VAL  10  -3.834  -1.469   2.521
   83   HG13  VAL  10          3HG1      VAL  10  -4.900  -2.650   3.287
   84   HG21  VAL  10          3HG2      VAL  10  -1.241  -2.016   2.412
   85   HG22  VAL  10          1HG2      VAL  10  -1.672  -3.543   1.633
   86   HG23  VAL  10          2HG2      VAL  10  -0.692  -3.547   3.102
   87    H    LYS  11           H        LYS  11  -3.809  -0.499   5.952
   88    HA   LYS  11           HA       LYS  11  -5.807  -2.208   7.331
   89    HB2  LYS  11           2HB      LYS  11  -4.391  -0.780   8.811
   90    HB3  LYS  11           3HB      LYS  11  -4.869   0.650   7.901
   91    HG2  LYS  11           2HG      LYS  11  -7.268   0.144   8.602
   92    HG3  LYS  11           3HG      LYS  11  -6.605  -1.067   9.698
   93    HD2  LYS  11           2HD      LYS  11  -5.912   1.897   9.759
   94    HD3  LYS  11           3HD      LYS  11  -7.111   1.130  10.797
   95    HE2  LYS  11           2HE      LYS  11  -5.312  -0.299  11.765
   96    HE3  LYS  11           3HE      LYS  11  -4.125   0.556  10.773
   97    HZ1  LYS  11           3HZ      LYS  11  -5.895   1.878  12.773
   98    HZ2  LYS  11           1HZ      LYS  11  -4.628   2.594  11.917
   99    HZ3  LYS  11           2HZ      LYS  11  -4.301   1.413  13.080
  100    H    ILE  12           H        ILE  12  -7.547  -2.344   5.915
  101    HA   ILE  12           HA       ILE  12  -8.545   0.148   4.640
  102    HB   ILE  12           HB       ILE  12  -7.743  -1.366   2.922
  103   HG12  ILE  12          2HG1      ILE  12 -10.790  -1.481   2.936
  104   HG13  ILE  12          3HG1      ILE  12  -9.843  -0.075   2.460
  105   HG21  ILE  12          1HG2      ILE  12  -7.814  -3.503   4.122
  106   HG22  ILE  12          2HG2      ILE  12  -8.607  -3.636   2.552
  107   HG23  ILE  12          3HG2      ILE  12  -9.578  -3.516   4.022
  108   HD11  ILE  12          3HD1      ILE  12 -10.645  -1.274   0.520
  109   HD12  ILE  12          1HD1      ILE  12  -9.856  -2.756   1.062
  110   HD13  ILE  12          2HD1      ILE  12  -8.887  -1.354   0.597
  111    H    THR  13           H        THR  13 -10.364   0.858   5.493
  112    HA   THR  13           HA       THR  13 -12.069  -0.921   7.114
  113    HB   THR  13           HB       THR  13 -11.802   2.118   7.165
  114    HG1  THR  13           HG1      THR  13 -10.971   0.644   9.364
  115   HG21  THR  13          3HG2      THR  13 -14.020   1.382   7.965
  116   HG22  THR  13          1HG2      THR  13 -13.037   2.007   9.296
  117   HG23  THR  13          2HG2      THR  13 -13.246   0.266   9.094
  118    H    CYS  14           H        CYS  14 -14.149  -1.245   6.600
  119    HA   CYS  14           HA       CYS  14 -15.807   0.634   5.220
  120    HB2  CYS  14           2HB      CYS  14 -14.812  -0.330   3.228
  121    HB3  CYS  14           3HB      CYS  14 -15.110  -1.972   3.804
  122    H    ASN  15           H        ASN  15 -17.914   0.364   5.702
  123    HA   ASN  15           HA       ASN  15 -19.881  -0.364   6.514
  124    HB2  ASN  15           2HB      ASN  15 -18.753  -3.052   5.632
  125    HB3  ASN  15           3HB      ASN  15 -20.419  -2.833   6.160
  126   HD21  ASN  15          1HD2      ASN  15 -19.338  -3.668   3.553
  127   HD22  ASN  15          2HD2      ASN  15 -20.002  -2.574   2.394
  128    H    GLY  16           H        GLY  16 -17.733  -0.006   8.393
  129    HA2  GLY  16           2HA      GLY  16 -17.838   0.022  10.721
  130    HA3  GLY  16           3HA      GLY  16 -19.011  -1.281  10.688
  131    H    LYS  17           H        LYS  17 -16.564  -2.290   8.723
  132    HA   LYS  17           HA       LYS  17 -15.101  -3.630  10.929
  133    HB2  LYS  17           2HB      LYS  17 -16.026  -4.684   8.235
  134    HB3  LYS  17           3HB      LYS  17 -14.600  -5.381   8.989
  135    HG2  LYS  17           2HG      LYS  17 -17.378  -5.306  10.200
  136    HG3  LYS  17           3HG      LYS  17 -16.607  -6.706   9.455
  137    HD2  LYS  17           2HD      LYS  17 -15.691  -5.279  11.983
  138    HD3  LYS  17           3HD      LYS  17 -16.471  -6.858  11.897
  139    HE2  LYS  17           2HE      LYS  17 -14.533  -7.792  10.728
  140    HE3  LYS  17           3HE      LYS  17 -13.763  -6.202  10.683
  141    HZ1  LYS  17           3HZ      LYS  17 -12.859  -7.511  12.480
  142    HZ2  LYS  17           1HZ      LYS  17 -14.395  -7.767  13.132
  143    HZ3  LYS  17           2HZ      LYS  17 -13.731  -6.215  13.122
  144    H    THR  18           H        THR  18 -12.909  -3.825  10.782
  145    HA   THR  18           HA       THR  18 -11.492  -2.288   8.685
  146    HB   THR  18           HB       THR  18 -10.774  -2.746  11.620
  147    HG1  THR  18           HG1      THR  18 -12.322  -1.024  10.965
  148   HG21  THR  18          3HG2      THR  18  -8.761  -1.357  11.202
  149   HG22  THR  18          1HG2      THR  18  -9.128  -1.341   9.477
  150   HG23  THR  18          2HG2      THR  18  -8.704  -2.859  10.275
  151    H    TYR  19           H        TYR  19 -10.083  -3.414   7.493
  152    HA   TYR  19           HA       TYR  19  -9.378  -6.200   8.223
  153    HB2  TYR  19           2HB      TYR  19  -9.666  -4.941   5.448
  154    HB3  TYR  19           3HB      TYR  19  -9.283  -6.629   5.781
  155    HD1  TYR  19           HD1      TYR  19 -11.040  -8.180   6.587
  156    HD2  TYR  19           HD2      TYR  19 -11.968  -4.092   5.753
  157    HE1  TYR  19           HE1      TYR  19 -13.441  -8.696   6.697
  158    HE2  TYR  19           HE2      TYR  19 -14.362  -4.608   5.856
  159    HH   TYR  19           HH       TYR  19 -15.852  -6.544   5.629
  160    H    GLU  20           H        GLU  20  -7.418  -5.943   9.165
  161    HA   GLU  20           HA       GLU  20  -5.286  -4.597   7.631
  162    HB2  GLU  20           2HB      GLU  20  -4.314  -3.809   9.815
  163    HB3  GLU  20           3HB      GLU  20  -5.823  -3.053   9.353
  164    HG2  GLU  20           2HG      GLU  20  -6.113  -3.345  11.629
  165    HG3  GLU  20           3HG      GLU  20  -6.942  -4.752  10.973
  166    H    ARG  21           H        ARG  21  -3.268  -5.530   7.684
  167    HA   ARG  21           HA       ARG  21  -2.731  -8.006   9.066
  168    HB2  ARG  21           2HB      ARG  21  -4.250  -8.890   7.366
  169    HB3  ARG  21           3HB      ARG  21  -3.407  -8.030   6.086
  170    HG2  ARG  21           2HG      ARG  21  -2.884 -10.420   6.025
  171    HG3  ARG  21           3HG      ARG  21  -1.439  -9.472   6.384
  172    HD2  ARG  21           2HD      ARG  21  -1.763 -10.012   8.802
  173    HD3  ARG  21           3HD      ARG  21  -3.108 -11.063   8.351
  174    HE   ARG  21           HE       ARG  21  -0.745 -11.727   6.916
  175   HH11  ARG  21          1HH1      ARG  21  -2.224 -12.120  10.082
  176   HH12  ARG  21          2HH1      ARG  21  -1.345 -13.572  10.436
  177   HH21  ARG  21          1HH2      ARG  21   0.399 -13.623   7.409
  178   HH22  ARG  21          2HH2      ARG  21   0.131 -14.419   8.931
  179    H    THR  22           H        THR  22  -0.562  -8.573   8.961
  180    HA   THR  22           HA       THR  22   1.306  -6.640   7.774
  181    HB   THR  22           HB       THR  22   1.844  -8.851   9.810
  182    HG1  THR  22           HG1      THR  22   0.356  -6.819  10.219
  183   HG21  THR  22          3HG2      THR  22   3.883  -7.556  10.346
  184   HG22  THR  22          1HG2      THR  22   3.480  -6.378   9.098
  185   HG23  THR  22          2HG2      THR  22   3.892  -8.034   8.646
  186    H    TYR  23           H        TYR  23   1.918  -7.205   5.764
  187    HA   TYR  23           HA       TYR  23   2.249 -10.011   4.912
  188    HB2  TYR  23           2HB      TYR  23   2.408  -7.587   3.060
  189    HB3  TYR  23           3HB      TYR  23   1.976  -9.245   2.657
  190    HD1  TYR  23           HD2      TYR  23  -0.337 -10.085   3.146
  191    HD2  TYR  23           HD1      TYR  23   0.770  -6.036   3.910
  192    HE1  TYR  23           HE2      TYR  23  -2.708  -9.468   3.389
  193    HE2  TYR  23           HE1      TYR  23  -1.578  -5.425   4.141
  194    HH   TYR  23           HH       TYR  23  -4.038  -7.640   4.515
  195    H    GLN  24           H        GLN  24   4.276 -10.749   4.284
  196    HA   GLN  24           HA       GLN  24   6.581  -8.919   4.680
  197    HB2  GLN  24           2HB      GLN  24   6.380 -11.961   4.880
  198    HB3  GLN  24           3HB      GLN  24   7.915 -11.103   4.836
  199    HG2  GLN  24           2HG      GLN  24   7.435 -11.587   7.134
  200    HG3  GLN  24           3HG      GLN  24   7.227  -9.856   6.897
  201   HE21  GLN  24          1HE2      GLN  24   5.851  -9.564   8.651
  202   HE22  GLN  24          2HE2      GLN  24   4.244 -10.200   8.705
  203    H    LEU  25           H        LEU  25   7.222  -8.087   2.829
  204    HA   LEU  25           HA       LEU  25   6.984  -9.572   0.286
  205    HB2  LEU  25           2HB      LEU  25   6.973  -6.550   0.738
  206    HB3  LEU  25           3HB      LEU  25   6.825  -7.351  -0.818
  207    HG   LEU  25           HG       LEU  25   4.781  -7.391   1.436
  208   HD11  LEU  25          1HD1      LEU  25   4.659  -6.097  -1.311
  209   HD12  LEU  25          2HD1      LEU  25   4.838  -5.266   0.237
  210   HD13  LEU  25          3HD1      LEU  25   3.352  -6.139  -0.121
  211   HD21  LEU  25          3HD2      LEU  25   4.639  -8.772  -1.265
  212   HD22  LEU  25          1HD2      LEU  25   3.313  -8.631  -0.105
  213   HD23  LEU  25          2HD2      LEU  25   4.753  -9.551   0.317
  214    H    TYR  26           H        TYR  26   9.033 -10.498   0.237
  215    HA   TYR  26           HA       TYR  26  11.403  -8.753   0.219
  216    HB2  TYR  26           2HB      TYR  26  11.667 -10.975   1.278
  217    HB3  TYR  26           3HB      TYR  26  11.147 -11.775  -0.200
  218    HD1  TYR  26           HD1      TYR  26  13.905  -9.778   1.325
  219    HD2  TYR  26           HD2      TYR  26  12.742 -12.162  -2.031
  220    HE1  TYR  26           HE1      TYR  26  16.234  -9.828   0.553
  221    HE2  TYR  26           HE2      TYR  26  15.077 -12.213  -2.802
  222    HH   TYR  26           HH       TYR  26  17.143 -10.913  -2.545
  223    H    ALA  27           H        ALA  27  12.376  -8.097  -1.623
  224    HA   ALA  27           HA       ALA  27  11.599  -9.173  -4.261
  225    HB1  ALA  27           3HB      ALA  27  10.145  -7.236  -3.894
  226    HB2  ALA  27           1HB      ALA  27  11.353  -6.849  -5.118
  227    HB3  ALA  27           2HB      ALA  27  11.534  -6.233  -3.474
  228    H    VAL  28           H        VAL  28  13.247  -8.920  -5.825
  229    HA   VAL  28           HA       VAL  28  15.933  -8.442  -4.842
  230    HB   VAL  28           HB       VAL  28  15.005  -9.081  -7.684
  231   HG11  VAL  28          1HG1      VAL  28  17.232  -8.033  -7.679
  232   HG12  VAL  28          2HG1      VAL  28  17.358  -9.741  -8.102
  233   HG13  VAL  28          3HG1      VAL  28  17.800  -9.199  -6.481
  234   HG21  VAL  28          3HG2      VAL  28  16.074 -10.959  -5.537
  235   HG22  VAL  28          1HG2      VAL  28  15.681 -11.411  -7.200
  236   HG23  VAL  28          2HG2      VAL  28  14.404 -10.881  -6.102
  237    H    ARG  29           H        ARG  29  13.648  -6.841  -7.016
  238    HA   ARG  29           HA       ARG  29  15.281  -4.369  -6.918
  239    HB2  ARG  29           2HB      ARG  29  13.405  -5.307  -9.136
  240    HB3  ARG  29           3HB      ARG  29  14.107  -3.695  -9.050
  241    HG2  ARG  29           2HG      ARG  29  16.381  -4.707  -9.237
  242    HG3  ARG  29           3HG      ARG  29  15.630  -6.297  -9.417
  243    HD2  ARG  29           2HD      ARG  29  14.526  -5.604 -11.467
  244    HD3  ARG  29           3HD      ARG  29  15.080  -3.942 -11.262
  245    HE   ARG  29           HE       ARG  29  16.902  -6.224 -11.761
  246   HH11  ARG  29          1HH1      ARG  29  15.990  -2.864 -12.352
  247   HH12  ARG  29          2HH1      ARG  29  17.306  -2.583 -13.450
  248   HH21  ARG  29          1HH2      ARG  29  18.575  -5.838 -13.257
  249   HH22  ARG  29          2HH2      ARG  29  18.766  -4.262 -13.960
  250    H    ASP  30           H        ASP  30  14.051  -2.387  -6.933
  251    HA   ASP  30           HA       ASP  30  11.762  -2.256  -5.273
  252    HB2  ASP  30           2HB      ASP  30  11.727   0.141  -5.878
  253    HB3  ASP  30           3HB      ASP  30  13.355  -0.392  -5.485
  254    H    GLU  31           H        GLU  31  12.214  -2.321  -8.789
  255    HA   GLU  31           HA       GLU  31   9.623  -1.922  -9.727
  256    HB2  GLU  31           2HB      GLU  31  11.906  -3.637 -10.766
  257    HB3  GLU  31           3HB      GLU  31  10.402  -3.463 -11.662
  258    HG2  GLU  31           2HG      GLU  31  12.142  -1.109 -10.863
  259    HG3  GLU  31           3HG      GLU  31  12.308  -1.966 -12.393
  260    H    GLU  32           H        GLU  32  11.138  -4.874  -8.475
  261    HA   GLU  32           HA       GLU  32   8.994  -6.653  -9.034
  262    HB2  GLU  32           2HB      GLU  32  11.140  -6.898  -6.891
  263    HB3  GLU  32           3HB      GLU  32  10.137  -8.210  -7.496
  264    HG2  GLU  32           2HG      GLU  32  12.255  -6.686  -9.034
  265    HG3  GLU  32           3HG      GLU  32  12.392  -8.326  -8.417
  266    H    LEU  33           H        LEU  33   9.862  -4.678  -6.206
  267    HA   LEU  33           HA       LEU  33   7.934  -5.647  -4.380
  268    HB2  LEU  33           2HB      LEU  33  10.079  -4.044  -4.103
  269    HB3  LEU  33           3HB      LEU  33   8.885  -2.776  -4.244
  270    HG   LEU  33           HG       LEU  33   9.430  -3.231  -1.887
  271   HD11  LEU  33          1HD1      LEU  33   6.593  -4.137  -2.438
  272   HD12  LEU  33          2HD1      LEU  33   7.149  -2.466  -2.309
  273   HD13  LEU  33          3HD1      LEU  33   7.226  -3.524  -0.903
  274   HD21  LEU  33          3HD2      LEU  33  10.102  -5.566  -2.042
  275   HD22  LEU  33          1HD2      LEU  33   8.433  -6.060  -2.338
  276   HD23  LEU  33          2HD2      LEU  33   8.891  -5.359  -0.783
  277    H    LYS  34           H        LYS  34   7.786  -3.193  -6.908
  278    HA   LYS  34           HA       LYS  34   5.455  -1.808  -6.189
  279    HB2  LYS  34           2HB      LYS  34   6.701  -2.326  -8.919
  280    HB3  LYS  34           3HB      LYS  34   5.340  -1.228  -8.675
  281    HG2  LYS  34           2HG      LYS  34   6.656   0.223  -7.273
  282    HG3  LYS  34           3HG      LYS  34   7.992  -0.927  -7.241
  283    HD2  LYS  34           2HD      LYS  34   8.469   0.958  -8.747
  284    HD3  LYS  34           3HD      LYS  34   8.395  -0.566  -9.634
  285    HE2  LYS  34           2HE      LYS  34   6.134  -0.021 -10.411
  286    HE3  LYS  34           3HE      LYS  34   6.156   1.472  -9.468
  287    HZ1  LYS  34           3HZ      LYS  34   8.085   0.864 -11.642
  288    HZ2  LYS  34           1HZ      LYS  34   7.889   2.334 -10.829
  289    HZ3  LYS  34           2HZ      LYS  34   6.671   1.766 -11.855
  290    H    GLU  35           H        GLU  35   5.771  -4.581  -8.471
  291    HA   GLU  35           HA       GLU  35   2.977  -4.823  -8.903
  292    HB2  GLU  35           2HB      GLU  35   3.465  -6.885 -10.084
  293    HB3  GLU  35           3HB      GLU  35   4.627  -5.651 -10.522
  294    HG2  GLU  35           2HG      GLU  35   6.088  -7.389 -10.308
  295    HG3  GLU  35           3HG      GLU  35   6.078  -6.881  -8.622
  296    H    LYS  36           H        LYS  36   5.108  -6.139  -6.443
  297    HA   LYS  36           HA       LYS  36   3.368  -8.082  -5.346
  298    HB2  LYS  36           2HB      LYS  36   5.556  -6.441  -3.995
  299    HB3  LYS  36           3HB      LYS  36   4.752  -7.830  -3.254
  300    HG2  LYS  36           2HG      LYS  36   5.589  -9.304  -4.999
  301    HG3  LYS  36           3HG      LYS  36   6.299  -7.936  -5.856
  302    HD2  LYS  36           2HD      LYS  36   7.801  -7.561  -3.857
  303    HD3  LYS  36           3HD      LYS  36   7.156  -9.056  -3.162
  304    HE2  LYS  36           2HE      LYS  36   8.684  -8.778  -5.773
  305    HE3  LYS  36           3HE      LYS  36   9.263  -9.528  -4.288
  306    HZ1  LYS  36           3HZ      LYS  36   8.596 -11.231  -5.783
  307    HZ2  LYS  36           1HZ      LYS  36   7.093 -10.508  -6.053
  308    HZ3  LYS  36           2HZ      LYS  36   7.447 -11.179  -4.544
  309    H    LEU  37           H        LEU  37   3.791  -4.628  -4.652
  310    HA   LEU  37           HA       LEU  37   1.841  -4.327  -2.656
  311    HB2  LEU  37           2HB      LEU  37   2.796  -2.358  -4.766
  312    HB3  LEU  37           3HB      LEU  37   1.790  -1.908  -3.396
  313    HG   LEU  37           HG       LEU  37   4.552  -3.150  -3.089
  314   HD11  LEU  37          1HD1      LEU  37   5.386  -0.904  -2.607
  315   HD12  LEU  37          2HD1      LEU  37   3.816  -0.220  -3.035
  316   HD13  LEU  37          3HD1      LEU  37   4.787  -1.039  -4.260
  317   HD21  LEU  37          3HD2      LEU  37   2.778  -1.705  -1.087
  318   HD22  LEU  37          1HD2      LEU  37   4.414  -2.300  -0.785
  319   HD23  LEU  37          2HD2      LEU  37   3.115  -3.438  -1.127
  320    H    LYS  38           H        LYS  38   1.541  -4.076  -6.247
  321    HA   LYS  38           HA       LYS  38  -1.205  -3.486  -6.374
  322    HB2  LYS  38           2HB      LYS  38   0.491  -5.032  -8.385
  323    HB3  LYS  38           3HB      LYS  38  -1.088  -4.323  -8.718
  324    HG2  LYS  38           2HG      LYS  38  -0.135  -2.063  -8.219
  325    HG3  LYS  38           3HG      LYS  38   1.446  -2.816  -7.997
  326    HD2  LYS  38           2HD      LYS  38   1.322  -1.859 -10.232
  327    HD3  LYS  38           3HD      LYS  38   1.371  -3.618 -10.359
  328    HE2  LYS  38           2HE      LYS  38  -1.114  -3.620 -10.660
  329    HE3  LYS  38           3HE      LYS  38  -1.090  -1.856 -10.618
  330    HZ1  LYS  38           3HZ      LYS  38   0.252  -1.835 -12.596
  331    HZ2  LYS  38           1HZ      LYS  38  -1.134  -2.752 -12.886
  332    HZ3  LYS  38           2HZ      LYS  38   0.354  -3.517 -12.622
  333    H    LYS  39           H        LYS  39   0.473  -6.624  -6.205
  334    HA   LYS  39           HA       LYS  39  -1.727  -8.351  -6.521
  335    HB2  LYS  39           2HB      LYS  39   0.830  -8.793  -4.910
  336    HB3  LYS  39           3HB      LYS  39  -0.327 -10.062  -5.290
  337    HG2  LYS  39           2HG      LYS  39   1.231  -8.486  -7.354
  338    HG3  LYS  39           3HG      LYS  39   1.711 -10.062  -6.734
  339    HD2  LYS  39           2HD      LYS  39  -0.283 -11.095  -7.702
  340    HD3  LYS  39           3HD      LYS  39  -0.901  -9.518  -8.204
  341    HE2  LYS  39           2HE      LYS  39   0.087 -10.741 -10.101
  342    HE3  LYS  39           3HE      LYS  39   0.984  -9.263  -9.767
  343    HZ1  LYS  39           3HZ      LYS  39   2.404 -11.186 -10.232
  344    HZ2  LYS  39           1HZ      LYS  39   1.801 -11.971  -8.865
  345    HZ3  LYS  39           2HZ      LYS  39   2.690 -10.541  -8.700
  346    H    VAL  40           H        VAL  40  -0.171  -7.167  -3.546
  347    HA   VAL  40           HA       VAL  40  -1.805  -8.374  -1.637
  348    HB   VAL  40           HB       VAL  40  -0.063  -5.873  -1.518
  349   HG11  VAL  40          1HG1      VAL  40  -1.771  -5.596   0.219
  350   HG12  VAL  40          2HG1      VAL  40  -0.208  -5.961   0.952
  351   HG13  VAL  40          3HG1      VAL  40  -1.442  -7.219   0.832
  352   HG21  VAL  40          3HG2      VAL  40   0.353  -8.688  -0.435
  353   HG22  VAL  40          1HG2      VAL  40   1.491  -7.343  -0.259
  354   HG23  VAL  40          2HG2      VAL  40   1.132  -7.997  -1.858
  355    H    LEU  41           H        LEU  41  -2.017  -5.090  -2.999
  356    HA   LEU  41           HA       LEU  41  -4.124  -4.183  -1.342
  357    HB2  LEU  41           2HB      LEU  41  -2.975  -3.147  -3.958
  358    HB3  LEU  41           3HB      LEU  41  -4.257  -2.300  -3.103
  359    HG   LEU  41           HG       LEU  41  -1.559  -2.918  -1.829
  360   HD11  LEU  41          1HD1      LEU  41  -2.399  -0.349  -3.201
  361   HD12  LEU  41          2HD1      LEU  41  -1.177  -1.489  -3.769
  362   HD13  LEU  41          3HD1      LEU  41  -0.917  -0.600  -2.272
  363   HD21  LEU  41          3HD2      LEU  41  -3.377  -2.518  -0.238
  364   HD22  LEU  41          1HD2      LEU  41  -3.757  -0.982  -1.028
  365   HD23  LEU  41          2HD2      LEU  41  -2.209  -1.203  -0.207
  366    H    ASN  42           H        ASN  42  -4.104  -5.328  -4.760
  367    HA   ASN  42           HA       ASN  42  -6.838  -4.971  -5.292
  368    HB2  ASN  42           2HB      ASN  42  -4.907  -5.399  -6.943
  369    HB3  ASN  42           3HB      ASN  42  -5.071  -7.106  -6.571
  370   HD21  ASN  42          1HD2      ASN  42  -5.456  -5.535  -9.075
  371   HD22  ASN  42          2HD2      ASN  42  -7.030  -5.981  -9.638
  372    H    GLU  43           H        GLU  43  -5.088  -7.882  -4.118
  373    HA   GLU  43           HA       GLU  43  -7.269  -9.654  -3.898
  374    HB2  GLU  43           2HB      GLU  43  -4.614  -9.509  -2.440
  375    HB3  GLU  43           3HB      GLU  43  -5.768 -10.788  -2.095
  376    HG2  GLU  43           2HG      GLU  43  -4.771 -10.298  -4.909
  377    HG3  GLU  43           3HG      GLU  43  -3.839 -11.249  -3.761
  378    H    ARG  44           H        ARG  44  -5.909  -7.394  -1.526
  379    HA   ARG  44           HA       ARG  44  -7.535  -8.126   0.669
  380    HB2  ARG  44           2HB      ARG  44  -5.341  -6.909   0.801
  381    HB3  ARG  44           3HB      ARG  44  -6.123  -5.470   0.156
  382    HG2  ARG  44           2HG      ARG  44  -5.802  -5.386   2.612
  383    HG3  ARG  44           3HG      ARG  44  -7.501  -5.267   2.149
  384    HD2  ARG  44           2HD      ARG  44  -7.045  -6.748   4.138
  385    HD3  ARG  44           3HD      ARG  44  -7.924  -7.544   2.828
  386    HE   ARG  44           HE       ARG  44  -5.110  -7.940   2.584
  387   HH11  ARG  44          1HH1      ARG  44  -7.862  -9.110   4.472
  388   HH12  ARG  44          2HH1      ARG  44  -7.118 -10.644   4.791
  389   HH21  ARG  44          1HH2      ARG  44  -4.189  -9.943   2.994
  390   HH22  ARG  44          2HH2      ARG  44  -5.034 -11.120   3.953
  391    H    MET  45           H        MET  45  -8.081  -6.032  -2.065
  392    HA   MET  45           HA       MET  45 -10.467  -4.818  -0.937
  393    HB2  MET  45           2HB      MET  45  -9.292  -4.615  -3.732
  394    HB3  MET  45           3HB      MET  45 -10.745  -3.774  -3.210
  395    HG2  MET  45           2HG      MET  45  -9.268  -2.728  -1.371
  396    HG3  MET  45           3HG      MET  45  -7.902  -3.311  -2.319
  397    HE1  MET  45           3HE      MET  45 -10.878  -0.772  -2.090
  398    HE2  MET  45           1HE      MET  45 -11.433  -1.799  -3.416
  399    HE3  MET  45           2HE      MET  45 -10.952  -0.131  -3.733
  400    H    ASP  46           H        ASP  46  -9.885  -7.823  -2.568
  401    HA   ASP  46           HA       ASP  46 -12.277  -8.039  -4.058
  402    HB2  ASP  46           2HB      ASP  46 -10.329 -10.099  -3.033
  403    HB3  ASP  46           3HB      ASP  46 -11.884 -10.669  -3.635
  404    HA   PRO  47           HA       PRO  47 -14.532  -9.808   0.014
  405    HB2  PRO  47           2HB      PRO  47 -13.505  -8.471   2.291
  406    HB3  PRO  47           3HB      PRO  47 -13.225 -10.176   1.889
  407    HG2  PRO  47           2HG      PRO  47 -11.461  -7.810   1.352
  408    HG3  PRO  47           3HG      PRO  47 -11.024  -9.440   1.917
  409    HD2  PRO  47           2HD      PRO  47 -10.623  -8.780  -0.632
  410    HD3  PRO  47           3HD      PRO  47 -11.251 -10.393  -0.227
  411    H    ILE  48           H        ILE  48 -12.995  -6.670  -0.375
  412    HA   ILE  48           HA       ILE  48 -15.048  -5.059   0.842
  413    HB   ILE  48           HB       ILE  48 -12.607  -4.394  -0.861
  414   HG12  ILE  48          2HG1      ILE  48 -12.090  -5.439   1.346
  415   HG13  ILE  48          3HG1      ILE  48 -11.484  -3.794   1.228
  416   HG21  ILE  48          1HG2      ILE  48 -14.165  -2.553  -1.088
  417   HG22  ILE  48          2HG2      ILE  48 -12.783  -2.066  -0.108
  418   HG23  ILE  48          3HG2      ILE  48 -14.326  -2.432   0.666
  419   HD11  ILE  48          3HD1      ILE  48 -12.393  -4.233   3.412
  420   HD12  ILE  48          1HD1      ILE  48 -13.954  -4.671   2.720
  421   HD13  ILE  48          2HD1      ILE  48 -13.363  -3.010   2.595
  422    H    LYS  49           H        LYS  49 -14.327  -6.225  -2.395
  423    HA   LYS  49           HA       LYS  49 -16.012  -4.391  -3.838
  424    HB2  LYS  49           2HB      LYS  49 -14.804  -7.050  -4.698
  425    HB3  LYS  49           3HB      LYS  49 -15.612  -5.912  -5.773
  426    HG2  LYS  49           2HG      LYS  49 -13.871  -4.339  -5.622
  427    HG3  LYS  49           3HG      LYS  49 -13.179  -5.086  -4.191
  428    HD2  LYS  49           2HD      LYS  49 -12.582  -7.092  -5.611
  429    HD3  LYS  49           3HD      LYS  49 -13.137  -6.200  -7.030
  430    HE2  LYS  49           2HE      LYS  49 -11.398  -4.564  -6.774
  431    HE3  LYS  49           3HE      LYS  49 -10.962  -5.181  -5.179
  432    HZ1  LYS  49           3HZ      LYS  49  -9.395  -5.908  -6.842
  433    HZ2  LYS  49           1HZ      LYS  49 -10.623  -6.630  -7.749
  434    HZ3  LYS  49           2HZ      LYS  49 -10.229  -7.237  -6.222
  435    H    LYS  50           H        LYS  50 -16.229  -7.721  -2.665
  436    HA   LYS  50           HA       LYS  50 -18.904  -8.213  -3.445
  437    HB2  LYS  50           2HB      LYS  50 -17.351 -10.010  -2.958
  438    HB3  LYS  50           3HB      LYS  50 -17.134  -9.446  -1.306
  439    HG2  LYS  50           2HG      LYS  50 -19.382 -10.098  -0.715
  440    HG3  LYS  50           3HG      LYS  50 -19.783 -10.433  -2.396
  441    HD2  LYS  50           2HD      LYS  50 -19.448 -12.490  -1.111
  442    HD3  LYS  50           3HD      LYS  50 -18.273 -12.356  -2.414
  443    HE2  LYS  50           2HE      LYS  50 -17.620 -11.584   0.447
  444    HE3  LYS  50           3HE      LYS  50 -17.432 -13.229  -0.146
  445    HZ1  LYS  50           3HZ      LYS  50 -15.855 -12.435  -1.790
  446    HZ2  LYS  50           1HZ      LYS  50 -15.364 -12.006  -0.234
  447    HZ3  LYS  50           2HZ      LYS  50 -16.040 -10.844  -1.246
  448    H    LEU  51           H        LEU  51 -17.502  -6.512  -0.711
  449    HA   LEU  51           HA       LEU  51 -19.940  -6.338   0.821
  450    HB2  LEU  51           2HB      LEU  51 -17.450  -4.564   0.881
  451    HB3  LEU  51           3HB      LEU  51 -18.798  -4.397   1.989
  452    HG   LEU  51           HG       LEU  51 -16.855  -6.730   1.837
  453   HD11  LEU  51          1HD1      LEU  51 -15.947  -4.737   2.936
  454   HD12  LEU  51          2HD1      LEU  51 -16.187  -6.045   4.090
  455   HD13  LEU  51          3HD1      LEU  51 -17.328  -4.695   4.039
  456   HD21  LEU  51          3HD2      LEU  51 -19.072  -7.615   2.319
  457   HD22  LEU  51          1HD2      LEU  51 -19.289  -6.443   3.623
  458   HD23  LEU  51          2HD2      LEU  51 -18.053  -7.698   3.753
  459    H    GLY  52           H        GLY  52 -18.418  -4.537  -1.792
  460    HA2  GLY  52           2HA      GLY  52 -19.403  -3.198  -3.400
  461    HA3  GLY  52           3HA      GLY  52 -20.910  -3.215  -2.495
  462    H    CYS  53           H        CYS  53 -17.704  -2.310  -1.350
  463    HA   CYS  53           HA       CYS  53 -18.604   0.123  -0.138
  464    HB2  CYS  53           2HB      CYS  53 -15.746  -0.805  -0.629
  465    HB3  CYS  53           3HB      CYS  53 -16.297   0.350   0.586
  466    H    LYS  54           H        LYS  54 -18.925   1.998  -1.215
  467    HA   LYS  54           HA       LYS  54 -18.054   2.526  -3.865
  468    HB2  LYS  54           2HB      LYS  54 -20.080   3.576  -2.897
  469    HB3  LYS  54           3HB      LYS  54 -19.087   4.462  -1.747
  470    HG2  LYS  54           2HG      LYS  54 -19.805   5.919  -3.576
  471    HG3  LYS  54           3HG      LYS  54 -18.053   5.730  -3.583
  472    HD2  LYS  54           2HD      LYS  54 -18.818   5.662  -5.858
  473    HD3  LYS  54           3HD      LYS  54 -18.306   4.033  -5.426
  474    HE2  LYS  54           2HE      LYS  54 -21.215   4.905  -5.314
  475    HE3  LYS  54           3HE      LYS  54 -20.477   4.263  -6.776
  476    HZ1  LYS  54           3HZ      LYS  54 -20.817   2.829  -4.189
  477    HZ2  LYS  54           1HZ      LYS  54 -19.939   2.220  -5.503
  478    HZ3  LYS  54           2HZ      LYS  54 -21.595   2.502  -5.650
  479    H    ARG  55           H        ARG  55 -17.064   3.954  -0.752
  480    HA   ARG  55           HA       ARG  55 -14.388   4.588  -1.871
  481    HB2  ARG  55           2HB      ARG  55 -15.567   6.684  -1.514
  482    HB3  ARG  55           3HB      ARG  55 -16.087   6.196   0.096
  483    HG2  ARG  55           2HG      ARG  55 -13.783   6.337   0.919
  484    HG3  ARG  55           3HG      ARG  55 -13.191   6.697  -0.703
  485    HD2  ARG  55           2HD      ARG  55 -15.146   8.462   0.806
  486    HD3  ARG  55           3HD      ARG  55 -13.397   8.687   0.835
  487    HE   ARG  55           HE       ARG  55 -14.810   8.694  -1.746
  488   HH11  ARG  55          1HH1      ARG  55 -12.978  10.508   0.668
  489   HH12  ARG  55          2HH1      ARG  55 -12.697  11.857  -0.387
  490   HH21  ARG  55          1HH2      ARG  55 -14.410  10.436  -3.128
  491   HH22  ARG  55          2HH2      ARG  55 -13.517  11.811  -2.556
  492    H    VAL  56           H        VAL  56 -12.660   4.151  -0.559
  493    HA   VAL  56           HA       VAL  56 -13.095   2.698   1.987
  494    HB   VAL  56           HB       VAL  56 -11.206   1.200   1.436
  495   HG11  VAL  56          1HG1      VAL  56 -13.367   1.158  -0.697
  496   HG12  VAL  56          2HG1      VAL  56 -13.459   0.426   0.906
  497   HG13  VAL  56          3HG1      VAL  56 -12.308  -0.195  -0.278
  498   HG21  VAL  56          3HG2      VAL  56  -9.920   2.647  -0.086
  499   HG22  VAL  56          1HG2      VAL  56 -11.174   2.497  -1.319
  500   HG23  VAL  56          2HG2      VAL  56 -10.233   1.082  -0.836
  501    H    ARG  57           H        ARG  57 -11.618   3.176   3.618
  502    HA   ARG  57           HA       ARG  57  -9.576   5.251   3.074
  503    HB2  ARG  57           2HB      ARG  57 -11.294   5.927   4.721
  504    HB3  ARG  57           3HB      ARG  57 -10.930   4.516   5.709
  505    HG2  ARG  57           2HG      ARG  57  -8.724   5.378   6.245
  506    HG3  ARG  57           3HG      ARG  57  -8.902   6.693   5.078
  507    HD2  ARG  57           2HD      ARG  57 -10.545   6.326   7.608
  508    HD3  ARG  57           3HD      ARG  57  -9.241   7.497   7.385
  509    HE   ARG  57           HE       ARG  57 -10.775   8.241   5.415
  510   HH11  ARG  57          1HH1      ARG  57 -11.892   7.340   8.621
  511   HH12  ARG  57          2HH1      ARG  57 -13.293   8.361   8.539
  512   HH21  ARG  57          1HH2      ARG  57 -12.588   9.546   5.302
  513   HH22  ARG  57          2HH2      ARG  57 -13.689   9.621   6.642
  514    H    ILE  58           H        ILE  58  -7.708   4.299   2.736
  515    HA   ILE  58           HA       ILE  58  -6.908   1.887   4.234
  516    HB   ILE  58           HB       ILE  58  -5.646   2.996   1.673
  517   HG12  ILE  58          2HG1      ILE  58  -7.669   0.720   1.966
  518   HG13  ILE  58          3HG1      ILE  58  -7.982   2.282   1.221
  519   HG21  ILE  58          1HG2      ILE  58  -4.542   0.789   1.527
  520   HG22  ILE  58          2HG2      ILE  58  -5.303   0.299   3.041
  521   HG23  ILE  58          3HG2      ILE  58  -4.120   1.609   3.033
  522   HD11  ILE  58          3HD1      ILE  58  -7.678   0.572  -0.449
  523   HD12  ILE  58          1HD1      ILE  58  -6.080   0.179   0.186
  524   HD13  ILE  58          2HD1      ILE  58  -6.378   1.758  -0.550
  525    H    SER  59           H        SER  59  -5.242   2.053   5.640
  526    HA   SER  59           HA       SER  59  -3.346   4.320   5.512
  527    HB2  SER  59           2HB      SER  59  -4.500   3.060   8.053
  528    HB3  SER  59           3HB      SER  59  -3.278   4.338   7.994
  529    HG   SER  59           HG       SER  59  -5.117   5.353   6.587
  530    H    ILE  60           H        ILE  60  -1.567   3.369   4.764
  531    HA   ILE  60           HA       ILE  60  -0.861   0.615   5.504
  532    HB   ILE  60           HB       ILE  60   0.228   2.428   3.309
  533   HG12  ILE  60          2HG1      ILE  60  -1.576  -0.025   3.111
  534   HG13  ILE  60          3HG1      ILE  60  -2.107   1.642   2.929
  535   HG21  ILE  60          1HG2      ILE  60   0.894  -0.478   3.872
  536   HG22  ILE  60          2HG2      ILE  60   1.985   0.897   4.066
  537   HG23  ILE  60          3HG2      ILE  60   1.423   0.438   2.458
  538   HD11  ILE  60          3HD1      ILE  60  -0.223   0.160   1.099
  539   HD12  ILE  60          1HD1      ILE  60  -0.691   1.857   0.932
  540   HD13  ILE  60          2HD1      ILE  60  -1.905   0.588   0.788
  541    H    ARG  61           H        ARG  61   0.602   0.308   7.067
  542    HA   ARG  61           HA       ARG  61   2.650   2.341   7.678
  543    HB2  ARG  61           2HB      ARG  61   1.357   0.147   9.345
  544    HB3  ARG  61           3HB      ARG  61   2.970   0.711   9.753
  545    HG2  ARG  61           2HG      ARG  61   1.431   1.875  11.157
  546    HG3  ARG  61           3HG      ARG  61   2.057   3.032   9.987
  547    HD2  ARG  61           2HD      ARG  61  -0.057   2.858   8.696
  548    HD3  ARG  61           3HD      ARG  61  -0.676   1.684   9.863
  549    HE   ARG  61           HE       ARG  61  -0.255   4.568  10.303
  550   HH11  ARG  61          1HH1      ARG  61  -1.417   1.505  11.595
  551   HH12  ARG  61          2HH1      ARG  61  -2.258   2.249  12.917
  552   HH21  ARG  61          1HH2      ARG  61  -1.349   5.524  12.050
  553   HH22  ARG  61          2HH2      ARG  61  -2.221   4.528  13.173
  554    H    VAL  62           H        VAL  62   4.326   1.920   6.355
  555    HA   VAL  62           HA       VAL  62   5.061  -0.848   5.662
  556    HB   VAL  62           HB       VAL  62   4.763   1.003   3.882
  557   HG11  VAL  62          1HG1      VAL  62   7.485   1.935   4.853
  558   HG12  VAL  62          2HG1      VAL  62   5.973   2.834   5.021
  559   HG13  VAL  62          3HG1      VAL  62   6.631   2.510   3.415
  560   HG21  VAL  62          3HG2      VAL  62   6.623   0.196   2.491
  561   HG22  VAL  62          1HG2      VAL  62   5.828  -1.120   3.358
  562   HG23  VAL  62          2HG2      VAL  62   7.384  -0.504   3.920
  563    H    LYS  63           H        LYS  63   7.174  -1.666   6.146
  564    HA   LYS  63           HA       LYS  63   8.490  -0.435   8.417
  565    HB2  LYS  63           2HB      LYS  63   9.016  -3.005   6.888
  566    HB3  LYS  63           3HB      LYS  63  10.053  -2.467   8.207
  567    HG2  LYS  63           2HG      LYS  63   7.076  -3.006   8.469
  568    HG3  LYS  63           3HG      LYS  63   8.339  -4.171   8.862
  569    HD2  LYS  63           2HD      LYS  63   7.979  -1.467  10.200
  570    HD3  LYS  63           3HD      LYS  63   7.423  -3.009  10.854
  571    HE2  LYS  63           2HE      LYS  63  10.317  -2.243  10.327
  572    HE3  LYS  63           3HE      LYS  63   9.527  -2.324  11.898
  573    HZ1  LYS  63           3HZ      LYS  63   9.993  -4.617  10.073
  574    HZ2  LYS  63           1HZ      LYS  63   9.184  -4.691  11.552
  575    HZ3  LYS  63           2HZ      LYS  63  10.822  -4.292  11.513
  576    H    HIS  64           H        HIS  64   9.803   1.205   8.094
  577    HA   HIS  64           HA       HIS  64  11.282   1.639   5.629
  578    HB2  HIS  64           2HB      HIS  64  11.346   3.241   8.233
  579    HB3  HIS  64           3HB      HIS  64  11.958   3.763   6.667
  580    HD1  HIS  64           HD1      HIS  64  10.261   4.761   5.021
  581    HD2  HIS  64           HD2      HIS  64   8.475   3.227   8.441
  582    HE1  HIS  64           HE1      HIS  64   7.913   5.648   5.008
  583    HE2  HIS  64           HE2      HIS  64   6.912   4.848   7.179
  584    H    SER  65           H        SER  65  13.150   0.654   5.326
  585    HA   SER  65           HA       SER  65  14.184  -1.441   6.347
  586    HB2  SER  65           2HB      SER  65  15.140  -0.377   4.375
  587    HB3  SER  65           3HB      SER  65  15.953   0.821   5.370
  588    HG   SER  65           HG       SER  65  17.159  -0.931   6.296
  589    H    ASP  66           H        ASP  66  15.952   1.470   7.425
  590    HA   ASP  66           HA       ASP  66  16.046   0.481  10.192
  591    HB2  ASP  66           2HB      ASP  66  18.491   1.464   8.630
  592    HB3  ASP  66           3HB      ASP  66  18.466   1.191  10.370
  593    H    ALA  67           H        ALA  67  17.074   2.414  11.563
  594    HA   ALA  67           HA       ALA  67  15.099   4.437  11.436
  595    HB1  ALA  67           3HB      ALA  67  16.053   3.653  13.564
  596    HB2  ALA  67           1HB      ALA  67  16.218   5.402  13.405
  597    HB3  ALA  67           2HB      ALA  67  17.616   4.358  13.139
  598    H    ALA  68           H        ALA  68  18.561   4.458  10.642
  599    HA   ALA  68           HA       ALA  68  18.671   7.226   9.859
  600    HB1  ALA  68           3HB      ALA  68  20.680   6.019  10.620
  601    HB2  ALA  68           1HB      ALA  68  20.916   6.652   8.994
  602    HB3  ALA  68           2HB      ALA  68  20.584   4.933   9.231
  603    H    GLU  69           H        GLU  69  17.821   4.240   8.246
  604    HA   GLU  69           HA       GLU  69  18.111   5.192   5.558
  605    HB2  GLU  69           2HB      GLU  69  16.508   2.825   6.617
  606    HB3  GLU  69           3HB      GLU  69  16.875   3.129   4.923
  607    HG2  GLU  69           2HG      GLU  69  18.923   2.561   7.082
  608    HG3  GLU  69           3HG      GLU  69  18.301   1.381   5.932
  609    H    GLU  70           H        GLU  70  15.598   5.499   7.982
  610    HA   GLU  70           HA       GLU  70  13.238   5.173   6.632
  611    HB2  GLU  70           2HB      GLU  70  13.767   7.195   8.843
  612    HB3  GLU  70           3HB      GLU  70  12.165   6.726   8.288
  613    HG2  GLU  70           2HG      GLU  70  12.738   4.353   8.938
  614    HG3  GLU  70           3HG      GLU  70  14.201   4.983   9.683
  615    H    LYS  71           H        LYS  71  15.166   8.148   6.611
  616    HA   LYS  71           HA       LYS  71  13.213   9.870   5.479
  617    HB2  LYS  71           2HB      LYS  71  16.247  10.107   5.359
  618    HB3  LYS  71           3HB      LYS  71  15.103  11.410   5.050
  619    HG2  LYS  71           2HG      LYS  71  14.384  11.388   7.386
  620    HG3  LYS  71           3HG      LYS  71  15.425   9.995   7.720
  621    HD2  LYS  71           2HD      LYS  71  17.425  11.348   7.167
  622    HD3  LYS  71           3HD      LYS  71  16.395  12.735   6.804
  623    HE2  LYS  71           2HE      LYS  71  17.427  12.942   9.018
  624    HE3  LYS  71           3HE      LYS  71  15.674  12.816   9.161
  625    HZ1  LYS  71           3HZ      LYS  71  16.790  11.474  10.806
  626    HZ2  LYS  71           1HZ      LYS  71  17.631  10.628   9.611
  627    HZ3  LYS  71           2HZ      LYS  71  15.951  10.475   9.734
  628    H    LYS  72           H        LYS  72  16.092   8.367   3.980
  629    HA   LYS  72           HA       LYS  72  15.526   9.097   1.301
  630    HB2  LYS  72           2HB      LYS  72  17.809   8.603   2.053
  631    HB3  LYS  72           3HB      LYS  72  17.349   6.963   2.487
  632    HG2  LYS  72           2HG      LYS  72  18.647   6.947   0.436
  633    HG3  LYS  72           3HG      LYS  72  16.995   6.426   0.097
  634    HD2  LYS  72           2HD      LYS  72  16.486   8.724  -0.756
  635    HD3  LYS  72           3HD      LYS  72  18.169   9.180  -0.469
  636    HE2  LYS  72           2HE      LYS  72  18.943   7.574  -2.126
  637    HE3  LYS  72           3HE      LYS  72  17.311   6.924  -2.317
  638    HZ1  LYS  72           3HZ      LYS  72  16.610   9.102  -3.167
  639    HZ2  LYS  72           1HZ      LYS  72  17.831   8.416  -4.118
  640    HZ3  LYS  72           2HZ      LYS  72  18.198   9.664  -3.042
  641    H    GLU  73           H        GLU  73  14.773   6.267   3.235
  642    HA   GLU  73           HA       GLU  73  13.926   4.462   1.231
  643    HB2  GLU  73           2HB      GLU  73  14.552   3.974   3.688
  644    HB3  GLU  73           3HB      GLU  73  12.949   4.529   4.132
  645    HG2  GLU  73           2HG      GLU  73  13.553   2.172   2.320
  646    HG3  GLU  73           3HG      GLU  73  13.175   2.044   4.030
  647    H    ALA  74           H        ALA  74  12.179   6.758   3.323
  648    HA   ALA  74           HA       ALA  74   9.552   6.118   2.439
  649    HB1  ALA  74           3HB      ALA  74  10.007   7.236   4.590
  650    HB2  ALA  74           1HB      ALA  74   8.848   8.139   3.616
  651    HB3  ALA  74           2HB      ALA  74  10.523   8.692   3.730
  652    H    LYS  75           H        LYS  75  11.853   8.648   1.437
  653    HA   LYS  75           HA       LYS  75  10.274   9.978  -0.470
  654    HB2  LYS  75           2HB      LYS  75  12.404  10.896   0.366
  655    HB3  LYS  75           3HB      LYS  75  13.302   9.590  -0.404
  656    HG2  LYS  75           2HG      LYS  75  12.612  10.419  -2.628
  657    HG3  LYS  75           3HG      LYS  75  11.686  11.715  -1.864
  658    HD2  LYS  75           2HD      LYS  75  13.748  12.690  -0.954
  659    HD3  LYS  75           3HD      LYS  75  14.700  11.355  -1.618
  660    HE2  LYS  75           2HE      LYS  75  14.863  13.396  -3.015
  661    HE3  LYS  75           3HE      LYS  75  14.131  12.058  -3.901
  662    HZ1  LYS  75           3HZ      LYS  75  11.959  13.019  -3.534
  663    HZ2  LYS  75           1HZ      LYS  75  12.969  14.167  -4.255
  664    HZ3  LYS  75           2HZ      LYS  75  12.615  14.269  -2.604
  665    H    LYS  76           H        LYS  76  12.430   7.175  -0.810
  666    HA   LYS  76           HA       LYS  76  12.162   6.753  -3.603
  667    HB2  LYS  76           2HB      LYS  76  14.064   5.836  -2.469
  668    HB3  LYS  76           3HB      LYS  76  13.071   4.998  -1.296
  669    HG2  LYS  76           2HG      LYS  76  12.778   4.161  -4.167
  670    HG3  LYS  76           3HG      LYS  76  14.294   3.751  -3.368
  671    HD2  LYS  76           2HD      LYS  76  11.503   2.937  -2.440
  672    HD3  LYS  76           3HD      LYS  76  12.691   1.886  -3.216
  673    HE2  LYS  76           2HE      LYS  76  14.209   2.170  -1.289
  674    HE3  LYS  76           3HE      LYS  76  13.037   3.240  -0.515
  675    HZ1  LYS  76           3HZ      LYS  76  12.502   0.395  -1.208
  676    HZ2  LYS  76           1HZ      LYS  76  11.499   1.429  -0.318
  677    HZ3  LYS  76           2HZ      LYS  76  12.984   0.934   0.321
  678    H    PHE  77           H        PHE  77  10.452   5.492  -0.782
  679    HA   PHE  77           HA       PHE  77   8.915   3.572  -2.270
  680    HB2  PHE  77           2HB      PHE  77   9.720   3.460   0.256
  681    HB3  PHE  77           3HB      PHE  77   8.238   4.351   0.587
  682    HD1  PHE  77           HD1      PHE  77   9.585   1.198  -0.894
  683    HD2  PHE  77           HD2      PHE  77   6.114   3.196   0.613
  684    HE1  PHE  77           HE1      PHE  77   8.324  -0.912  -0.988
  685    HE2  PHE  77           HE2      PHE  77   4.866   1.081   0.517
  686    HZ   PHE  77           HZ       PHE  77   5.961  -0.972  -0.286
  687    H    ALA  78           H        ALA  78   8.563   6.874  -1.360
  688    HA   ALA  78           HA       ALA  78   5.775   7.229  -1.742
  689    HB1  ALA  78           3HB      ALA  78   8.046   9.192  -2.229
  690    HB2  ALA  78           1HB      ALA  78   7.189   8.952  -0.706
  691    HB3  ALA  78           2HB      ALA  78   6.332   9.608  -2.102
  692    H    ALA  79           H        ALA  79   8.572   7.348  -3.963
  693    HA   ALA  79           HA       ALA  79   7.128   7.894  -6.347
  694    HB1  ALA  79           3HB      ALA  79   9.548   8.298  -6.123
  695    HB2  ALA  79           1HB      ALA  79   9.209   7.247  -7.497
  696    HB3  ALA  79           2HB      ALA  79   9.840   6.562  -5.995
  697    H    ILE  80           H        ILE  80   8.197   4.891  -4.793
  698    HA   ILE  80           HA       ILE  80   7.437   2.973  -6.677
  699    HB   ILE  80           HB       ILE  80   7.609   2.849  -3.637
  700   HG12  ILE  80          2HG1      ILE  80   9.759   3.290  -4.664
  701   HG13  ILE  80          3HG1      ILE  80   9.771   1.626  -4.103
  702   HG21  ILE  80          1HG2      ILE  80   7.656   0.396  -3.750
  703   HG22  ILE  80          2HG2      ILE  80   7.314   0.464  -5.478
  704   HG23  ILE  80          3HG2      ILE  80   6.115   1.040  -4.323
  705   HD11  ILE  80          3HD1      ILE  80  10.843   1.816  -6.249
  706   HD12  ILE  80          1HD1      ILE  80   9.406   2.553  -6.954
  707   HD13  ILE  80          2HD1      ILE  80   9.365   0.870  -6.416
  708    H    LEU  81           H        LEU  81   5.591   4.202  -3.882
  709    HA   LEU  81           HA       LEU  81   3.209   2.749  -4.419
  710    HB2  LEU  81           2HB      LEU  81   3.896   5.064  -2.592
  711    HB3  LEU  81           3HB      LEU  81   2.243   4.496  -2.728
  712    HG   LEU  81           HG       LEU  81   4.598   2.820  -1.780
  713   HD11  LEU  81          1HD1      LEU  81   2.297   4.024  -0.217
  714   HD12  LEU  81          2HD1      LEU  81   3.985   4.538  -0.165
  715   HD13  LEU  81          3HD1      LEU  81   3.536   2.941   0.425
  716   HD21  LEU  81          3HD2      LEU  81   1.647   2.108  -1.915
  717   HD22  LEU  81          1HD2      LEU  81   2.915   1.129  -1.172
  718   HD23  LEU  81          2HD2      LEU  81   2.936   1.422  -2.909
  719    H    ASN  82           H        ASN  82   4.348   5.947  -5.361
  720    HA   ASN  82           HA       ASN  82   1.923   7.186  -6.100
  721    HB2  ASN  82           2HB      ASN  82   4.144   8.354  -5.894
  722    HB3  ASN  82           3HB      ASN  82   4.671   7.578  -7.385
  723   HD21  ASN  82          1HD2      ASN  82   4.954   9.496  -8.516
  724   HD22  ASN  82          2HD2      ASN  82   3.648  10.537  -8.964
  725    H    LYS  83           H        LYS  83   4.123   5.084  -7.852
  726    HA   LYS  83           HA       LYS  83   2.772   5.058 -10.358
  727    HB2  LYS  83           2HB      LYS  83   4.827   3.228  -9.071
  728    HB3  LYS  83           3HB      LYS  83   4.218   2.948 -10.697
  729    HG2  LYS  83           2HG      LYS  83   5.662   5.468  -9.798
  730    HG3  LYS  83           3HG      LYS  83   6.409   4.118 -10.661
  731    HD2  LYS  83           2HD      LYS  83   4.821   4.503 -12.560
  732    HD3  LYS  83           3HD      LYS  83   4.180   5.909 -11.706
  733    HE2  LYS  83           2HE      LYS  83   7.065   5.595 -12.605
  734    HE3  LYS  83           3HE      LYS  83   5.826   6.500 -13.472
  735    HZ1  LYS  83           3HZ      LYS  83   6.811   7.101 -10.742
  736    HZ2  LYS  83           1HZ      LYS  83   5.618   7.967 -11.572
  737    HZ3  LYS  83           2HZ      LYS  83   7.202   7.948 -12.152
  738    H    VAL  84           H        VAL  84   2.666   2.929  -7.494
  739    HA   VAL  84           HA       VAL  84   1.247   0.754  -8.644
  740    HB   VAL  84           HB       VAL  84   1.658   1.629  -5.745
  741   HG11  VAL  84          1HG1      VAL  84  -0.410   0.316  -5.781
  742   HG12  VAL  84          2HG1      VAL  84   0.883  -0.616  -5.024
  743   HG13  VAL  84          3HG1      VAL  84   0.394  -0.972  -6.681
  744   HG21  VAL  84          3HG2      VAL  84   3.283  -0.229  -5.670
  745   HG22  VAL  84          1HG2      VAL  84   3.689   0.920  -6.949
  746   HG23  VAL  84          2HG2      VAL  84   2.924  -0.618  -7.354
  747    H    PHE  85           H        PHE  85   0.194   3.337  -6.463
  748    HA   PHE  85           HA       PHE  85  -2.547   2.775  -6.376
  749    HB2  PHE  85           2HB      PHE  85  -1.076   5.408  -5.949
  750    HB3  PHE  85           3HB      PHE  85  -2.772   5.167  -5.555
  751    HD1  PHE  85           HD1      PHE  85  -2.668   2.387  -4.379
  752    HD2  PHE  85           HD2      PHE  85  -0.112   5.774  -3.799
  753    HE1  PHE  85           HE1      PHE  85  -2.060   1.558  -2.146
  754    HE2  PHE  85           HE2      PHE  85   0.488   4.927  -1.573
  755    HZ   PHE  85           HZ       PHE  85  -0.482   2.824  -0.742
  756    H    ALA  86           H        ALA  86  -0.702   4.748  -8.651
  757    HA   ALA  86           HA       ALA  86  -2.878   5.960 -10.018
  758    HB1  ALA  86           3HB      ALA  86  -0.068   5.406 -11.016
  759    HB2  ALA  86           1HB      ALA  86  -0.579   6.831 -10.110
  760    HB3  ALA  86           2HB      ALA  86  -1.217   6.541 -11.732
  761    H    GLU  87           H        GLU  87  -1.424   2.808 -10.259
  762    HA   GLU  87           HA       GLU  87  -2.639   2.097 -12.826
  763    HB2  GLU  87           2HB      GLU  87  -0.976   0.507 -10.820
  764    HB3  GLU  87           3HB      GLU  87  -1.563  -0.149 -12.347
  765    HG2  GLU  87           2HG      GLU  87  -0.182   1.390 -13.614
  766    HG3  GLU  87           3HG      GLU  87   0.283   2.255 -12.150
  767    H    LEU  88           H        LEU  88  -3.638   2.274  -9.606
  768    HA   LEU  88           HA       LEU  88  -5.503  -0.035  -9.786
  769    HB2  LEU  88           2HB      LEU  88  -4.426   1.360  -7.301
  770    HB3  LEU  88           3HB      LEU  88  -5.594   0.049  -7.301
  771    HG   LEU  88           HG       LEU  88  -2.698  -0.153  -8.213
  772   HD11  LEU  88          1HD1      LEU  88  -4.047  -1.340  -5.769
  773   HD12  LEU  88          2HD1      LEU  88  -2.928   0.027  -5.784
  774   HD13  LEU  88          3HD1      LEU  88  -2.364  -1.571  -6.260
  775   HD21  LEU  88          3HD2      LEU  88  -4.801  -2.341  -8.111
  776   HD22  LEU  88          1HD2      LEU  88  -3.081  -2.571  -8.446
  777   HD23  LEU  88          2HD2      LEU  88  -4.077  -1.645  -9.564
  778    H    GLY  89           H        GLY  89  -5.480   3.233 -10.233
  779    HA2  GLY  89           2HA      GLY  89  -7.479   4.327 -10.911
  780    HA3  GLY  89           3HA      GLY  89  -8.394   3.414  -9.727
  781    H    TYR  90           H        TYR  90  -5.785   4.296  -8.033
  782    HA   TYR  90           HA       TYR  90  -7.102   6.556  -6.758
  783    HB2  TYR  90           2HB      TYR  90  -4.463   5.183  -6.101
  784    HB3  TYR  90           3HB      TYR  90  -5.275   6.366  -5.087
  785    HD1  TYR  90           HD2      TYR  90  -7.932   5.617  -4.685
  786    HD2  TYR  90           HD1      TYR  90  -4.615   2.986  -5.302
  787    HE1  TYR  90           HE2      TYR  90  -9.126   3.828  -3.499
  788    HE2  TYR  90           HE1      TYR  90  -5.809   1.197  -4.110
  789    HH   TYR  90           HH       TYR  90  -9.110   1.356  -3.374
  790    H    ASN  91           H        ASN  91  -6.509   8.642  -6.976
  791    HA   ASN  91           HA       ASN  91  -4.211   9.403  -8.692
  792    HB2  ASN  91           2HB      ASN  91  -6.934  10.767  -8.408
  793    HB3  ASN  91           3HB      ASN  91  -5.606  11.358  -9.409
  794   HD21  ASN  91          1HD2      ASN  91  -5.109  10.237 -11.352
  795   HD22  ASN  91          2HD2      ASN  91  -6.207   9.101 -12.053
  796    H    ASP  92           H        ASP  92  -4.247  12.163  -8.242
  797    HA   ASP  92           HA       ASP  92  -2.674  12.556  -6.030
  798    HB2  ASP  92           2HB      ASP  92  -4.489  14.637  -7.344
  799    HB3  ASP  92           3HB      ASP  92  -3.172  15.022  -6.242
  800    H    SER  93           H        SER  93  -6.162  13.233  -6.239
  801    HA   SER  93           HA       SER  93  -6.546  14.310  -3.664
  802    HB2  SER  93           2HB      SER  93  -8.595  12.922  -5.444
  803    HB3  SER  93           3HB      SER  93  -8.952  14.041  -4.125
  804    HG   SER  93           HG       SER  93  -7.447  15.482  -5.477
  805    H    ASN  94           H        ASN  94  -6.027  11.060  -4.582
  806    HA   ASN  94           HA       ASN  94  -7.538   9.888  -2.355
  807    HB2  ASN  94           2HB      ASN  94  -6.100   8.600  -4.730
  808    HB3  ASN  94           3HB      ASN  94  -6.963   7.702  -3.481
  809   HD21  ASN  94          1HD2      ASN  94  -9.218   9.490  -3.216
  810   HD22  ASN  94          2HD2      ASN  94 -10.132   9.368  -4.678
  811    H    VAL  95           H        VAL  95  -4.190  10.343  -3.519
  812    HA   VAL  95           HA       VAL  95  -3.094   8.687  -1.346
  813    HB   VAL  95           HB       VAL  95  -1.592  10.213  -3.531
  814   HG11  VAL  95          1HG1      VAL  95  -0.653   7.977  -1.695
  815   HG12  VAL  95          2HG1      VAL  95  -0.190   9.678  -1.582
  816   HG13  VAL  95          3HG1      VAL  95   0.298   8.724  -2.983
  817   HG21  VAL  95          3HG2      VAL  95  -3.090   8.554  -4.563
  818   HG22  VAL  95          1HG2      VAL  95  -2.421   7.286  -3.531
  819   HG23  VAL  95          2HG2      VAL  95  -1.401   8.073  -4.739
  820    H    THR  96           H        THR  96  -2.381   9.576   0.536
  821    HA   THR  96           HA       THR  96  -1.420  12.350   0.659
  822    HB   THR  96           HB       THR  96  -3.576  11.329   2.584
  823    HG1  THR  96           HG1      THR  96  -4.409  13.462   1.215
  824   HG21  THR  96          3HG2      THR  96  -2.053  12.971   3.626
  825   HG22  THR  96          1HG2      THR  96  -3.659  13.669   3.381
  826   HG23  THR  96          2HG2      THR  96  -2.338  14.094   2.294
  827    H    TRP  97           H        TRP  97   0.610  12.048   1.502
  828    HA   TRP  97           HA       TRP  97   1.209   9.960   3.438
  829    HB2  TRP  97           2HB      TRP  97   2.891  12.122   2.107
  830    HB3  TRP  97           3HB      TRP  97   3.530  11.147   3.427
  831    HD1  TRP  97           HD1      TRP  97   2.343  10.762  -0.241
  832    HE1  TRP  97           HE1      TRP  97   3.346   8.586  -1.183
  833    HE3  TRP  97           HE3      TRP  97   4.447   8.888   4.041
  834    HZ2  TRP  97           HZ2      TRP  97   4.835   6.375  -0.246
  835    HZ3  TRP  97           HZ3      TRP  97   5.647   6.736   3.931
  836    HH2  TRP  97           HH2      TRP  97   5.834   5.505   1.825
  837    H    ASP  98           H        ASP  98   1.726  10.255   5.574
  838    HA   ASP  98           HA       ASP  98   1.420  12.849   6.899
  839    HB2  ASP  98           2HB      ASP  98  -0.882  11.906   6.821
  840    HB3  ASP  98           3HB      ASP  98  -0.307  10.404   7.536
  841    H    GLY  99           H        GLY  99   3.537  12.756   7.518
  842    HA2  GLY  99           2HA      GLY  99   5.317  12.368   8.887
  843    HA3  GLY  99           3HA      GLY  99   4.269  11.362   9.871
  844    H    ASP 100           H        ASP 100   4.179   9.144   9.479
  845    HA   ASP 100           HA       ASP 100   6.481   7.992   7.991
  846    HB2  ASP 100           2HB      ASP 100   6.558   7.951  10.545
  847    HB3  ASP 100           3HB      ASP 100   5.139   6.911  10.523
  848    H    THR 101           H        THR 101   3.096   8.057   8.382
  849    HA   THR 101           HA       THR 101   2.554   5.441   7.124
  850    HB   THR 101           HB       THR 101   0.754   7.425   8.594
  851    HG1  THR 101           HG1      THR 101   2.294   6.061   9.797
  852   HG21  THR 101          3HG2      THR 101  -0.597   6.260   6.886
  853   HG22  THR 101          1HG2      THR 101  -1.021   5.696   8.506
  854   HG23  THR 101          2HG2      THR 101  -0.002   4.701   7.462
  855    H    VAL 102           H        VAL 102   1.345   5.314   5.188
  856    HA   VAL 102           HA       VAL 102   0.696   7.849   3.766
  857    HB   VAL 102           HB       VAL 102   2.285   6.556   2.461
  858   HG11  VAL 102          1HG1      VAL 102   1.892   4.253   1.696
  859   HG12  VAL 102          2HG1      VAL 102   0.426   4.174   2.668
  860   HG13  VAL 102          3HG1      VAL 102   1.995   4.347   3.455
  861   HG21  VAL 102          3HG2      VAL 102   1.033   6.197   0.349
  862   HG22  VAL 102          1HG2      VAL 102   0.539   7.687   1.160
  863   HG23  VAL 102          2HG2      VAL 102  -0.489   6.254   1.245
  864    H    THR 103           H        THR 103  -1.400   8.317   3.991
  865    HA   THR 103           HA       THR 103  -3.435   6.217   4.351
  866    HB   THR 103           HB       THR 103  -3.666   9.231   4.819
  867    HG1  THR 103           HG1      THR 103  -2.270   7.824   6.273
  868   HG21  THR 103          3HG2      THR 103  -5.861   8.185   4.321
  869   HG22  THR 103          1HG2      THR 103  -5.761   8.660   6.019
  870   HG23  THR 103          2HG2      THR 103  -5.568   6.966   5.566
  871    H    VAL 104           H        VAL 104  -4.278   5.584   2.439
  872    HA   VAL 104           HA       VAL 104  -4.835   7.574   0.322
  873    HB   VAL 104           HB       VAL 104  -4.457   4.544   0.077
  874   HG11  VAL 104          1HG1      VAL 104  -4.595   4.886  -2.369
  875   HG12  VAL 104          2HG1      VAL 104  -4.981   6.590  -2.114
  876   HG13  VAL 104          3HG1      VAL 104  -6.106   5.341  -1.573
  877   HG21  VAL 104          3HG2      VAL 104  -2.692   6.842  -0.839
  878   HG22  VAL 104          1HG2      VAL 104  -2.407   5.132  -1.169
  879   HG23  VAL 104          2HG2      VAL 104  -2.347   5.730   0.489
  880    H    GLU 105           H        GLU 105  -6.901   8.242   0.512
  881    HA   GLU 105           HA       GLU 105  -9.042   6.279   1.109
  882    HB2  GLU 105           2HB      GLU 105  -8.818   8.222   2.717
  883    HB3  GLU 105           3HB      GLU 105  -9.109   9.324   1.377
  884    HG2  GLU 105           2HG      GLU 105 -11.359   8.247   1.055
  885    HG3  GLU 105           3HG      GLU 105 -11.062   7.291   2.506
  886    H    GLY 106           H        GLY 106  -9.984   5.616  -0.765
  887    HA2  GLY 106           2HA      GLY 106 -10.712   7.497  -2.872
  888    HA3  GLY 106           3HA      GLY 106  -9.439   6.357  -3.300
  889    H    GLN 107           H        GLN 107 -11.511   6.215  -4.837
  890    HA   GLN 107           HA       GLN 107 -13.669   4.569  -3.787
  891    HB2  GLN 107           2HB      GLN 107 -13.209   5.957  -6.455
  892    HB3  GLN 107           3HB      GLN 107 -14.548   4.839  -6.215
  893    HG2  GLN 107           2HG      GLN 107 -15.342   7.107  -5.957
  894    HG3  GLN 107           3HG      GLN 107 -15.425   6.287  -4.402
  895   HE21  GLN 107          1HE2      GLN 107 -13.794   8.781  -6.244
  896   HE22  GLN 107          2HE2      GLN 107 -13.021   9.540  -4.900
  897    H    LEU 108           H        LEU 108 -14.392   2.688  -4.766
  898    HA   LEU 108           HA       LEU 108 -12.479   0.723  -5.594
  899    HB2  LEU 108           2HB      LEU 108 -14.753   0.521  -4.259
  900    HB3  LEU 108           3HB      LEU 108 -15.501   0.493  -5.836
  901    HG   LEU 108           HG       LEU 108 -13.605  -1.580  -4.675
  902   HD11  LEU 108          1HD1      LEU 108 -15.589  -3.053  -4.833
  903   HD12  LEU 108          2HD1      LEU 108 -16.566  -1.669  -5.311
  904   HD13  LEU 108          3HD1      LEU 108 -15.809  -1.713  -3.714
  905   HD21  LEU 108          3HD2      LEU 108 -14.885  -1.580  -7.429
  906   HD22  LEU 108          1HD2      LEU 108 -14.049  -2.948  -6.691
  907   HD23  LEU 108          2HD2      LEU 108 -13.162  -1.479  -7.066
  908    H    GLU 109           H        GLU 109 -12.001   0.127  -7.704
  909    HA   GLU 109           HA       GLU 109 -12.419   1.731  -9.919
  910    HB2  GLU 109           2HB      GLU 109 -10.629   0.021  -9.732
  911    HB3  GLU 109           3HB      GLU 109 -11.829  -1.259  -9.873
  912    HG2  GLU 109           2HG      GLU 109 -10.690  -0.991 -11.996
  913    HG3  GLU 109           3HG      GLU 109 -12.365  -0.470 -12.176
  914    H    GLY 110           H        GLY 110 -13.914  -1.469  -9.450
  915    HA2  GLY 110           2HA      GLY 110 -16.551  -0.656 -10.195
  916    HA3  GLY 110           3HA      GLY 110 -15.738  -1.513 -11.505
  917    H    VAL 111           H        VAL 111 -17.887  -2.008  -9.163
  918    HA   VAL 111           HA       VAL 111 -17.068  -4.472  -7.979
  919    HB   VAL 111           HB       VAL 111 -19.896  -3.397  -8.431
  920   HG11  VAL 111          1HG1      VAL 111 -20.600  -4.948  -6.641
  921   HG12  VAL 111          2HG1      VAL 111 -18.966  -5.609  -6.552
  922   HG13  VAL 111          3HG1      VAL 111 -19.927  -5.830  -8.016
  923   HG21  VAL 111          3HG2      VAL 111 -19.765  -2.621  -6.092
  924   HG22  VAL 111          1HG2      VAL 111 -18.524  -1.863  -7.091
  925   HG23  VAL 111          2HG2      VAL 111 -18.092  -3.176  -5.990
  926    H    ASP 112           H        ASP 112 -16.501  -6.099  -9.266
  927    HA   ASP 112           HA       ASP 112 -16.480  -7.801 -10.716
  928    HB2  ASP 112           2HB      ASP 112 -18.744  -8.364  -9.949
  929    HB3  ASP 112           3HB      ASP 112 -19.451  -7.181 -11.043
  930    H    LEU 113           H        LEU 113 -15.034  -6.794 -12.049
  931    HA   LEU 113           HA       LEU 113 -15.682  -4.794 -13.967
  932    HB2  LEU 113           2HB      LEU 113 -13.204  -6.518 -13.603
  933    HB3  LEU 113           3HB      LEU 113 -13.306  -5.245 -14.811
  934    HG   LEU 113           HG       LEU 113 -13.541  -4.804 -11.799
  935   HD11  LEU 113          1HD1      LEU 113 -11.198  -4.184 -13.632
  936   HD12  LEU 113          2HD1      LEU 113 -11.260  -5.457 -12.411
  937   HD13  LEU 113          3HD1      LEU 113 -11.328  -3.768 -11.918
  938   HD21  LEU 113          3HD2      LEU 113 -13.409  -2.409 -12.333
  939   HD22  LEU 113          1HD2      LEU 113 -14.827  -3.152 -13.069
  940   HD23  LEU 113          2HD2      LEU 113 -13.414  -2.779 -14.060
  941    H    GLU 114           H        GLU 114 -16.445  -4.990 -15.951
  942    HA   GLU 114           HA       GLU 114 -17.046  -7.391 -17.321
  943    HB2  GLU 114           2HB      GLU 114 -16.758  -4.535 -18.375
  944    HB3  GLU 114           3HB      GLU 114 -17.505  -5.864 -19.262
  945    HG2  GLU 114           2HG      GLU 114 -19.322  -6.008 -17.683
  946    HG3  GLU 114           3HG      GLU 114 -18.534  -4.878 -16.581
  947    H    HIS 115           H        HIS 115 -14.550  -4.906 -17.830
  948    HA   HIS 115           HA       HIS 115 -12.930  -6.562 -19.580
  949    HB2  HIS 115           2HB      HIS 115 -13.128  -4.007 -19.718
  950    HB3  HIS 115           3HB      HIS 115 -12.206  -3.920 -18.226
  951    HD1  HIS 115           HD1      HIS 115 -11.875  -4.601 -21.890
  952    HD2  HIS 115           HD2      HIS 115  -9.433  -4.372 -18.535
  953    HE1  HIS 115           HE1      HIS 115  -9.523  -4.477 -22.767
  954    HE2  HIS 115           HE2      HIS 115  -8.091  -4.172 -20.723
  955    H    HIS 116           H        HIS 116 -12.759  -8.384 -18.120
  956    HA   HIS 116           HA       HIS 116 -11.223  -7.961 -15.630
  957    HB2  HIS 116           2HB      HIS 116 -12.182 -10.005 -14.762
  958    HB3  HIS 116           3HB      HIS 116 -13.470  -8.970 -15.355
  959    HD1  HIS 116           HD1      HIS 116 -11.878 -12.291 -15.851
  960    HD2  HIS 116           HD2      HIS 116 -14.871 -10.019 -17.621
  961    HE1  HIS 116           HE1      HIS 116 -13.123 -13.865 -17.356
  962    HE2  HIS 116           HE2      HIS 116 -15.028 -12.503 -18.278
  963    H    HIS 117           H        HIS 117 -10.699  -9.113 -18.787
  964    HA   HIS 117           HA       HIS 117  -8.681 -11.078 -18.108
  965    HB2  HIS 117           2HB      HIS 117  -9.143  -9.618 -20.746
  966    HB3  HIS 117           3HB      HIS 117  -8.029 -10.961 -20.518
  967    HD1  HIS 117           HD1      HIS 117 -10.549 -10.893 -22.475
  968    HD2  HIS 117           HD2      HIS 117 -10.332 -12.812 -18.793
  969    HE1  HIS 117           HE1      HIS 117 -12.283 -12.704 -22.557
  970    HE2  HIS 117           HE2      HIS 117 -11.995 -13.961 -20.394
  971    H    HIS 118           H        HIS 118  -7.520  -9.941 -16.554
  972    HA   HIS 118           HA       HIS 118  -5.172  -8.574 -17.429
  973    HB2  HIS 118           2HB      HIS 118  -5.463  -6.442 -16.228
  974    HB3  HIS 118           3HB      HIS 118  -6.767  -6.615 -17.400
  975    HD1  HIS 118           HD1      HIS 118  -6.102  -6.381 -13.734
  976    HD2  HIS 118           HD2      HIS 118  -9.340  -6.978 -16.248
  977    HE1  HIS 118           HE1      HIS 118  -8.133  -6.100 -12.288
  978    HE2  HIS 118           HE2      HIS 118 -10.065  -6.674 -13.798
  979    H    HIS 119           H        HIS 119  -3.642  -8.332 -15.596
  980    HA   HIS 119           HA       HIS 119  -3.925 -10.419 -13.652
  981    HB2  HIS 119           2HB      HIS 119  -1.662 -10.169 -13.329
  982    HB3  HIS 119           3HB      HIS 119  -1.719  -9.098 -14.716
  983    HD1  HIS 119           HD1      HIS 119  -1.977  -6.436 -14.035
  984    HD2  HIS 119           HD2      HIS 119  -0.752  -9.001 -11.028
  985    HE1  HIS 119           HE1      HIS 119  -1.089  -4.966 -12.218
  986    HE2  HIS 119           HE2      HIS 119  -0.668  -6.536 -10.306
  987    H    HIS 120           H        HIS 120  -3.951 -10.156 -11.344
  988    HA   HIS 120           HA       HIS 120  -5.632  -7.975 -10.382
  989    HB2  HIS 120           2HB      HIS 120  -4.523 -10.443  -8.976
  990    HB3  HIS 120           3HB      HIS 120  -5.630  -9.291  -8.242
  991    HD1  HIS 120           HD1      HIS 120  -8.093  -9.586  -8.715
  992    HD2  HIS 120           HD2      HIS 120  -5.699 -12.038 -11.064
  993    HE1  HIS 120           HE1      HIS 120  -9.669 -11.149  -9.895
  994    HE2  HIS 120           HE2      HIS 120  -8.207 -12.547 -11.390
  Start of MODEL   20
    1    H1   MET   1           1H       MET   1  16.548   1.322  -1.789
    2    H2   MET   1           2H       MET   1  17.175   2.388  -2.944
    3    H3   MET   1           3H       MET   1  18.192   1.730  -1.768
    4    HA   MET   1           HA       MET   1  16.789   0.211  -3.882
    5    HB2  MET   1           2HB      MET   1  18.887  -0.021  -5.037
    6    HB3  MET   1           3HB      MET   1  18.732   1.689  -4.664
    7    HG2  MET   1           2HG      MET   1  20.296   1.457  -2.804
    8    HG3  MET   1           3HG      MET   1  20.397  -0.283  -3.074
    9    HE1  MET   1           3HE      MET   1  23.941   0.660  -4.266
   10    HE2  MET   1           1HE      MET   1  22.961  -0.454  -3.313
   11    HE3  MET   1           2HE      MET   1  23.080   1.244  -2.843
   12    H    SER   2           H        SER   2  17.585   0.074  -0.747
   13    HA   SER   2           HA       SER   2  19.269  -2.131  -0.399
   14    HB2  SER   2           2HB      SER   2  18.777  -0.520   1.400
   15    HB3  SER   2           3HB      SER   2  17.089  -1.031   1.431
   16    HG   SER   2           HG       SER   2  19.039  -2.000   2.842
   17    H    GLY   3           H        GLY   3  18.936  -4.233  -0.763
   18    HA2  GLY   3           2HA      GLY   3  16.412  -5.466  -1.362
   19    HA3  GLY   3           3HA      GLY   3  17.956  -6.277  -1.119
   20    H    LYS   4           H        LYS   4  15.357  -4.659   0.591
   21    HA   LYS   4           HA       LYS   4  15.947  -6.139   3.078
   22    HB2  LYS   4           2HB      LYS   4  14.640  -4.182   4.186
   23    HB3  LYS   4           3HB      LYS   4  16.260  -3.847   3.607
   24    HG2  LYS   4           2HG      LYS   4  14.870  -1.957   3.082
   25    HG3  LYS   4           3HG      LYS   4  15.284  -2.767   1.574
   26    HD2  LYS   4           2HD      LYS   4  13.015  -3.842   1.582
   27    HD3  LYS   4           3HD      LYS   4  12.618  -2.937   3.045
   28    HE2  LYS   4           2HE      LYS   4  11.686  -1.859   1.044
   29    HE3  LYS   4           3HE      LYS   4  12.888  -0.825   1.814
   30    HZ1  LYS   4           3HZ      LYS   4  14.513  -1.607   0.137
   31    HZ2  LYS   4           1HZ      LYS   4  13.196  -0.797  -0.558
   32    HZ3  LYS   4           2HZ      LYS   4  13.284  -2.485  -0.622
   33    H    LYS   5           H        LYS   5  13.955  -6.385   4.459
   34    HA   LYS   5           HA       LYS   5  11.606  -7.232   2.911
   35    HB2  LYS   5           2HB      LYS   5  12.578  -8.837   4.576
   36    HB3  LYS   5           3HB      LYS   5  12.275  -7.670   5.859
   37    HG2  LYS   5           2HG      LYS   5   9.801  -7.809   5.280
   38    HG3  LYS   5           3HG      LYS   5  10.198  -9.123   4.176
   39    HD2  LYS   5           2HD      LYS   5   9.476 -10.219   6.140
   40    HD3  LYS   5           3HD      LYS   5  11.233 -10.313   6.224
   41    HE2  LYS   5           2HE      LYS   5   9.530  -8.275   7.706
   42    HE3  LYS   5           3HE      LYS   5  10.154  -9.759   8.411
   43    HZ1  LYS   5           3HZ      LYS   5  11.754  -7.467   7.420
   44    HZ2  LYS   5           1HZ      LYS   5  12.407  -8.920   7.986
   45    HZ3  LYS   5           2HZ      LYS   5  11.528  -7.926   9.028
   46    H    VAL   6           H        VAL   6  10.162  -5.632   2.635
   47    HA   VAL   6           HA       VAL   6   9.657  -3.629   4.746
   48    HB   VAL   6           HB       VAL   6   9.926  -2.390   2.728
   49   HG11  VAL   6          1HG1      VAL   6   8.277  -4.486   1.250
   50   HG12  VAL   6          2HG1      VAL   6  10.026  -4.280   1.146
   51   HG13  VAL   6          3HG1      VAL   6   8.955  -3.021   0.530
   52   HG21  VAL   6          3HG2      VAL   6   7.700  -1.521   2.109
   53   HG22  VAL   6          1HG2      VAL   6   7.832  -1.752   3.856
   54   HG23  VAL   6          2HG2      VAL   6   6.929  -2.910   2.879
   55    H    GLU   7           H        GLU   7   7.853  -3.864   5.929
   56    HA   GLU   7           HA       GLU   7   5.886  -5.932   5.160
   57    HB2  GLU   7           2HB      GLU   7   6.419  -4.700   7.891
   58    HB3  GLU   7           3HB      GLU   7   5.235  -5.956   7.544
   59    HG2  GLU   7           2HG      GLU   7   7.061  -7.480   6.843
   60    HG3  GLU   7           3HG      GLU   7   8.243  -6.222   7.208
   61    H    VAL   8           H        VAL   8   4.180  -5.191   4.250
   62    HA   VAL   8           HA       VAL   8   3.405  -2.374   4.336
   63    HB   VAL   8           HB       VAL   8   2.655  -4.682   2.467
   64   HG11  VAL   8          1HG1      VAL   8   1.862  -1.760   2.213
   65   HG12  VAL   8          2HG1      VAL   8   0.772  -3.088   2.610
   66   HG13  VAL   8          3HG1      VAL   8   1.540  -3.023   1.023
   67   HG21  VAL   8          3HG2      VAL   8   4.995  -3.903   2.222
   68   HG22  VAL   8          1HG2      VAL   8   4.423  -2.251   1.967
   69   HG23  VAL   8          2HG2      VAL   8   4.039  -3.512   0.793
   70    H    GLN   9           H        GLN   9   1.962  -1.933   5.901
   71    HA   GLN   9           HA       GLN   9   0.133  -4.029   6.898
   72    HB2  GLN   9           2HB      GLN   9   0.972  -1.394   8.196
   73    HB3  GLN   9           3HB      GLN   9   0.043  -2.683   8.960
   74    HG2  GLN   9           2HG      GLN   9   1.967  -4.179   8.886
   75    HG3  GLN   9           3HG      GLN   9   2.898  -2.993   7.970
   76   HE21  GLN   9          1HE2      GLN   9   4.548  -2.943   9.531
   77   HE22  GLN   9          2HE2      GLN   9   4.338  -2.200  11.078
   78    H    VAL  10           H        VAL  10  -1.650  -3.907   5.665
   79    HA   VAL  10           HA       VAL  10  -2.688  -1.329   4.715
   80    HB   VAL  10           HB       VAL  10  -3.555  -4.172   3.988
   81   HG11  VAL  10          1HG1      VAL  10  -4.229  -1.525   2.646
   82   HG12  VAL  10          2HG1      VAL  10  -5.343  -2.528   3.578
   83   HG13  VAL  10          3HG1      VAL  10  -4.692  -3.122   2.049
   84   HG21  VAL  10          3HG2      VAL  10  -1.216  -3.770   3.302
   85   HG22  VAL  10          1HG2      VAL  10  -1.706  -2.299   2.455
   86   HG23  VAL  10          2HG2      VAL  10  -2.272  -3.874   1.892
   87    H    LYS  11           H        LYS  11  -4.000  -0.368   6.156
   88    HA   LYS  11           HA       LYS  11  -5.928  -1.942   7.759
   89    HB2  LYS  11           2HB      LYS  11  -4.314  -0.536   9.048
   90    HB3  LYS  11           3HB      LYS  11  -4.852   0.892   8.169
   91    HG2  LYS  11           2HG      LYS  11  -7.127   0.617   9.153
   92    HG3  LYS  11           3HG      LYS  11  -6.553  -0.788  10.053
   93    HD2  LYS  11           2HD      LYS  11  -5.549   2.069  10.370
   94    HD3  LYS  11           3HD      LYS  11  -6.626   1.222  11.482
   95    HE2  LYS  11           2HE      LYS  11  -4.815  -0.429  11.941
   96    HE3  LYS  11           3HE      LYS  11  -3.742   0.469  10.865
   97    HZ1  LYS  11           3HZ      LYS  11  -4.993   1.549  13.332
   98    HZ2  LYS  11           1HZ      LYS  11  -3.926   2.375  12.313
   99    HZ3  LYS  11           2HZ      LYS  11  -3.390   1.035  13.188
  100    H    ILE  12           H        ILE  12  -7.735  -2.056   6.500
  101    HA   ILE  12           HA       ILE  12  -8.686   0.377   5.110
  102    HB   ILE  12           HB       ILE  12  -7.903  -1.170   3.428
  103   HG12  ILE  12          2HG1      ILE  12 -10.956  -1.254   3.469
  104   HG13  ILE  12          3HG1      ILE  12  -9.998   0.128   2.953
  105   HG21  ILE  12          1HG2      ILE  12  -8.783  -3.451   3.121
  106   HG22  ILE  12          2HG2      ILE  12  -9.736  -3.287   4.597
  107   HG23  ILE  12          3HG2      ILE  12  -7.973  -3.278   4.681
  108   HD11  ILE  12          3HD1      ILE  12 -10.083  -2.575   1.611
  109   HD12  ILE  12          1HD1      ILE  12  -9.086  -1.207   1.106
  110   HD13  ILE  12          2HD1      ILE  12 -10.843  -1.087   1.053
  111    H    THR  13           H        THR  13 -10.543   1.126   5.822
  112    HA   THR  13           HA       THR  13 -12.279  -0.484   7.528
  113    HB   THR  13           HB       THR  13 -12.489   2.470   6.796
  114    HG1  THR  13           HG1      THR  13 -11.377   1.217   9.109
  115   HG21  THR  13          3HG2      THR  13 -13.900   2.627   8.827
  116   HG22  THR  13          1HG2      THR  13 -13.773   0.888   9.068
  117   HG23  THR  13          2HG2      THR  13 -14.625   1.522   7.654
  118    H    CYS  14           H        CYS  14 -14.066  -1.412   6.779
  119    HA   CYS  14           HA       CYS  14 -15.555  -0.537   4.474
  120    HB2  CYS  14           2HB      CYS  14 -13.791  -1.692   3.298
  121    HB3  CYS  14           3HB      CYS  14 -13.826  -3.045   4.418
  122    H    ASN  15           H        ASN  15 -17.599  -0.933   4.930
  123    HA   ASN  15           HA       ASN  15 -19.548  -1.787   5.620
  124    HB2  ASN  15           2HB      ASN  15 -18.510  -3.898   4.496
  125    HB3  ASN  15           3HB      ASN  15 -18.185  -4.474   6.124
  126   HD21  ASN  15          1HD2      ASN  15 -20.714  -3.594   3.856
  127   HD22  ASN  15          2HD2      ASN  15 -21.974  -4.478   4.639
  128    H    GLY  16           H        GLY  16 -17.608  -0.591   7.483
  129    HA2  GLY  16           2HA      GLY  16 -17.877   0.163   9.668
  130    HA3  GLY  16           3HA      GLY  16 -19.019  -1.128   9.985
  131    H    LYS  17           H        LYS  17 -16.332  -2.504   8.597
  132    HA   LYS  17           HA       LYS  17 -15.142  -3.242  11.216
  133    HB2  LYS  17           2HB      LYS  17 -15.172  -4.739   8.558
  134    HB3  LYS  17           3HB      LYS  17 -14.378  -5.307  10.021
  135    HG2  LYS  17           2HG      LYS  17 -17.371  -4.827   9.791
  136    HG3  LYS  17           3HG      LYS  17 -16.599  -6.390   9.521
  137    HD2  LYS  17           2HD      LYS  17 -16.533  -4.816  12.128
  138    HD3  LYS  17           3HD      LYS  17 -17.571  -6.204  11.791
  139    HE2  LYS  17           2HE      LYS  17 -14.533  -6.226  11.900
  140    HE3  LYS  17           3HE      LYS  17 -15.623  -6.899  13.107
  141    HZ1  LYS  17           3HZ      LYS  17 -16.372  -8.522  11.525
  142    HZ2  LYS  17           1HZ      LYS  17 -14.688  -8.585  11.618
  143    HZ3  LYS  17           2HZ      LYS  17 -15.436  -7.846  10.294
  144    H    THR  18           H        THR  18 -12.830  -3.442  11.326
  145    HA   THR  18           HA       THR  18 -11.336  -1.781   9.362
  146    HB   THR  18           HB       THR  18 -10.682  -2.265  12.307
  147    HG1  THR  18           HG1      THR  18 -12.640  -0.986  11.832
  148   HG21  THR  18          3HG2      THR  18  -9.107  -0.378  12.030
  149   HG22  THR  18          1HG2      THR  18  -9.531  -0.260  10.326
  150   HG23  THR  18          2HG2      THR  18  -8.694  -1.695  10.927
  151    H    TYR  19           H        TYR  19 -10.155  -3.100   8.051
  152    HA   TYR  19           HA       TYR  19  -9.251  -5.757   9.019
  153    HB2  TYR  19           2HB      TYR  19  -9.446  -4.799   6.119
  154    HB3  TYR  19           3HB      TYR  19  -9.168  -6.444   6.677
  155    HD1  TYR  19           HD1      TYR  19 -11.056  -7.798   7.580
  156    HD2  TYR  19           HD2      TYR  19 -11.706  -3.846   6.082
  157    HE1  TYR  19           HE1      TYR  19 -13.476  -8.225   7.479
  158    HE2  TYR  19           HE2      TYR  19 -14.116  -4.279   5.982
  159    HH   TYR  19           HH       TYR  19 -15.691  -6.070   5.936
  160    H    GLU  20           H        GLU  20  -7.290  -5.280   9.940
  161    HA   GLU  20           HA       GLU  20  -5.288  -3.847   8.285
  162    HB2  GLU  20           2HB      GLU  20  -4.158  -3.254  10.456
  163    HB3  GLU  20           3HB      GLU  20  -5.711  -2.491  10.186
  164    HG2  GLU  20           2HG      GLU  20  -6.717  -4.287  11.708
  165    HG3  GLU  20           3HG      GLU  20  -5.060  -4.721  12.130
  166    H    ARG  21           H        ARG  21  -3.595  -4.954   7.633
  167    HA   ARG  21           HA       ARG  21  -2.943  -7.585   8.804
  168    HB2  ARG  21           2HB      ARG  21  -4.685  -7.897   7.006
  169    HB3  ARG  21           3HB      ARG  21  -3.598  -7.142   5.850
  170    HG2  ARG  21           2HG      ARG  21  -3.242  -9.407   5.420
  171    HG3  ARG  21           3HG      ARG  21  -1.924  -9.059   6.538
  172    HD2  ARG  21           2HD      ARG  21  -4.574 -10.360   7.239
  173    HD3  ARG  21           3HD      ARG  21  -3.033 -11.194   7.069
  174    HE   ARG  21           HE       ARG  21  -2.351  -9.583   8.983
  175   HH11  ARG  21          1HH1      ARG  21  -5.493 -11.142   8.712
  176   HH12  ARG  21          2HH1      ARG  21  -5.758 -11.165  10.424
  177   HH21  ARG  21          1HH2      ARG  21  -2.699  -9.612  11.201
  178   HH22  ARG  21          2HH2      ARG  21  -4.162 -10.290  11.845
  179    H    THR  22           H        THR  22  -0.789  -7.807   8.923
  180    HA   THR  22           HA       THR  22   1.036  -6.020   7.533
  181    HB   THR  22           HB       THR  22   1.634  -8.284   9.496
  182    HG1  THR  22           HG1      THR  22   0.586  -5.780   9.847
  183   HG21  THR  22          3HG2      THR  22   3.756  -7.088   9.889
  184   HG22  THR  22          1HG2      THR  22   3.323  -5.886   8.676
  185   HG23  THR  22          2HG2      THR  22   3.621  -7.560   8.195
  186    H    TYR  23           H        TYR  23   1.525  -6.547   5.479
  187    HA   TYR  23           HA       TYR  23   1.799  -9.343   4.593
  188    HB2  TYR  23           2HB      TYR  23   1.658  -6.695   3.072
  189    HB3  TYR  23           3HB      TYR  23   2.043  -8.218   2.282
  190    HD1  TYR  23           HD1      TYR  23  -0.657  -6.246   3.881
  191    HD2  TYR  23           HD2      TYR  23   0.324  -9.911   1.900
  192    HE1  TYR  23           HE1      TYR  23  -3.050  -6.709   3.541
  193    HE2  TYR  23           HE2      TYR  23  -2.059 -10.381   1.574
  194    HH   TYR  23           HH       TYR  23  -4.178  -9.789   2.332
  195    H    GLN  24           H        GLN  24   3.774 -10.215   4.537
  196    HA   GLN  24           HA       GLN  24   6.172  -8.550   4.900
  197    HB2  GLN  24           2HB      GLN  24   5.795 -11.580   4.948
  198    HB3  GLN  24           3HB      GLN  24   7.353 -10.785   5.135
  199    HG2  GLN  24           2HG      GLN  24   6.602 -11.370   7.329
  200    HG3  GLN  24           3HG      GLN  24   6.441  -9.621   7.176
  201   HE21  GLN  24          1HE2      GLN  24   4.902  -9.478   8.827
  202   HE22  GLN  24          2HE2      GLN  24   3.289 -10.073   8.651
  203    H    LEU  25           H        LEU  25   6.998  -7.720   3.084
  204    HA   LEU  25           HA       LEU  25   7.058  -9.318   0.581
  205    HB2  LEU  25           2HB      LEU  25   6.719  -6.298   0.894
  206    HB3  LEU  25           3HB      LEU  25   6.983  -7.108  -0.643
  207    HG   LEU  25           HG       LEU  25   4.530  -7.412   1.142
  208   HD11  LEU  25          1HD1      LEU  25   3.318  -6.288  -0.659
  209   HD12  LEU  25          2HD1      LEU  25   4.814  -6.100  -1.580
  210   HD13  LEU  25          3HD1      LEU  25   4.612  -5.268  -0.037
  211   HD21  LEU  25          3HD2      LEU  25   5.120  -8.743  -1.529
  212   HD22  LEU  25          1HD2      LEU  25   3.575  -8.791  -0.671
  213   HD23  LEU  25          2HD2      LEU  25   4.999  -9.541   0.042
  214    H    TYR  26           H        TYR  26   9.027  -9.578  -0.297
  215    HA   TYR  26           HA       TYR  26  11.306  -7.893   0.579
  216    HB2  TYR  26           2HB      TYR  26  11.365 -10.186   1.630
  217    HB3  TYR  26           3HB      TYR  26  11.363 -10.913   0.030
  218    HD1  TYR  26           HD2      TYR  26  13.422 -10.557  -1.486
  219    HD2  TYR  26           HD1      TYR  26  13.403  -9.393   2.630
  220    HE1  TYR  26           HE2      TYR  26  15.878 -10.454  -1.503
  221    HE2  TYR  26           HE1      TYR  26  15.850  -9.294   2.608
  222    HH   TYR  26           HH       TYR  26  17.682  -9.249  -0.175
  223    H    ALA  27           H        ALA  27  12.485  -7.077  -1.063
  224    HA   ALA  27           HA       ALA  27  12.757  -8.427  -3.616
  225    HB1  ALA  27           3HB      ALA  27  12.033  -6.525  -5.004
  226    HB2  ALA  27           1HB      ALA  27  11.537  -5.636  -3.559
  227    HB3  ALA  27           2HB      ALA  27  10.697  -7.117  -4.018
  228    H    VAL  28           H        VAL  28  14.528  -7.680  -4.786
  229    HA   VAL  28           HA       VAL  28  16.679  -6.458  -3.391
  230    HB   VAL  28           HB       VAL  28  16.332  -6.993  -6.383
  231   HG11  VAL  28          1HG1      VAL  28  18.796  -6.824  -6.563
  232   HG12  VAL  28          2HG1      VAL  28  18.891  -6.351  -4.865
  233   HG13  VAL  28          3HG1      VAL  28  18.079  -5.302  -6.030
  234   HG21  VAL  28          3HG2      VAL  28  17.681  -9.031  -6.015
  235   HG22  VAL  28          1HG2      VAL  28  16.205  -9.067  -5.046
  236   HG23  VAL  28          2HG2      VAL  28  17.751  -8.687  -4.285
  237    H    ARG  29           H        ARG  29  14.815  -5.380  -6.250
  238    HA   ARG  29           HA       ARG  29  15.648  -2.598  -5.823
  239    HB2  ARG  29           2HB      ARG  29  14.201  -3.889  -8.168
  240    HB3  ARG  29           3HB      ARG  29  14.682  -2.199  -8.090
  241    HG2  ARG  29           2HG      ARG  29  17.056  -2.868  -8.050
  242    HG3  ARG  29           3HG      ARG  29  16.584  -4.573  -8.102
  243    HD2  ARG  29           2HD      ARG  29  15.542  -4.247 -10.290
  244    HD3  ARG  29           3HD      ARG  29  15.892  -2.518 -10.233
  245    HE   ARG  29           HE       ARG  29  18.268  -4.081 -10.009
  246   HH11  ARG  29          1HH1      ARG  29  15.917  -2.916 -12.373
  247   HH12  ARG  29          2HH1      ARG  29  17.040  -2.985 -13.695
  248   HH21  ARG  29          1HH2      ARG  29  19.719  -4.158 -11.751
  249   HH22  ARG  29          2HH2      ARG  29  19.200  -3.693 -13.339
  250    H    ASP  30           H        ASP  30  14.135  -0.929  -6.105
  251    HA   ASP  30           HA       ASP  30  11.739  -1.007  -4.602
  252    HB2  ASP  30           2HB      ASP  30  11.528   1.344  -5.293
  253    HB3  ASP  30           3HB      ASP  30  13.197   1.006  -4.862
  254    H    GLU  31           H        GLU  31  12.458  -1.172  -8.051
  255    HA   GLU  31           HA       GLU  31   9.865  -0.693  -9.088
  256    HB2  GLU  31           2HB      GLU  31  10.800  -1.465 -11.244
  257    HB3  GLU  31           3HB      GLU  31  11.871  -0.326 -10.438
  258    HG2  GLU  31           2HG      GLU  31  13.305  -2.177  -9.678
  259    HG3  GLU  31           3HG      GLU  31  12.228  -3.340 -10.447
  260    H    GLU  32           H        GLU  32  11.530  -3.592  -8.053
  261    HA   GLU  32           HA       GLU  32   9.793  -5.540  -9.168
  262    HB2  GLU  32           2HB      GLU  32  11.455  -5.762  -6.621
  263    HB3  GLU  32           3HB      GLU  32  10.853  -7.099  -7.600
  264    HG2  GLU  32           2HG      GLU  32  12.910  -5.051  -8.470
  265    HG3  GLU  32           3HG      GLU  32  13.271  -6.683  -7.923
  266    H    LEU  33           H        LEU  33   9.772  -3.614  -6.233
  267    HA   LEU  33           HA       LEU  33   7.807  -5.080  -4.794
  268    HB2  LEU  33           2HB      LEU  33   9.654  -3.106  -4.146
  269    HB3  LEU  33           3HB      LEU  33   8.162  -2.199  -4.081
  270    HG   LEU  33           HG       LEU  33   8.741  -2.979  -1.848
  271   HD11  LEU  33          1HD1      LEU  33   6.734  -4.160  -1.156
  272   HD12  LEU  33          2HD1      LEU  33   6.382  -4.598  -2.830
  273   HD13  LEU  33          3HD1      LEU  33   6.345  -2.905  -2.331
  274   HD21  LEU  33          3HD2      LEU  33   8.923  -5.346  -1.241
  275   HD22  LEU  33          1HD2      LEU  33  10.141  -4.893  -2.433
  276   HD23  LEU  33          2HD2      LEU  33   8.718  -5.811  -2.934
  277    H    LYS  34           H        LYS  34   7.628  -2.592  -7.278
  278    HA   LYS  34           HA       LYS  34   5.168  -1.378  -6.756
  279    HB2  LYS  34           2HB      LYS  34   6.383  -2.026  -9.474
  280    HB3  LYS  34           3HB      LYS  34   4.992  -0.968  -9.242
  281    HG2  LYS  34           2HG      LYS  34   6.418   0.561  -7.900
  282    HG3  LYS  34           3HG      LYS  34   7.812  -0.475  -8.232
  283    HD2  LYS  34           2HD      LYS  34   6.156   1.038 -10.301
  284    HD3  LYS  34           3HD      LYS  34   7.778   1.465  -9.754
  285    HE2  LYS  34           2HE      LYS  34   8.640  -0.664 -10.699
  286    HE3  LYS  34           3HE      LYS  34   7.020  -1.067 -11.258
  287    HZ1  LYS  34           3HZ      LYS  34   7.068   0.855 -12.689
  288    HZ2  LYS  34           1HZ      LYS  34   8.378  -0.158 -13.017
  289    HZ3  LYS  34           2HZ      LYS  34   8.611   1.274 -12.147
  290    H    GLU  35           H        GLU  35   5.710  -4.089  -9.058
  291    HA   GLU  35           HA       GLU  35   2.994  -4.571  -9.536
  292    HB2  GLU  35           2HB      GLU  35   3.729  -6.683 -10.621
  293    HB3  GLU  35           3HB      GLU  35   4.622  -5.272 -11.149
  294    HG2  GLU  35           2HG      GLU  35   6.305  -6.852 -10.981
  295    HG3  GLU  35           3HG      GLU  35   6.426  -6.042  -9.424
  296    H    LYS  36           H        LYS  36   5.081  -5.773  -6.988
  297    HA   LYS  36           HA       LYS  36   3.444  -7.902  -6.056
  298    HB2  LYS  36           2HB      LYS  36   5.420  -6.214  -4.455
  299    HB3  LYS  36           3HB      LYS  36   4.775  -7.790  -3.981
  300    HG2  LYS  36           2HG      LYS  36   5.858  -8.807  -5.963
  301    HG3  LYS  36           3HG      LYS  36   6.526  -7.230  -6.386
  302    HD2  LYS  36           2HD      LYS  36   7.713  -7.253  -4.130
  303    HD3  LYS  36           3HD      LYS  36   7.188  -8.933  -3.959
  304    HE2  LYS  36           2HE      LYS  36   9.035  -7.778  -6.071
  305    HE3  LYS  36           3HE      LYS  36   9.433  -8.965  -4.829
  306    HZ1  LYS  36           3HZ      LYS  36   7.895 -10.519  -5.944
  307    HZ2  LYS  36           1HZ      LYS  36   9.176 -10.041  -6.943
  308    HZ3  LYS  36           2HZ      LYS  36   7.635  -9.378  -7.162
  309    H    LEU  37           H        LEU  37   3.700  -4.460  -5.153
  310    HA   LEU  37           HA       LEU  37   1.763  -4.364  -3.124
  311    HB2  LEU  37           2HB      LEU  37   2.658  -2.245  -5.103
  312    HB3  LEU  37           3HB      LEU  37   1.554  -1.900  -3.780
  313    HG   LEU  37           HG       LEU  37   4.391  -2.929  -3.399
  314   HD11  LEU  37          1HD1      LEU  37   4.442  -0.709  -4.410
  315   HD12  LEU  37          2HD1      LEU  37   4.986  -0.652  -2.735
  316   HD13  LEU  37          3HD1      LEU  37   3.365  -0.091  -3.155
  317   HD21  LEU  37          3HD2      LEU  37   4.070  -2.278  -1.049
  318   HD22  LEU  37          1HD2      LEU  37   2.901  -3.502  -1.538
  319   HD23  LEU  37          2HD2      LEU  37   2.400  -1.813  -1.392
  320    H    LYS  38           H        LYS  38   1.439  -3.989  -6.690
  321    HA   LYS  38           HA       LYS  38  -1.301  -3.459  -6.846
  322    HB2  LYS  38           2HB      LYS  38   0.401  -5.073  -8.789
  323    HB3  LYS  38           3HB      LYS  38  -1.183  -4.385  -9.148
  324    HG2  LYS  38           2HG      LYS  38  -0.281  -2.110  -8.863
  325    HG3  LYS  38           3HG      LYS  38   1.302  -2.782  -8.452
  326    HD2  LYS  38           2HD      LYS  38   1.272  -2.033 -10.792
  327    HD3  LYS  38           3HD      LYS  38   1.469  -3.786 -10.709
  328    HE2  LYS  38           2HE      LYS  38  -0.971  -4.046 -11.195
  329    HE3  LYS  38           3HE      LYS  38  -1.104  -2.293 -11.343
  330    HZ1  LYS  38           3HZ      LYS  38  -0.887  -3.361 -13.492
  331    HZ2  LYS  38           1HZ      LYS  38   0.595  -4.038 -13.040
  332    HZ3  LYS  38           2HZ      LYS  38   0.439  -2.362 -13.185
  333    H    LYS  39           H        LYS  39   0.399  -6.617  -6.785
  334    HA   LYS  39           HA       LYS  39  -1.851  -8.296  -7.053
  335    HB2  LYS  39           2HB      LYS  39   0.706  -8.941  -5.523
  336    HB3  LYS  39           3HB      LYS  39  -0.441 -10.109  -6.170
  337    HG2  LYS  39           2HG      LYS  39   1.307  -8.249  -7.802
  338    HG3  LYS  39           3HG      LYS  39   1.620  -9.956  -7.525
  339    HD2  LYS  39           2HD      LYS  39  -0.813  -8.855  -8.990
  340    HD3  LYS  39           3HD      LYS  39   0.652  -9.442  -9.777
  341    HE2  LYS  39           2HE      LYS  39  -1.229 -11.091  -8.060
  342    HE3  LYS  39           3HE      LYS  39  -1.084 -11.163  -9.814
  343    HZ1  LYS  39           3HZ      LYS  39   0.107 -12.963  -8.759
  344    HZ2  LYS  39           1HZ      LYS  39   1.053 -11.878  -7.872
  345    HZ3  LYS  39           2HZ      LYS  39   1.192 -11.941  -9.557
  346    H    VAL  40           H        VAL  40  -0.121  -7.218  -4.134
  347    HA   VAL  40           HA       VAL  40  -1.614  -8.399  -2.118
  348    HB   VAL  40           HB       VAL  40   0.021  -5.828  -2.166
  349   HG11  VAL  40          1HG1      VAL  40   0.048  -5.858   0.314
  350   HG12  VAL  40          2HG1      VAL  40  -1.151  -7.153   0.303
  351   HG13  VAL  40          3HG1      VAL  40  -1.570  -5.556  -0.325
  352   HG21  VAL  40          3HG2      VAL  40   1.286  -7.915  -2.526
  353   HG22  VAL  40          1HG2      VAL  40   0.635  -8.580  -1.027
  354   HG23  VAL  40          2HG2      VAL  40   1.717  -7.186  -0.977
  355    H    LEU  41           H        LEU  41  -2.129  -5.258  -3.719
  356    HA   LEU  41           HA       LEU  41  -4.314  -4.461  -2.047
  357    HB2  LEU  41           2HB      LEU  41  -3.205  -3.391  -4.656
  358    HB3  LEU  41           3HB      LEU  41  -4.654  -2.707  -3.931
  359    HG   LEU  41           HG       LEU  41  -1.962  -2.836  -2.502
  360   HD11  LEU  41          1HD1      LEU  41  -1.719  -0.445  -2.961
  361   HD12  LEU  41          2HD1      LEU  41  -3.185  -0.469  -3.945
  362   HD13  LEU  41          3HD1      LEU  41  -1.764  -1.383  -4.453
  363   HD21  LEU  41          3HD2      LEU  41  -2.967  -1.249  -0.926
  364   HD22  LEU  41          1HD2      LEU  41  -3.898  -2.743  -0.984
  365   HD23  LEU  41          2HD2      LEU  41  -4.493  -1.299  -1.812
  366    H    ASN  42           H        ASN  42  -4.094  -6.039  -5.261
  367    HA   ASN  42           HA       ASN  42  -6.878  -6.228  -5.733
  368    HB2  ASN  42           2HB      ASN  42  -4.427  -7.603  -6.825
  369    HB3  ASN  42           3HB      ASN  42  -5.969  -8.407  -7.101
  370   HD21  ASN  42          1HD2      ASN  42  -4.082  -5.525  -7.814
  371   HD22  ASN  42          2HD2      ASN  42  -5.054  -5.004  -9.137
  372    H    GLU  43           H        GLU  43  -4.734  -8.186  -3.712
  373    HA   GLU  43           HA       GLU  43  -6.597 -10.348  -3.338
  374    HB2  GLU  43           2HB      GLU  43  -4.135  -9.579  -1.720
  375    HB3  GLU  43           3HB      GLU  43  -5.059 -11.061  -1.491
  376    HG2  GLU  43           2HG      GLU  43  -3.477 -10.280  -3.956
  377    HG3  GLU  43           3HG      GLU  43  -3.037 -11.503  -2.773
  378    H    ARG  44           H        ARG  44  -5.506  -7.642  -1.263
  379    HA   ARG  44           HA       ARG  44  -7.219  -8.241   0.916
  380    HB2  ARG  44           2HB      ARG  44  -5.145  -6.985   1.246
  381    HB3  ARG  44           3HB      ARG  44  -5.714  -5.689   0.207
  382    HG2  ARG  44           2HG      ARG  44  -5.784  -5.119   2.635
  383    HG3  ARG  44           3HG      ARG  44  -7.354  -4.991   1.847
  384    HD2  ARG  44           2HD      ARG  44  -7.410  -6.027   4.149
  385    HD3  ARG  44           3HD      ARG  44  -8.131  -7.023   2.882
  386    HE   ARG  44           HE       ARG  44  -5.411  -7.710   3.239
  387   HH11  ARG  44          1HH1      ARG  44  -8.501  -8.099   4.898
  388   HH12  ARG  44          2HH1      ARG  44  -8.023  -9.571   5.676
  389   HH21  ARG  44          1HH2      ARG  44  -4.857  -9.689   4.182
  390   HH22  ARG  44          2HH2      ARG  44  -5.956 -10.474   5.268
  391    H    MET  45           H        MET  45  -7.587  -6.141  -1.932
  392    HA   MET  45           HA       MET  45 -10.072  -4.994  -0.919
  393    HB2  MET  45           2HB      MET  45  -8.540  -4.498  -3.485
  394    HB3  MET  45           3HB      MET  45 -10.100  -3.769  -3.160
  395    HG2  MET  45           2HG      MET  45  -9.020  -2.806  -1.026
  396    HG3  MET  45           3HG      MET  45  -7.481  -3.284  -1.743
  397    HE1  MET  45           3HE      MET  45 -10.786  -1.854  -3.466
  398    HE2  MET  45           1HE      MET  45 -10.356  -0.147  -3.560
  399    HE3  MET  45           2HE      MET  45 -10.603  -0.905  -1.988
  400    H    ASP  46           H        ASP  46  -9.287  -7.840  -2.649
  401    HA   ASP  46           HA       ASP  46 -11.441  -8.000  -4.452
  402    HB2  ASP  46           2HB      ASP  46  -9.605  -9.609  -4.604
  403    HB3  ASP  46           3HB      ASP  46 -10.014 -10.295  -3.039
  404    HA   PRO  47           HA       PRO  47 -14.196  -9.998  -0.866
  405    HB2  PRO  47           2HB      PRO  47 -13.429  -9.339   1.734
  406    HB3  PRO  47           3HB      PRO  47 -13.027 -10.878   0.942
  407    HG2  PRO  47           2HG      PRO  47 -11.336  -8.409   1.215
  408    HG3  PRO  47           3HG      PRO  47 -10.884 -10.115   1.450
  409    HD2  PRO  47           2HD      PRO  47 -10.252  -8.843  -0.818
  410    HD3  PRO  47           3HD      PRO  47 -10.755 -10.544  -0.848
  411    H    ILE  48           H        ILE  48 -12.527  -6.916  -0.664
  412    HA   ILE  48           HA       ILE  48 -14.482  -5.486   0.881
  413    HB   ILE  48           HB       ILE  48 -12.217  -4.436  -0.875
  414   HG12  ILE  48          2HG1      ILE  48 -11.350  -5.884   0.906
  415   HG13  ILE  48          3HG1      ILE  48 -10.917  -4.216   1.238
  416   HG21  ILE  48          1HG2      ILE  48 -13.793  -2.957   1.254
  417   HG22  ILE  48          2HG2      ILE  48 -13.858  -2.666  -0.483
  418   HG23  ILE  48          3HG2      ILE  48 -12.375  -2.331   0.410
  419   HD11  ILE  48          3HD1      ILE  48 -11.525  -5.394   3.251
  420   HD12  ILE  48          1HD1      ILE  48 -13.109  -5.790   2.587
  421   HD13  ILE  48          2HD1      ILE  48 -12.686  -4.110   2.928
  422    H    LYS  49           H        LYS  49 -13.884  -5.980  -2.579
  423    HA   LYS  49           HA       LYS  49 -15.716  -3.989  -3.535
  424    HB2  LYS  49           2HB      LYS  49 -14.736  -6.463  -5.013
  425    HB3  LYS  49           3HB      LYS  49 -15.485  -5.037  -5.727
  426    HG2  LYS  49           2HG      LYS  49 -13.531  -3.683  -5.119
  427    HG3  LYS  49           3HG      LYS  49 -12.782  -5.083  -4.357
  428    HD2  LYS  49           2HD      LYS  49 -13.458  -4.810  -7.314
  429    HD3  LYS  49           3HD      LYS  49 -11.846  -4.693  -6.606
  430    HE2  LYS  49           2HE      LYS  49 -11.976  -7.053  -5.892
  431    HE3  LYS  49           3HE      LYS  49 -13.607  -7.174  -6.551
  432    HZ1  LYS  49           3HZ      LYS  49 -12.679  -6.689  -8.751
  433    HZ2  LYS  49           1HZ      LYS  49 -12.029  -8.098  -8.078
  434    HZ3  LYS  49           2HZ      LYS  49 -11.123  -6.673  -8.094
  435    H    LYS  50           H        LYS  50 -15.892  -7.470  -2.835
  436    HA   LYS  50           HA       LYS  50 -18.604  -7.805  -3.687
  437    HB2  LYS  50           2HB      LYS  50 -16.890  -9.613  -3.653
  438    HB3  LYS  50           3HB      LYS  50 -16.880  -9.570  -1.901
  439    HG2  LYS  50           2HG      LYS  50 -19.475 -10.120  -3.343
  440    HG3  LYS  50           3HG      LYS  50 -18.274 -11.402  -3.240
  441    HD2  LYS  50           2HD      LYS  50 -19.580  -9.974  -0.881
  442    HD3  LYS  50           3HD      LYS  50 -19.949 -11.608  -1.440
  443    HE2  LYS  50           2HE      LYS  50 -17.632 -12.305  -0.890
  444    HE3  LYS  50           3HE      LYS  50 -17.282 -10.673  -0.314
  445    HZ1  LYS  50           3HZ      LYS  50 -18.851 -10.944   1.436
  446    HZ2  LYS  50           1HZ      LYS  50 -17.822 -12.284   1.450
  447    HZ3  LYS  50           2HZ      LYS  50 -19.385 -12.424   0.822
  448    H    LEU  51           H        LEU  51 -17.049  -6.794  -0.718
  449    HA   LEU  51           HA       LEU  51 -19.382  -6.891   0.977
  450    HB2  LEU  51           2HB      LEU  51 -16.793  -5.297   1.186
  451    HB3  LEU  51           3HB      LEU  51 -18.067  -5.195   2.390
  452    HG   LEU  51           HG       LEU  51 -16.524  -7.730   1.710
  453   HD11  LEU  51          1HD1      LEU  51 -15.409  -7.464   3.873
  454   HD12  LEU  51          2HD1      LEU  51 -16.223  -5.916   4.116
  455   HD13  LEU  51          3HD1      LEU  51 -15.066  -6.112   2.797
  456   HD21  LEU  51          3HD2      LEU  51 -18.557  -7.207   3.906
  457   HD22  LEU  51          1HD2      LEU  51 -17.592  -8.677   3.726
  458   HD23  LEU  51          2HD2      LEU  51 -18.776  -8.247   2.496
  459    H    GLY  52           H        GLY  52 -18.009  -4.699  -1.373
  460    HA2  GLY  52           2HA      GLY  52 -18.966  -3.086  -2.650
  461    HA3  GLY  52           3HA      GLY  52 -20.519  -3.493  -1.941
  462    H    CYS  53           H        CYS  53 -17.625  -2.451  -0.259
  463    HA   CYS  53           HA       CYS  53 -18.958  -0.374   1.152
  464    HB2  CYS  53           2HB      CYS  53 -16.009  -1.066   0.921
  465    HB3  CYS  53           3HB      CYS  53 -16.683   0.111   2.058
  466    H    LYS  54           H        LYS  54 -19.538   1.459   0.306
  467    HA   LYS  54           HA       LYS  54 -18.977   2.328  -2.275
  468    HB2  LYS  54           2HB      LYS  54 -21.048   2.853  -0.988
  469    HB3  LYS  54           3HB      LYS  54 -20.122   3.931   0.053
  470    HG2  LYS  54           2HG      LYS  54 -19.697   5.448  -1.818
  471    HG3  LYS  54           3HG      LYS  54 -20.475   4.328  -2.945
  472    HD2  LYS  54           2HD      LYS  54 -22.641   4.634  -1.752
  473    HD3  LYS  54           3HD      LYS  54 -21.864   5.760  -0.634
  474    HE2  LYS  54           2HE      LYS  54 -21.439   7.327  -2.454
  475    HE3  LYS  54           3HE      LYS  54 -22.080   6.184  -3.634
  476    HZ1  LYS  54           3HZ      LYS  54 -23.602   7.507  -1.458
  477    HZ2  LYS  54           1HZ      LYS  54 -24.229   6.336  -2.502
  478    HZ3  LYS  54           2HZ      LYS  54 -23.725   7.828  -3.114
  479    H    ARG  55           H        ARG  55 -17.966   3.834   0.820
  480    HA   ARG  55           HA       ARG  55 -15.561   4.960  -0.512
  481    HB2  ARG  55           2HB      ARG  55 -16.921   6.695   0.557
  482    HB3  ARG  55           3HB      ARG  55 -17.005   5.779   2.057
  483    HG2  ARG  55           2HG      ARG  55 -14.545   6.116   2.377
  484    HG3  ARG  55           3HG      ARG  55 -14.499   7.070   0.893
  485    HD2  ARG  55           2HD      ARG  55 -15.934   8.764   1.876
  486    HD3  ARG  55           3HD      ARG  55 -16.196   7.771   3.312
  487    HE   ARG  55           HE       ARG  55 -13.423   8.324   2.972
  488   HH11  ARG  55          1HH1      ARG  55 -16.413   9.834   4.074
  489   HH12  ARG  55          2HH1      ARG  55 -15.604  10.950   5.125
  490   HH21  ARG  55          1HH2      ARG  55 -12.385   9.831   4.344
  491   HH22  ARG  55          2HH2      ARG  55 -13.329  10.948   5.276
  492    H    VAL  56           H        VAL  56 -13.593   4.228   0.139
  493    HA   VAL  56           HA       VAL  56 -13.368   2.520   2.555
  494    HB   VAL  56           HB       VAL  56 -11.579   1.210   1.408
  495   HG11  VAL  56          1HG1      VAL  56 -13.857   0.308   1.442
  496   HG12  VAL  56          2HG1      VAL  56 -13.041  -0.146  -0.054
  497   HG13  VAL  56          3HG1      VAL  56 -14.240   1.150  -0.062
  498   HG21  VAL  56          3HG2      VAL  56 -11.263   1.334  -1.048
  499   HG22  VAL  56          1HG2      VAL  56 -10.836   2.861  -0.272
  500   HG23  VAL  56          2HG2      VAL  56 -12.371   2.706  -1.128
  501    H    ARG  57           H        ARG  57 -11.723   3.018   3.922
  502    HA   ARG  57           HA       ARG  57  -9.740   5.070   3.135
  503    HB2  ARG  57           2HB      ARG  57 -11.067   5.708   5.115
  504    HB3  ARG  57           3HB      ARG  57 -10.649   4.195   5.917
  505    HG2  ARG  57           2HG      ARG  57  -8.288   4.862   6.028
  506    HG3  ARG  57           3HG      ARG  57  -8.632   6.330   5.116
  507    HD2  ARG  57           2HD      ARG  57  -9.988   7.189   6.957
  508    HD3  ARG  57           3HD      ARG  57  -9.748   5.693   7.864
  509    HE   ARG  57           HE       ARG  57  -7.226   6.412   7.547
  510   HH11  ARG  57          1HH1      ARG  57  -9.941   8.485   8.416
  511   HH12  ARG  57          2HH1      ARG  57  -8.956   9.590   9.322
  512   HH21  ARG  57          1HH2      ARG  57  -5.951   7.876   8.717
  513   HH22  ARG  57          2HH2      ARG  57  -6.691   9.241   9.489
  514    H    ILE  58           H        ILE  58  -7.981   4.052   2.370
  515    HA   ILE  58           HA       ILE  58  -7.035   1.521   3.579
  516    HB   ILE  58           HB       ILE  58  -6.131   2.831   0.963
  517   HG12  ILE  58          2HG1      ILE  58  -8.169   0.581   1.322
  518   HG13  ILE  58          3HG1      ILE  58  -8.548   2.228   0.837
  519   HG21  ILE  58          1HG2      ILE  58  -5.698   0.011   2.020
  520   HG22  ILE  58          2HG2      ILE  58  -4.479   1.283   1.933
  521   HG23  ILE  58          3HG2      ILE  58  -5.156   0.614   0.450
  522   HD11  ILE  58          3HD1      ILE  58  -6.910   0.247  -0.749
  523   HD12  ILE  58          1HD1      ILE  58  -7.270   1.909  -1.227
  524   HD13  ILE  58          2HD1      ILE  58  -8.575   0.738  -1.059
  525    H    SER  59           H        SER  59  -5.633   1.988   5.216
  526    HA   SER  59           HA       SER  59  -3.743   4.257   4.997
  527    HB2  SER  59           2HB      SER  59  -4.758   2.850   7.520
  528    HB3  SER  59           3HB      SER  59  -3.768   4.312   7.455
  529    HG   SER  59           HG       SER  59  -6.375   4.082   6.352
  530    H    ILE  60           H        ILE  60  -1.920   3.381   4.161
  531    HA   ILE  60           HA       ILE  60  -1.071   0.652   4.890
  532    HB   ILE  60           HB       ILE  60  -0.248   2.470   2.581
  533   HG12  ILE  60          2HG1      ILE  60  -1.882  -0.113   2.630
  534   HG13  ILE  60          3HG1      ILE  60  -2.518   1.504   2.356
  535   HG21  ILE  60          1HG2      ILE  60   0.721  -0.351   3.171
  536   HG22  ILE  60          2HG2      ILE  60   1.691   1.119   3.260
  537   HG23  ILE  60          3HG2      ILE  60   1.074   0.567   1.704
  538   HD11  ILE  60          3HD1      ILE  60  -1.215   1.633   0.265
  539   HD12  ILE  60          1HD1      ILE  60  -2.378   0.309   0.285
  540   HD13  ILE  60          2HD1      ILE  60  -0.665  -0.026   0.530
  541    H    ARG  61           H        ARG  61   0.373   0.516   6.467
  542    HA   ARG  61           HA       ARG  61   2.194   2.737   7.132
  543    HB2  ARG  61           2HB      ARG  61   1.588   0.221   8.768
  544    HB3  ARG  61           3HB      ARG  61   2.373   1.697   9.326
  545    HG2  ARG  61           2HG      ARG  61   0.197   2.913   8.909
  546    HG3  ARG  61           3HG      ARG  61  -0.545   1.352   8.559
  547    HD2  ARG  61           2HD      ARG  61   0.756   2.128  11.191
  548    HD3  ARG  61           3HD      ARG  61  -0.980   2.130  10.868
  549    HE   ARG  61           HE       ARG  61   0.152  -0.437  10.340
  550   HH11  ARG  61          1HH1      ARG  61  -0.809   1.633  13.023
  551   HH12  ARG  61          2HH1      ARG  61  -1.110   0.308  14.100
  552   HH21  ARG  61          1HH2      ARG  61  -0.249  -2.172  11.772
  553   HH22  ARG  61          2HH2      ARG  61  -0.793  -1.848  13.388
  554    H    VAL  62           H        VAL  62   4.292   2.511   6.507
  555    HA   VAL  62           HA       VAL  62   5.185  -0.053   5.375
  556    HB   VAL  62           HB       VAL  62   5.475   1.989   3.969
  557   HG11  VAL  62          1HG1      VAL  62   7.462   2.944   6.052
  558   HG12  VAL  62          2HG1      VAL  62   5.887   3.679   5.726
  559   HG13  VAL  62          3HG1      VAL  62   7.149   3.708   4.489
  560   HG21  VAL  62          3HG2      VAL  62   7.830   1.624   3.310
  561   HG22  VAL  62          1HG2      VAL  62   6.992   0.103   3.624
  562   HG23  VAL  62          2HG2      VAL  62   8.114   0.752   4.819
  563    H    LYS  63           H        LYS  63   6.613  -1.343   6.435
  564    HA   LYS  63           HA       LYS  63   7.834  -0.380   8.923
  565    HB2  LYS  63           2HB      LYS  63   6.454  -2.631   8.619
  566    HB3  LYS  63           3HB      LYS  63   7.969  -3.259   7.997
  567    HG2  LYS  63           2HG      LYS  63   7.527  -2.076  10.760
  568    HG3  LYS  63           3HG      LYS  63   7.648  -3.794  10.388
  569    HD2  LYS  63           2HD      LYS  63  10.003  -3.547   9.774
  570    HD3  LYS  63           3HD      LYS  63   9.901  -1.791   9.923
  571    HE2  LYS  63           2HE      LYS  63   9.346  -2.138  12.373
  572    HE3  LYS  63           3HE      LYS  63   9.752  -3.841  12.150
  573    HZ1  LYS  63           3HZ      LYS  63  11.974  -3.193  11.501
  574    HZ2  LYS  63           1HZ      LYS  63  11.608  -2.550  13.019
  575    HZ3  LYS  63           2HZ      LYS  63  11.586  -1.557  11.650
  576    H    HIS  64           H        HIS  64   9.840   0.205   8.878
  577    HA   HIS  64           HA       HIS  64  11.673  -0.565   6.695
  578    HB2  HIS  64           2HB      HIS  64  12.837   1.665   7.436
  579    HB3  HIS  64           3HB      HIS  64  11.382   1.747   6.448
  580    HD1  HIS  64           HD1      HIS  64  12.487   2.201  10.058
  581    HD2  HIS  64           HD2      HIS  64   9.307   3.205   7.569
  582    HE1  HIS  64           HE1      HIS  64  11.047   3.772  11.386
  583    HE2  HIS  64           HE2      HIS  64   9.272   4.521   9.784
  584    H    SER  65           H        SER  65  13.550  -1.509   7.238
  585    HA   SER  65           HA       SER  65  13.846  -2.458   9.979
  586    HB2  SER  65           2HB      SER  65  15.356  -3.262   7.453
  587    HB3  SER  65           3HB      SER  65  15.329  -4.135   8.990
  588    HG   SER  65           HG       SER  65  13.846  -5.091   7.651
  589    H    ASP  66           H        ASP  66  16.044  -1.088   7.478
  590    HA   ASP  66           HA       ASP  66  18.092  -0.562   9.496
  591    HB2  ASP  66           2HB      ASP  66  18.710  -1.564   7.281
  592    HB3  ASP  66           3HB      ASP  66  18.184  -0.086   6.479
  593    H    ALA  67           H        ALA  67  18.628   1.408  10.264
  594    HA   ALA  67           HA       ALA  67  16.663   3.487  10.061
  595    HB1  ALA  67           3HB      ALA  67  17.630   2.877  12.225
  596    HB2  ALA  67           1HB      ALA  67  17.911   4.584  11.869
  597    HB3  ALA  67           2HB      ALA  67  19.223   3.415  11.690
  598    H    ALA  68           H        ALA  68  19.794   2.983   8.597
  599    HA   ALA  68           HA       ALA  68  20.220   5.779   7.863
  600    HB1  ALA  68           3HB      ALA  68  22.142   4.280   8.292
  601    HB2  ALA  68           1HB      ALA  68  22.178   4.887   6.634
  602    HB3  ALA  68           2HB      ALA  68  21.644   3.236   6.960
  603    H    GLU  69           H        GLU  69  19.074   2.780   6.301
  604    HA   GLU  69           HA       GLU  69  18.838   3.837   3.677
  605    HB2  GLU  69           2HB      GLU  69  17.518   1.406   4.942
  606    HB3  GLU  69           3HB      GLU  69  17.355   1.820   3.237
  607    HG2  GLU  69           2HG      GLU  69  19.905   1.069   4.688
  608    HG3  GLU  69           3HG      GLU  69  19.032   0.106   3.497
  609    H    GLU  70           H        GLU  70  16.506   3.432   6.315
  610    HA   GLU  70           HA       GLU  70  14.117   3.524   4.962
  611    HB2  GLU  70           2HB      GLU  70  13.073   4.131   7.094
  612    HB3  GLU  70           3HB      GLU  70  14.323   2.914   7.314
  613    HG2  GLU  70           2HG      GLU  70  15.862   4.578   8.188
  614    HG3  GLU  70           3HG      GLU  70  14.707   5.875   7.867
  615    H    LYS  71           H        LYS  71  16.106   6.258   5.786
  616    HA   LYS  71           HA       LYS  71  14.181   8.323   5.748
  617    HB2  LYS  71           2HB      LYS  71  16.417   8.439   6.821
  618    HB3  LYS  71           3HB      LYS  71  17.178   8.412   5.236
  619    HG2  LYS  71           2HG      LYS  71  16.201  10.589   4.690
  620    HG3  LYS  71           3HG      LYS  71  15.313  10.600   6.213
  621    HD2  LYS  71           2HD      LYS  71  17.217  12.040   6.481
  622    HD3  LYS  71           3HD      LYS  71  17.524  10.588   7.432
  623    HE2  LYS  71           2HE      LYS  71  18.649  10.952   4.635
  624    HE3  LYS  71           3HE      LYS  71  19.489  11.533   6.067
  625    HZ1  LYS  71           3HZ      LYS  71  18.743   8.715   5.541
  626    HZ2  LYS  71           1HZ      LYS  71  19.567   9.290   6.900
  627    HZ3  LYS  71           2HZ      LYS  71  20.285   9.381   5.373
  628    H    LYS  72           H        LYS  72  16.500   7.200   3.234
  629    HA   LYS  72           HA       LYS  72  15.282   8.750   1.103
  630    HB2  LYS  72           2HB      LYS  72  17.671   8.208   0.984
  631    HB3  LYS  72           3HB      LYS  72  17.323   6.486   1.067
  632    HG2  LYS  72           2HG      LYS  72  16.124   6.691  -1.154
  633    HG3  LYS  72           3HG      LYS  72  16.661   8.366  -1.233
  634    HD2  LYS  72           2HD      LYS  72  18.574   6.010  -1.038
  635    HD3  LYS  72           3HD      LYS  72  18.024   6.679  -2.572
  636    HE2  LYS  72           2HE      LYS  72  20.169   7.630  -2.140
  637    HE3  LYS  72           3HE      LYS  72  18.993   8.904  -1.839
  638    HZ1  LYS  72           3HZ      LYS  72  20.771   8.778  -0.173
  639    HZ2  LYS  72           1HZ      LYS  72  20.240   7.240   0.283
  640    HZ3  LYS  72           2HZ      LYS  72  19.238   8.583   0.499
  641    H    GLU  73           H        GLU  73  15.140   5.464   2.345
  642    HA   GLU  73           HA       GLU  73  14.230   4.137   0.039
  643    HB2  GLU  73           2HB      GLU  73  15.395   3.158   2.120
  644    HB3  GLU  73           3HB      GLU  73  13.824   3.200   2.905
  645    HG2  GLU  73           2HG      GLU  73  14.202   0.968   2.121
  646    HG3  GLU  73           3HG      GLU  73  12.945   1.681   1.113
  647    H    ALA  74           H        ALA  74  12.495   5.569   2.788
  648    HA   ALA  74           HA       ALA  74   9.893   4.576   2.084
  649    HB1  ALA  74           3HB      ALA  74  10.645   6.832   3.966
  650    HB2  ALA  74           1HB      ALA  74  10.479   5.131   4.403
  651    HB3  ALA  74           2HB      ALA  74   9.067   6.041   3.866
  652    H    LYS  75           H        LYS  75  11.618   7.650   1.574
  653    HA   LYS  75           HA       LYS  75   9.536   9.068   0.265
  654    HB2  LYS  75           2HB      LYS  75  12.551   9.339  -0.102
  655    HB3  LYS  75           3HB      LYS  75  11.359  10.521  -0.640
  656    HG2  LYS  75           2HG      LYS  75  11.855   9.720   2.240
  657    HG3  LYS  75           3HG      LYS  75  12.493  11.169   1.457
  658    HD2  LYS  75           2HD      LYS  75  10.177  11.998   1.111
  659    HD3  LYS  75           3HD      LYS  75   9.537  10.547   1.889
  660    HE2  LYS  75           2HE      LYS  75  10.672  11.179   3.989
  661    HE3  LYS  75           3HE      LYS  75  11.320  12.623   3.208
  662    HZ1  LYS  75           3HZ      LYS  75   9.367  13.112   4.527
  663    HZ2  LYS  75           1HZ      LYS  75   8.445  12.025   3.614
  664    HZ3  LYS  75           2HZ      LYS  75   9.072  13.416   2.889
  665    H    LYS  76           H        LYS  76  11.984   6.831  -0.931
  666    HA   LYS  76           HA       LYS  76  11.336   7.140  -3.718
  667    HB2  LYS  76           2HB      LYS  76  13.593   6.388  -2.771
  668    HB3  LYS  76           3HB      LYS  76  12.841   4.833  -2.423
  669    HG2  LYS  76           2HG      LYS  76  12.355   4.532  -4.835
  670    HG3  LYS  76           3HG      LYS  76  13.107   6.098  -5.171
  671    HD2  LYS  76           2HD      LYS  76  15.250   5.176  -4.154
  672    HD3  LYS  76           3HD      LYS  76  14.461   3.593  -4.097
  673    HE2  LYS  76           2HE      LYS  76  14.157   3.696  -6.558
  674    HE3  LYS  76           3HE      LYS  76  15.002   5.244  -6.586
  675    HZ1  LYS  76           3HZ      LYS  76  16.150   2.671  -5.673
  676    HZ2  LYS  76           1HZ      LYS  76  16.963   4.153  -5.732
  677    HZ3  LYS  76           2HZ      LYS  76  16.450   3.409  -7.162
  678    H    PHE  77           H        PHE  77  10.338   5.087  -1.047
  679    HA   PHE  77           HA       PHE  77   8.811   3.199  -2.597
  680    HB2  PHE  77           2HB      PHE  77   9.848   2.739  -0.297
  681    HB3  PHE  77           3HB      PHE  77   8.592   3.750   0.399
  682    HD1  PHE  77           HD1      PHE  77   8.931   0.804  -1.920
  683    HD2  PHE  77           HD2      PHE  77   6.677   2.622   1.238
  684    HE1  PHE  77           HE1      PHE  77   7.463  -1.162  -1.817
  685    HE2  PHE  77           HE2      PHE  77   5.217   0.644   1.324
  686    HZ   PHE  77           HZ       PHE  77   5.604  -1.247  -0.204
  687    H    ALA  78           H        ALA  78   8.311   6.336  -1.192
  688    HA   ALA  78           HA       ALA  78   5.480   6.496  -1.254
  689    HB1  ALA  78           3HB      ALA  78   5.808   8.933  -1.231
  690    HB2  ALA  78           1HB      ALA  78   7.516   8.726  -1.638
  691    HB3  ALA  78           2HB      ALA  78   6.902   8.153  -0.088
  692    H    ALA  79           H        ALA  79   8.016   7.139  -3.660
  693    HA   ALA  79           HA       ALA  79   6.373   7.905  -5.830
  694    HB1  ALA  79           3HB      ALA  79   8.344   7.403  -7.229
  695    HB2  ALA  79           1HB      ALA  79   9.112   6.588  -5.863
  696    HB3  ALA  79           2HB      ALA  79   8.795   8.324  -5.794
  697    H    ILE  80           H        ILE  80   7.619   4.782  -4.719
  698    HA   ILE  80           HA       ILE  80   6.737   3.138  -6.833
  699    HB   ILE  80           HB       ILE  80   7.409   2.514  -3.925
  700   HG12  ILE  80          2HG1      ILE  80   9.335   3.327  -5.128
  701   HG13  ILE  80          3HG1      ILE  80   9.540   1.589  -4.972
  702   HG21  ILE  80          1HG2      ILE  80   6.996   0.465  -6.123
  703   HG22  ILE  80          2HG2      ILE  80   5.949   0.707  -4.729
  704   HG23  ILE  80          3HG2      ILE  80   7.598   0.130  -4.499
  705   HD11  ILE  80          3HD1      ILE  80  10.206   2.355  -7.160
  706   HD12  ILE  80          1HD1      ILE  80   8.619   3.061  -7.446
  707   HD13  ILE  80          2HD1      ILE  80   8.798   1.308  -7.299
  708    H    LEU  81           H        LEU  81   5.232   3.950  -3.721
  709    HA   LEU  81           HA       LEU  81   2.921   2.346  -3.943
  710    HB2  LEU  81           2HB      LEU  81   3.607   4.810  -2.314
  711    HB3  LEU  81           3HB      LEU  81   2.001   4.106  -2.231
  712    HG   LEU  81           HG       LEU  81   4.508   2.506  -1.580
  713   HD11  LEU  81          1HD1      LEU  81   4.413   4.412  -0.052
  714   HD12  LEU  81          2HD1      LEU  81   4.060   2.905   0.790
  715   HD13  LEU  81          3HD1      LEU  81   2.747   4.009   0.373
  716   HD21  LEU  81          3HD2      LEU  81   2.527   1.156  -2.117
  717   HD22  LEU  81          1HD2      LEU  81   1.581   2.028  -0.905
  718   HD23  LEU  81          2HD2      LEU  81   2.940   1.013  -0.411
  719    H    ASN  82           H        ASN  82   3.628   5.724  -4.790
  720    HA   ASN  82           HA       ASN  82   0.985   6.546  -5.433
  721    HB2  ASN  82           2HB      ASN  82   3.099   7.986  -4.942
  722    HB3  ASN  82           3HB      ASN  82   3.509   7.765  -6.630
  723   HD21  ASN  82          1HD2      ASN  82   0.680   8.053  -7.588
  724   HD22  ASN  82          2HD2      ASN  82   0.326   9.720  -7.395
  725    H    LYS  83           H        LYS  83   3.616   5.124  -7.374
  726    HA   LYS  83           HA       LYS  83   2.366   5.274  -9.916
  727    HB2  LYS  83           2HB      LYS  83   4.518   3.396  -8.867
  728    HB3  LYS  83           3HB      LYS  83   3.974   3.383 -10.542
  729    HG2  LYS  83           2HG      LYS  83   5.365   5.665  -9.101
  730    HG3  LYS  83           3HG      LYS  83   6.043   4.640 -10.365
  731    HD2  LYS  83           2HD      LYS  83   3.770   6.646 -10.697
  732    HD3  LYS  83           3HD      LYS  83   5.426   6.838 -11.268
  733    HE2  LYS  83           2HE      LYS  83   5.123   4.946 -12.823
  734    HE3  LYS  83           3HE      LYS  83   3.476   4.715 -12.234
  735    HZ1  LYS  83           3HZ      LYS  83   3.579   5.952 -14.321
  736    HZ2  LYS  83           1HZ      LYS  83   4.467   7.176 -13.560
  737    HZ3  LYS  83           2HZ      LYS  83   2.877   6.856 -13.080
  738    H    VAL  84           H        VAL  84   2.282   2.825  -7.355
  739    HA   VAL  84           HA       VAL  84   0.923   0.783  -8.806
  740    HB   VAL  84           HB       VAL  84   1.234   1.305  -5.817
  741   HG11  VAL  84          1HG1      VAL  84   0.033  -1.158  -7.134
  742   HG12  VAL  84          2HG1      VAL  84  -0.810  -0.021  -6.082
  743   HG13  VAL  84          3HG1      VAL  84   0.476  -1.038  -5.432
  744   HG21  VAL  84          3HG2      VAL  84   2.887  -0.514  -5.924
  745   HG22  VAL  84          1HG2      VAL  84   3.310   0.781  -7.044
  746   HG23  VAL  84          2HG2      VAL  84   2.583  -0.708  -7.649
  747    H    PHE  85           H        PHE  85  -0.166   3.309  -6.587
  748    HA   PHE  85           HA       PHE  85  -2.927   2.788  -6.632
  749    HB2  PHE  85           2HB      PHE  85  -1.511   5.461  -6.212
  750    HB3  PHE  85           3HB      PHE  85  -3.219   5.170  -5.879
  751    HD1  PHE  85           HD1      PHE  85  -3.247   2.562  -4.528
  752    HD2  PHE  85           HD2      PHE  85  -0.461   5.785  -4.104
  753    HE1  PHE  85           HE1      PHE  85  -2.675   1.783  -2.265
  754    HE2  PHE  85           HE2      PHE  85   0.105   4.993  -1.850
  755    HZ   PHE  85           HZ       PHE  85  -0.995   2.996  -0.928
  756    H    ALA  86           H        ALA  86  -0.882   4.758  -8.764
  757    HA   ALA  86           HA       ALA  86  -2.899   5.794 -10.468
  758    HB1  ALA  86           3HB      ALA  86   0.034   5.276 -11.051
  759    HB2  ALA  86           1HB      ALA  86  -0.645   6.752 -10.355
  760    HB3  ALA  86           2HB      ALA  86  -1.045   6.294 -12.010
  761    H    GLU  87           H        GLU  87  -1.175   2.735 -10.399
  762    HA   GLU  87           HA       GLU  87  -1.960   1.820 -13.021
  763    HB2  GLU  87           2HB      GLU  87  -0.719   0.380 -10.636
  764    HB3  GLU  87           3HB      GLU  87  -1.071  -0.420 -12.164
  765    HG2  GLU  87           2HG      GLU  87   0.846   1.903 -11.799
  766    HG3  GLU  87           3HG      GLU  87   1.304   0.211 -11.959
  767    H    LEU  88           H        LEU  88  -3.512   1.972  -9.955
  768    HA   LEU  88           HA       LEU  88  -5.464  -0.147 -10.662
  769    HB2  LEU  88           2HB      LEU  88  -4.736   0.918  -7.905
  770    HB3  LEU  88           3HB      LEU  88  -5.969  -0.291  -8.236
  771    HG   LEU  88           HG       LEU  88  -2.963  -0.619  -8.613
  772   HD11  LEU  88          1HD1      LEU  88  -3.698  -0.759  -6.284
  773   HD12  LEU  88          2HD1      LEU  88  -3.110  -2.308  -6.875
  774   HD13  LEU  88          3HD1      LEU  88  -4.847  -2.033  -6.708
  775   HD21  LEU  88          3HD2      LEU  88  -5.137  -2.640  -9.266
  776   HD22  LEU  88          1HD2      LEU  88  -3.396  -2.944  -9.289
  777   HD23  LEU  88          2HD2      LEU  88  -4.103  -1.802 -10.427
  778    H    GLY  89           H        GLY  89  -5.180   2.973 -11.147
  779    HA2  GLY  89           2HA      GLY  89  -6.818   4.376 -11.969
  780    HA3  GLY  89           3HA      GLY  89  -8.055   3.305 -11.344
  781    H    TYR  90           H        TYR  90  -5.562   4.550  -9.274
  782    HA   TYR  90           HA       TYR  90  -7.373   6.556  -8.053
  783    HB2  TYR  90           2HB      TYR  90  -4.853   5.418  -6.761
  784    HB3  TYR  90           3HB      TYR  90  -6.156   6.305  -5.984
  785    HD1  TYR  90           HD2      TYR  90  -8.606   4.926  -6.589
  786    HD2  TYR  90           HD1      TYR  90  -4.734   3.223  -5.942
  787    HE1  TYR  90           HE2      TYR  90  -9.639   2.804  -5.897
  788    HE2  TYR  90           HE1      TYR  90  -5.767   1.109  -5.249
  789    HH   TYR  90           HH       TYR  90  -7.912   0.317  -4.354
  790    H    ASN  91           H        ASN  91  -6.489   8.662  -7.707
  791    HA   ASN  91           HA       ASN  91  -4.213   9.349  -9.469
  792    HB2  ASN  91           2HB      ASN  91  -6.531  11.031  -8.431
  793    HB3  ASN  91           3HB      ASN  91  -5.183  11.696  -9.344
  794   HD21  ASN  91          1HD2      ASN  91  -4.880   9.565 -11.238
  795   HD22  ASN  91          2HD2      ASN  91  -6.267   9.596 -12.262
  796    H    ASP  92           H        ASP  92  -3.102  11.464  -8.727
  797    HA   ASP  92           HA       ASP  92  -1.469  10.742  -6.529
  798    HB2  ASP  92           2HB      ASP  92  -1.617  13.442  -7.944
  799    HB3  ASP  92           3HB      ASP  92  -0.261  12.838  -6.995
  800    H    SER  93           H        SER  93  -4.074  13.072  -6.914
  801    HA   SER  93           HA       SER  93  -3.691  14.669  -4.644
  802    HB2  SER  93           2HB      SER  93  -6.312  14.096  -6.084
  803    HB3  SER  93           3HB      SER  93  -5.964  15.501  -5.070
  804    HG   SER  93           HG       SER  93  -5.610  16.173  -7.119
  805    H    ASN  94           H        ASN  94  -5.517  11.618  -4.997
  806    HA   ASN  94           HA       ASN  94  -6.509  11.729  -2.246
  807    HB2  ASN  94           2HB      ASN  94  -7.627   9.589  -2.736
  808    HB3  ASN  94           3HB      ASN  94  -7.990  10.787  -3.968
  809   HD21  ASN  94          1HD2      ASN  94  -6.072   7.913  -3.268
  810   HD22  ASN  94          2HD2      ASN  94  -5.866   7.432  -4.914
  811    H    VAL  95           H        VAL  95  -3.570  10.976  -3.536
  812    HA   VAL  95           HA       VAL  95  -2.874   8.922  -1.527
  813    HB   VAL  95           HB       VAL  95  -1.206  10.013  -3.855
  814   HG11  VAL  95          1HG1      VAL  95   0.204   9.192  -1.998
  815   HG12  VAL  95          2HG1      VAL  95   0.337   8.136  -3.405
  816   HG13  VAL  95          3HG1      VAL  95  -0.648   7.644  -2.025
  817   HG21  VAL  95          3HG2      VAL  95  -2.690   7.364  -3.651
  818   HG22  VAL  95          1HG2      VAL  95  -1.637   7.856  -4.981
  819   HG23  VAL  95          2HG2      VAL  95  -3.143   8.726  -4.677
  820    H    THR  96           H        THR  96  -2.414   9.883   0.392
  821    HA   THR  96           HA       THR  96  -0.669  12.277   0.478
  822    HB   THR  96           HB       THR  96  -3.226  11.977   2.132
  823    HG1  THR  96           HG1      THR  96  -2.676  13.356  -0.278
  824   HG21  THR  96          3HG2      THR  96  -1.478  13.323   3.266
  825   HG22  THR  96          1HG2      THR  96  -2.837  14.334   2.765
  826   HG23  THR  96          2HG2      THR  96  -1.338  14.343   1.834
  827    H    TRP  97           H        TRP  97   0.857  12.143   2.052
  828    HA   TRP  97           HA       TRP  97   1.010   9.714   3.666
  829    HB2  TRP  97           2HB      TRP  97   3.019  11.836   2.882
  830    HB3  TRP  97           3HB      TRP  97   3.358  10.781   4.252
  831    HD1  TRP  97           HD1      TRP  97   2.761  10.569   0.433
  832    HE1  TRP  97           HE1      TRP  97   3.800   8.376  -0.405
  833    HE3  TRP  97           HE3      TRP  97   4.090   8.508   4.926
  834    HZ2  TRP  97           HZ2      TRP  97   5.018   6.074   0.680
  835    HZ3  TRP  97           HZ3      TRP  97   5.184   6.296   4.942
  836    HH2  TRP  97           HH2      TRP  97   5.639   5.102   2.853
  837    H    ASP  98           H        ASP  98   1.530   9.715   5.822
  838    HA   ASP  98           HA       ASP  98   0.945  11.947   7.596
  839    HB2  ASP  98           2HB      ASP  98  -1.296  10.911   7.013
  840    HB3  ASP  98           3HB      ASP  98  -0.703   9.355   7.577
  841    H    GLY  99           H        GLY  99   3.195  11.563   7.957
  842    HA2  GLY  99           2HA      GLY  99   4.984  10.775   9.141
  843    HA3  GLY  99           3HA      GLY  99   3.909   9.651   9.963
  844    H    ASP 100           H        ASP 100   4.384   7.571   9.608
  845    HA   ASP 100           HA       ASP 100   5.819   6.692   7.175
  846    HB2  ASP 100           2HB      ASP 100   5.245   5.189   9.779
  847    HB3  ASP 100           3HB      ASP 100   6.166   4.542   8.425
  848    H    THR 101           H        THR 101   2.766   7.287   7.693
  849    HA   THR 101           HA       THR 101   1.684   4.804   6.474
  850    HB   THR 101           HB       THR 101   0.238   6.819   8.266
  851    HG1  THR 101           HG1      THR 101   1.866   4.985   9.032
  852   HG21  THR 101          3HG2      THR 101  -1.299   5.774   6.619
  853   HG22  THR 101          1HG2      THR 101  -1.633   5.201   8.257
  854   HG23  THR 101          2HG2      THR 101  -0.754   4.174   7.126
  855    H    VAL 102           H        VAL 102   0.964   5.128   4.396
  856    HA   VAL 102           HA       VAL 102   0.216   7.847   3.522
  857    HB   VAL 102           HB       VAL 102   1.777   6.646   2.017
  858   HG11  VAL 102          1HG1      VAL 102   1.099   4.686   0.688
  859   HG12  VAL 102          2HG1      VAL 102  -0.410   4.584   1.596
  860   HG13  VAL 102          3HG1      VAL 102   1.129   4.313   2.415
  861   HG21  VAL 102          3HG2      VAL 102   0.564   7.030  -0.106
  862   HG22  VAL 102          1HG2      VAL 102   0.255   8.314   1.067
  863   HG23  VAL 102          2HG2      VAL 102  -0.963   7.070   0.779
  864    H    THR 103           H        THR 103  -1.881   8.361   3.690
  865    HA   THR 103           HA       THR 103  -3.905   6.254   4.025
  866    HB   THR 103           HB       THR 103  -4.293   9.222   4.593
  867    HG1  THR 103           HG1      THR 103  -2.466   7.917   5.774
  868   HG21  THR 103          3HG2      THR 103  -5.618   6.719   5.726
  869   HG22  THR 103          1HG2      THR 103  -6.337   7.797   4.520
  870   HG23  THR 103          2HG2      THR 103  -6.022   8.381   6.153
  871    H    VAL 104           H        VAL 104  -4.779   5.748   2.157
  872    HA   VAL 104           HA       VAL 104  -5.370   7.748   0.065
  873    HB   VAL 104           HB       VAL 104  -4.722   4.763  -0.176
  874   HG11  VAL 104          1HG1      VAL 104  -6.406   5.372  -1.873
  875   HG12  VAL 104          2HG1      VAL 104  -4.844   5.062  -2.634
  876   HG13  VAL 104          3HG1      VAL 104  -5.401   6.722  -2.407
  877   HG21  VAL 104          3HG2      VAL 104  -2.708   5.520  -1.386
  878   HG22  VAL 104          1HG2      VAL 104  -2.743   6.156   0.260
  879   HG23  VAL 104          2HG2      VAL 104  -3.162   7.200  -1.101
  880    H    GLU 105           H        GLU 105  -7.504   8.206   0.158
  881    HA   GLU 105           HA       GLU 105  -9.456   6.044   0.709
  882    HB2  GLU 105           2HB      GLU 105  -9.877   9.050   0.981
  883    HB3  GLU 105           3HB      GLU 105 -11.051   7.790   1.362
  884    HG2  GLU 105           2HG      GLU 105  -9.339   6.944   3.087
  885    HG3  GLU 105           3HG      GLU 105  -8.496   8.475   2.839
  886    H    GLY 106           H        GLY 106 -11.295   5.924  -0.599
  887    HA2  GLY 106           2HA      GLY 106 -11.774   7.674  -2.805
  888    HA3  GLY 106           3HA      GLY 106 -11.010   6.172  -3.322
  889    H    GLN 107           H        GLN 107 -13.796   7.386  -3.643
  890    HA   GLN 107           HA       GLN 107 -15.549   5.377  -2.632
  891    HB2  GLN 107           2HB      GLN 107 -16.545   7.469  -3.358
  892    HB3  GLN 107           3HB      GLN 107 -15.876   7.299  -4.980
  893    HG2  GLN 107           2HG      GLN 107 -17.319   5.316  -5.373
  894    HG3  GLN 107           3HG      GLN 107 -17.970   5.465  -3.743
  895   HE21  GLN 107          1HE2      GLN 107 -20.054   5.563  -4.699
  896   HE22  GLN 107          2HE2      GLN 107 -20.640   7.023  -5.412
  897    H    LEU 108           H        LEU 108 -15.082   3.311  -3.087
  898    HA   LEU 108           HA       LEU 108 -14.363   2.385  -5.747
  899    HB2  LEU 108           2HB      LEU 108 -13.489   1.171  -3.806
  900    HB3  LEU 108           3HB      LEU 108 -15.109   0.954  -3.165
  901    HG   LEU 108           HG       LEU 108 -15.632  -0.492  -5.192
  902   HD11  LEU 108          1HD1      LEU 108 -13.792  -1.450  -6.480
  903   HD12  LEU 108          2HD1      LEU 108 -12.639  -0.393  -5.661
  904   HD13  LEU 108          3HD1      LEU 108 -13.884   0.295  -6.708
  905   HD21  LEU 108          3HD2      LEU 108 -15.145  -1.409  -2.983
  906   HD22  LEU 108          1HD2      LEU 108 -13.426  -1.472  -3.376
  907   HD23  LEU 108          2HD2      LEU 108 -14.581  -2.461  -4.274
  908    H    GLU 109           H        GLU 109 -16.007   2.986  -7.061
  909    HA   GLU 109           HA       GLU 109 -18.032   3.256  -8.033
  910    HB2  GLU 109           2HB      GLU 109 -17.282   1.162  -8.928
  911    HB3  GLU 109           3HB      GLU 109 -17.828   0.278  -7.514
  912    HG2  GLU 109           2HG      GLU 109 -19.250  -0.093  -9.534
  913    HG3  GLU 109           3HG      GLU 109 -20.142   0.536  -8.149
  914    H    GLY 110           H        GLY 110 -19.013   0.751  -5.706
  915    HA2  GLY 110           2HA      GLY 110 -20.604   1.328  -3.882
  916    HA3  GLY 110           3HA      GLY 110 -21.496   2.258  -5.086
  917    H    VAL 111           H        VAL 111 -19.883  -0.810  -5.622
  918    HA   VAL 111           HA       VAL 111 -22.044  -1.994  -6.986
  919    HB   VAL 111           HB       VAL 111 -20.637  -4.186  -6.717
  920   HG11  VAL 111          1HG1      VAL 111 -19.388  -1.787  -8.114
  921   HG12  VAL 111          2HG1      VAL 111 -20.664  -2.810  -8.777
  922   HG13  VAL 111          3HG1      VAL 111 -19.062  -3.486  -8.472
  923   HG21  VAL 111          3HG2      VAL 111 -18.613  -2.174  -5.641
  924   HG22  VAL 111          1HG2      VAL 111 -18.251  -3.838  -6.116
  925   HG23  VAL 111          2HG2      VAL 111 -19.314  -3.523  -4.745
  926    H    ASP 112           H        ASP 112 -23.850  -1.988  -5.791
  927    HA   ASP 112           HA       ASP 112 -24.164  -4.114  -3.769
  928    HB2  ASP 112           2HB      ASP 112 -24.136  -1.903  -2.599
  929    HB3  ASP 112           3HB      ASP 112 -25.434  -1.331  -3.643
  930    H    LEU 113           H        LEU 113 -25.136  -5.543  -5.070
  931    HA   LEU 113           HA       LEU 113 -27.030  -4.783  -7.143
  932    HB2  LEU 113           2HB      LEU 113 -25.867  -7.480  -6.341
  933    HB3  LEU 113           3HB      LEU 113 -26.860  -7.191  -7.761
  934    HG   LEU 113           HG       LEU 113 -24.122  -5.927  -7.299
  935   HD11  LEU 113          1HD1      LEU 113 -23.886  -8.334  -7.601
  936   HD12  LEU 113          2HD1      LEU 113 -23.266  -7.464  -9.001
  937   HD13  LEU 113          3HD1      LEU 113 -24.836  -8.268  -9.087
  938   HD21  LEU 113          3HD2      LEU 113 -24.258  -5.249  -9.666
  939   HD22  LEU 113          1HD2      LEU 113 -25.564  -4.542  -8.716
  940   HD23  LEU 113          2HD2      LEU 113 -25.890  -5.920  -9.772
  941    H    GLU 114           H        GLU 114 -28.994  -4.329  -6.384
  942    HA   GLU 114           HA       GLU 114 -30.003  -5.321  -3.896
  943    HB2  GLU 114           2HB      GLU 114 -31.991  -3.844  -4.440
  944    HB3  GLU 114           3HB      GLU 114 -30.433  -3.030  -4.401
  945    HG2  GLU 114           2HG      GLU 114 -30.365  -3.150  -6.906
  946    HG3  GLU 114           3HG      GLU 114 -31.994  -3.822  -6.883
  947    H    HIS 115           H        HIS 115 -31.201  -5.697  -7.276
  948    HA   HIS 115           HA       HIS 115 -32.710  -8.119  -6.431
  949    HB2  HIS 115           2HB      HIS 115 -34.206  -6.304  -7.167
  950    HB3  HIS 115           3HB      HIS 115 -33.341  -6.173  -8.693
  951    HD1  HIS 115           HD1      HIS 115 -34.654  -7.228 -10.535
  952    HD2  HIS 115           HD2      HIS 115 -35.257  -9.205  -6.918
  953    HE1  HIS 115           HE1      HIS 115 -36.301  -9.059 -11.023
  954    HE2  HIS 115           HE2      HIS 115 -36.587 -10.288  -8.848
  955    H    HIS 116           H        HIS 116 -30.562  -6.667  -8.808
  956    HA   HIS 116           HA       HIS 116 -30.190  -9.104 -10.343
  957    HB2  HIS 116           2HB      HIS 116 -28.803  -6.387 -10.397
  958    HB3  HIS 116           3HB      HIS 116 -28.321  -7.722 -11.435
  959    HD1  HIS 116           HD1      HIS 116 -30.211  -4.771 -11.618
  960    HD2  HIS 116           HD2      HIS 116 -30.820  -8.650 -12.964
  961    HE1  HIS 116           HE1      HIS 116 -31.870  -4.588 -13.489
  962    HE2  HIS 116           HE2      HIS 116 -32.363  -6.960 -14.136
  963    H    HIS 117           H        HIS 117 -29.756 -10.103  -8.044
  964    HA   HIS 117           HA       HIS 117 -27.571  -9.501  -6.438
  965    HB2  HIS 117           2HB      HIS 117 -27.926 -11.735  -5.401
  966    HB3  HIS 117           3HB      HIS 117 -29.438 -10.875  -5.646
  967    HD1  HIS 117           HD1      HIS 117 -31.141 -11.899  -7.320
  968    HD2  HIS 117           HD2      HIS 117 -27.635 -14.105  -6.941
  969    HE1  HIS 117           HE1      HIS 117 -31.609 -14.116  -8.398
  970    HE2  HIS 117           HE2      HIS 117 -29.555 -15.488  -7.958
  971    H    HIS 118           H        HIS 118 -25.580 -10.576  -6.034
  972    HA   HIS 118           HA       HIS 118 -24.014 -11.037  -8.360
  973    HB2  HIS 118           2HB      HIS 118 -23.072  -9.970  -6.336
  974    HB3  HIS 118           3HB      HIS 118 -23.318 -11.452  -5.417
  975    HD1  HIS 118           HD1      HIS 118 -21.203 -10.077  -8.253
  976    HD2  HIS 118           HD2      HIS 118 -21.243 -13.284  -5.614
  977    HE1  HIS 118           HE1      HIS 118 -19.003 -11.239  -8.566
  978    HE2  HIS 118           HE2      HIS 118 -19.132 -13.265  -7.092
  979    H    HIS 119           H        HIS 119 -24.478 -12.806  -9.514
  980    HA   HIS 119           HA       HIS 119 -24.947 -15.454  -8.522
  981    HB2  HIS 119           2HB      HIS 119 -24.209 -14.357 -11.269
  982    HB3  HIS 119           3HB      HIS 119 -24.389 -16.083 -10.985
  983    HD1  HIS 119           HD1      HIS 119 -26.621 -16.930 -11.570
  984    HD2  HIS 119           HD2      HIS 119 -26.783 -12.951 -10.391
  985    HE1  HIS 119           HE1      HIS 119 -29.015 -16.243 -11.832
  986    HE2  HIS 119           HE2      HIS 119 -29.055 -13.798 -11.260
  987    H    HIS 120           H        HIS 120 -23.422 -17.291  -9.373
  988    HA   HIS 120           HA       HIS 120 -20.978 -17.137  -7.967
  989    HB2  HIS 120           2HB      HIS 120 -22.180 -19.268  -8.294
  990    HB3  HIS 120           3HB      HIS 120 -21.870 -19.203 -10.028
  991    HD1  HIS 120           HD1      HIS 120 -20.021 -19.587  -6.732
  992    HD2  HIS 120           HD2      HIS 120 -19.411 -20.270 -10.790
  993    HE1  HIS 120           HE1      HIS 120 -17.843 -20.829  -6.897
  994    HE2  HIS 120           HE2      HIS 120 -17.460 -21.152  -9.360