*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   27-JUN-08   2K5E              
*TITLE     SOLUTION STRUCTURE OF PUTATIVE UNCHARACTERIZED PROTEIN                
*TITLE    2 GSU1278 FROM METHANOCALDOCOCCUS JANNASCHII, NORTHEAST                
*TITLE    3 STRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET GSR195                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UNCHARACTERIZED PROTEIN;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: METHANOCOCCUS JANNASCHII;                       
*SOURCE   3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   4 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   5 EXPRESSION_SYSTEM_PLASMID: PET 21-23C                                
*KEYWDS    NMR, HELIX PROTEIN, STRUCTURAL GENOMIC, STRUCTURAL GENOMICS,          
*KEYWDS   2 PSI-2, PROTEIN STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL            
*KEYWDS   3 GENOMICS CONSORTIUM, NESG, UNKNOWN FUNCTION                          
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    G.LIU, L.ZHAO, C.CICCOSANTI, M.JIANG, R.XIAO, G.SWAPNA,               
*AUTHOR   2 R.NAIR, J.K.EVERETT, T.B.ACTON, B.ROST, G.T.MONTELIONE,              
*AUTHOR   3 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG)                      
*REVDAT   1   26-AUG-08 2K5E    0                                                


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 assign (resid   9 and name HG1  ) (resid  10 and name HN   )  3.94  2.14  0.79
 assign (resid  10 and name HN   ) (resid  10 and name HG2* )  2.68  0.88  0.54
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 assign (resid  10 and name HA   ) (resid  11 and name HN   )  2.74  0.94  0.55
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 assign (resid  11 and name HN   ) (resid  11 and name HB1  )  3.71  1.91  0.74
 assign (resid  11 and name HN   ) (resid  11 and name HB2  )  3.08  1.28  0.62
 assign (resid  11 and name HN   ) (resid  11 and name HD*  )  3.00  1.20  0.60
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 assign (resid  11 and name HB1  ) (resid  12 and name HN   )  3.79  1.99  0.76
 assign (resid  11 and name HB2  ) (resid  12 and name HN   )  3.46  1.66  0.69
 assign (resid  11 and name HD*  ) (resid  12 and name HN   )  4.49  2.69  0.90
 assign (resid  12 and name HN   ) (resid  12 and name HB*  )  2.65  0.85  0.53
 assign (resid  12 and name HN   ) (resid  14 and name HN   )  4.27  2.47  0.85
 assign (resid  11 and name HN   ) (resid  13 and name HN   )  4.61  2.81  0.92
 assign (resid  11 and name HA   ) (resid  13 and name HN   )  5.52  3.72  1.10
 assign (resid  12 and name HN   ) (resid  13 and name HN   )  3.21  1.41  0.64
 assign (resid  12 and name HB*  ) (resid  13 and name HN   )  2.81  1.01  0.56
 assign (resid  13 and name HN   ) (resid  13 and name HB2  )  2.89  1.09  0.58
 assign (resid  13 and name HN   ) (resid  13 and name HG1  )  3.11  1.31  0.62
 assign (resid  13 and name HN   ) (resid  14 and name HN   )  2.98  1.18  0.60
 assign (resid  13 and name HN   ) (resid  15 and name HN   )  4.30  2.50  0.86
 assign (resid  13 and name HN   ) (resid  13 and name HE21 )  5.91  4.11  1.18
 assign (resid  13 and name HA   ) (resid  13 and name HE21 )  4.82  3.02  0.96
 assign (resid  13 and name HB2  ) (resid  13 and name HE21 )  4.39  2.59  0.88
 assign (resid  13 and name HB1  ) (resid  13 and name HE21 )  4.13  2.33  0.83
 assign (resid  13 and name HG2  ) (resid  13 and name HE21 )  3.03  1.23  0.61
 assign (resid  13 and name HA   ) (resid  13 and name HE22 )  5.67  3.87  1.13
 assign (resid   9 and name HB1  ) (resid  13 and name HE22 )  5.09  3.29  1.02
 assign (resid  13 and name HB2  ) (resid  13 and name HE22 )  5.31  3.51  1.06
 assign (resid  13 and name HB1  ) (resid  13 and name HE22 )  4.44  2.64  0.89
 assign (resid  13 and name HG2  ) (resid  13 and name HE22 )  3.81  2.01  0.76
 assign (resid  13 and name HB2  ) (resid  14 and name HN   )  3.41  1.61  0.68
 assign (resid   9 and name HE*  ) (resid  14 and name HN   )  3.47  1.67  0.69
 assign (resid  13 and name HB1  ) (resid  14 and name HN   )  3.86  2.06  0.77
 assign (resid  13 and name HG2  ) (resid  14 and name HN   )  5.06  3.26  1.01
 assign (resid  45 and name HB2  ) (resid  47 and name HN   )  6.50  4.70  1.30
 assign (resid  14 and name HN   ) (resid  14 and name HB*  )  2.66  0.86  0.53
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 assign (resid  11 and name HA   ) (resid  15 and name HN   )  4.49  2.69  0.90
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 assign (resid  14 and name HB*  ) (resid  15 and name HN   )  2.93  1.13  0.59
 assign (resid  15 and name HN   ) (resid  15 and name HB2  )  2.89  1.09  0.58
 assign (resid  15 and name HN   ) (resid  15 and name HG   )  3.00  1.20  0.60
 assign (resid  15 and name HN   ) (resid  15 and name HD1* )  3.69  1.89  0.74
 assign (resid  15 and name HN   ) (resid  15 and name HD2* )  3.95  2.15  0.79
 assign (resid  12 and name HA   ) (resid  16 and name HN   )  4.16  2.36  0.83
 assign (resid  15 and name HN   ) (resid  16 and name HN   )  3.07  1.27  0.61
 assign (resid  15 and name HB1  ) (resid  16 and name HN   )  3.62  1.82  0.72
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 assign (resid  15 and name HG   ) (resid  16 and name HN   )  4.88  3.08  0.98
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 assign (resid  16 and name HG*  ) (resid  16 and name HE22 )  3.58  1.78  0.72
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 assign (resid  16 and name HB2  ) (resid  17 and name HN   )  3.86  2.06  0.77
 assign (resid  16 and name HB1  ) (resid  17 and name HN   )  3.98  2.18  0.80
 assign (resid  16 and name HG*  ) (resid  17 and name HN   )  4.38  2.58  0.88
 assign (resid  17 and name HN   ) (resid  17 and name HB   )  2.83  1.03  0.57
 assign (resid  17 and name HN   ) (resid  17 and name HG2* )  3.80  2.00  0.76
 assign (resid  17 and name HN   ) (resid  18 and name HN   )  2.94  1.14  0.59
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 assign (resid  17 and name HG2* ) (resid  18 and name HN   )  3.57  1.77  0.71
 assign (resid  18 and name HN   ) (resid  18 and name HB1  )  3.77  1.97  0.75
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 assign (resid  21 and name HG1* ) (resid  22 and name HN   )  3.60  1.80  0.72
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 assign (resid  21 and name HA   ) (resid  23 and name HN   )  5.44  3.64  1.09
 assign (resid  23 and name HN   ) (resid  26 and name HD1  )  5.64  3.84  1.13
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 assign (resid  26 and name HN   ) (resid  26 and name HG2  )  3.90  2.10  0.78
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 assign (resid  26 and name HG2  ) (resid  27 and name HN   )  5.36  3.56  1.07
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 assign (resid  29 and name HB2  ) (resid  29 and name HD22 )  3.73  1.93  0.75
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 assign (resid  29 and name HA   ) (resid  29 and name HD21 )  5.38  3.58  1.08
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 assign (resid  54 and name HA   ) (resid  57 and name HG11 )  4.32  2.52  0.86
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 assign (resid  21 and name HB   ) (resid  22 and name HB*  )  4.34  2.54  0.87
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 assign (resid  24 and name HB   ) (resid  25 and name HG   )  4.67  2.87  0.93
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 assign (resid  24 and name HA   ) (resid  61 and name HG   )  5.83  4.03  1.17
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 assign (resid  25 and name HA   ) (resid  29 and name HN   )  6.50  4.70  1.30
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 assign (resid  11 and name HE*  ) (resid  25 and name HB1  )  5.17  3.37  1.03
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 assign (resid  25 and name HB1  ) (resid  26 and name HA   )  4.65  2.85  0.93
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 assign (resid  26 and name HA   ) (resid  33 and name HG2* )  6.50  4.70  1.30
 assign (resid  25 and name HN   ) (resid  26 and name HA   )  5.54  3.74  1.11
 assign (resid  26 and name HB2  ) (resid  30 and name HN   )  5.59  3.79  1.12
 assign (resid  22 and name HB*  ) (resid  26 and name HD1  )  4.44  2.64  0.89
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 assign (resid  26 and name HB2  ) (resid  27 and name HA   )  6.05  4.25  1.21
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 assign (resid  31 and name HA1  ) (resid  33 and name HN   )  5.23  3.43  1.05
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 assign (resid  35 and name HA   ) (resid  36 and name HB1  )  5.79  3.99  1.16
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 assign (resid  33 and name HA   ) (resid  36 and name HG1  )  5.11  3.31  1.02
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 assign (resid  58 and name HD1* ) (resid  59 and name HA   )  5.75  3.95  1.15
 assign (resid  56 and name HA   ) (resid  59 and name HA   )  5.81  4.01  1.16
 assign (resid  42 and name HB1  ) (resid  44 and name HB1  )  5.44  3.64  1.09
 assign (resid   3 and name HB1  ) (resid   6 and name HB   )  6.06  4.26  1.21
 assign (resid  59 and name HB1  ) (resid  60 and name HA   )  6.29  4.49  1.26
 assign (resid  58 and name HN   ) (resid  59 and name HA   )  5.37  3.57  1.07
 assign (resid  60 and name HA   ) (resid  62 and name HN   )  4.84  3.04  0.97
 assign (resid  61 and name HB2  ) (resid  63 and name HN   )  5.21  3.41  1.04
 assign (resid  60 and name HB1  ) (resid  63 and name HN   )  5.35  3.55  1.07
 assign (resid  60 and name HA   ) (resid  61 and name HA   )  5.27  3.47  1.05
 assign (resid  61 and name HA   ) (resid  62 and name HA   )  5.03  3.23  1.01
 assign (resid  59 and name HN   ) (resid  60 and name HB1  )  6.04  4.24  1.21
 assign (resid  24 and name HG1* ) (resid  61 and name HD1* )  4.82  3.02  0.96
 assign (resid  21 and name HG2* ) (resid  61 and name HD1* )  4.83  3.03  0.97
 assign (resid   5 and name HZ   ) (resid  61 and name HD2* )  5.15  3.35  1.03
 assign (resid   5 and name HZ   ) (resid  61 and name HD1* )  5.69  3.89  1.14
 assign (resid  58 and name HN   ) (resid  61 and name HD1* )  4.78  2.98  0.96
 assign (resid  23 and name HN   ) (resid  61 and name HD2* )  6.13  4.33  1.23
 assign (resid  26 and name HN   ) (resid  61 and name HD2* )  6.50  4.70  1.30
 assign (resid  14 and name HN   ) (resid  61 and name HD1* )  5.70  3.90  1.14
 assign (resid  61 and name HN   ) (resid  63 and name HB*  )  4.65  2.85  0.93
 assign (resid  63 and name HB*  ) (resid  64 and name HA   )  3.87  2.07  0.77
 assign (resid  63 and name HA   ) (resid  64 and name HA   )  5.04  3.24  1.01
 assign (resid  63 and name HB*  ) (resid  64 and name HG   )  3.72  1.92  0.74
 assign (resid  61 and name HD2* ) (resid  63 and name HB*  )  6.16  4.36  1.23
 assign (resid  63 and name HB*  ) (resid  64 and name HB1  )  6.50  4.70  1.30
 assign (resid  63 and name HA   ) (resid  64 and name HD2* )  5.75  3.95  1.15
 assign (resid  62 and name HB2  ) (resid  63 and name HA   )  4.84  3.04  0.97
 assign (resid  49 and name HB*  ) (resid  50 and name HB2  )  4.72  2.92  0.94
 assign (resid  62 and name HB2  ) (resid  63 and name HB*  )  5.13  3.33  1.03
 assign (resid  61 and name HB1  ) (resid  64 and name HD1* )  5.07  3.27  1.01
 assign (resid  21 and name HG1* ) (resid  64 and name HD1* )  3.90  2.10  0.78
 assign (resid  63 and name HB*  ) (resid  64 and name HD1* )  5.28  3.48  1.06
 assign (resid  63 and name HB*  ) (resid  64 and name HD2* )  3.85  2.05  0.77
 assign (resid  61 and name HB2  ) (resid  64 and name HD1* )  4.58  2.78  0.92
 assign (resid  24 and name HB   ) (resid  64 and name HD2* )  4.51  2.71  0.90
 assign (resid  20 and name HA1  ) (resid  64 and name HD1* )  3.76  1.96  0.75
 assign (resid  20 and name HA2  ) (resid  64 and name HD2* )  3.68  1.88  0.74
 assign (resid   5 and name HZ   ) (resid  64 and name HD1* )  4.54  2.74  0.91
 assign (resid  64 and name HB2  ) (resid  65 and name HA   )  5.34  3.54  1.07
 assign (resid  22 and name HN   ) (resid  64 and name HD1* )  5.05  3.25  1.01
 assign (resid  61 and name HN   ) (resid  64 and name HD2* )  5.47  3.67  1.09
 assign (resid  11 and name HD*  ) (resid  38 and name HA   )  4.78  2.98  0.96
 assign (resid  66 and name HD2* ) (resid  68 and name HN   )  5.43  3.63  1.09
 assign (resid  63 and name HA   ) (resid  66 and name HG   )  3.76  1.96  0.75
 assign (resid  63 and name HA   ) (resid  66 and name HD1* )  3.43  1.63  0.69
 assign (resid  28 and name HA   ) (resid  30 and name HD1* )  6.35  4.55  1.27
 assign (resid   2 and name HG2* ) (resid   3 and name HA   )  4.65  2.85  0.93
 assign (resid  11 and name HA   ) (resid  25 and name HD2* )  6.50  4.70  1.30
 assign (resid  11 and name HA   ) (resid  33 and name HG2* )  6.50  4.70  1.30
 assign (resid  11 and name HA   ) (resid  25 and name HD1* )  4.45  2.65  0.89
 assign (resid  11 and name HB2  ) (resid  43 and name HD2* )  5.02  3.22  1.00
 assign (resid  11 and name HB1  ) (resid  33 and name HD1* )  5.29  3.49  1.06
 assign (resid  11 and name HB2  ) (resid  33 and name HD1* )  6.11  4.31  1.22
 assign (resid  15 and name HG   ) (resid  33 and name HD1* )  5.05  3.25  1.01
 assign (resid  25 and name HB1  ) (resid  33 and name HD1* )  4.97  3.17  0.99
 assign (resid  25 and name HB2  ) (resid  33 and name HD1* )  5.45  3.65  1.09
 assign (resid  33 and name HD1* ) (resid  39 and name HE21 )  6.33  4.53  1.27
 assign (resid  31 and name HA2  ) (resid  33 and name HG12 )  6.50  4.70  1.30
 assign (resid  12 and name HA   ) (resid  39 and name HB2  )  5.54  3.74  1.11
 assign (resid  33 and name HB   ) (resid  39 and name HG2  )  6.50  4.70  1.30
 assign (resid  25 and name HB1  ) (resid  33 and name HG2* )  5.39  3.59  1.08
 assign (resid  25 and name HB2  ) (resid  33 and name HG2* )  5.28  3.48  1.06
 assign (resid  11 and name HZ   ) (resid  33 and name HG2* )  4.78  2.98  0.96
 assign (resid  11 and name HB1  ) (resid  33 and name HB   )  5.79  3.99  1.16
 assign (resid  32 and name HA   ) (resid  35 and name HN   )  3.98  2.18  0.80
 assign (resid  32 and name HB*  ) (resid  34 and name HN   )  6.50  4.70  1.30
 assign (resid  32 and name HB*  ) (resid  36 and name HN   )  6.50  4.70  1.30
 assign (resid  35 and name HB*  ) (resid  36 and name HG2  )  5.69  3.89  1.14
 assign (resid  35 and name HB*  ) (resid  36 and name HG1  )  5.93  4.13  1.19
 assign (resid   7 and name HA   ) (resid  43 and name HG   )  5.21  3.41  1.04
 assign (resid  11 and name HD*  ) (resid  15 and name HD1* )  4.14  2.34  0.83
 assign (resid  15 and name HB2  ) (resid  16 and name HE22 )  6.50  4.70  1.30
 assign (resid  15 and name HB2  ) (resid  39 and name HE21 )  6.50  4.70  1.30
 assign (resid  18 and name HB2  ) (resid  20 and name HN   )  5.69  3.89  1.14
 assign (resid  11 and name HB1  ) (resid  25 and name HD1* )  5.09  3.29  1.02
 assign (resid  25 and name HD1* ) (resid  33 and name HG11 )  4.78  2.98  0.96
 assign (resid  24 and name HG2* ) (resid  64 and name HG   )  3.54  1.74  0.71
 assign (resid  24 and name HG1* ) (resid  64 and name HG   )  4.56  2.76  0.91
 assign (resid   5 and name HE*  ) (resid  65 and name HB*  )  3.49  1.69  0.70
 assign (resid  63 and name HA   ) (resid  66 and name HB1  )  4.86  3.06  0.97
 assign (resid  25 and name HD2* ) (resid  30 and name HB2  )  3.71  1.91  0.74
 assign (resid  51 and name HN   ) (resid  52 and name HD1* )  5.20  3.40  1.04
 assign (resid  51 and name HN   ) (resid  52 and name HD2* )  5.39  3.59  1.08
 assign (resid  31 and name HA2  ) (resid  35 and name HN   )  6.43  4.63  1.29
 assign (resid   8 and name HA   ) (resid   9 and name HB1  )  6.50  4.70  1.30
 assign (resid  11 and name HD*  ) (resid  15 and name HD2* )  5.42  3.62  1.08
 assign (resid  62 and name HA   ) (resid  65 and name HB*  )  4.23  2.43  0.85
 assign (resid  18 and name HA   ) (resid  18 and name HD2  )  5.07  3.27  1.01
 assign (resid   5 and name HD*  ) (resid  62 and name HA   )  3.69  1.89  0.74
 assign (resid   4 and name HB2  ) (resid   5 and name HD*  )  4.15  2.35  0.83
 assign (resid   5 and name HD*  ) (resid  21 and name HG2* )  5.23  3.43  1.05
 assign (resid   5 and name HA   ) (resid   5 and name HE*  )  5.10  3.30  1.02
 assign (resid   5 and name HZ   ) (resid  64 and name HB2  )  5.44  3.64  1.09
 assign (resid   5 and name HZ   ) (resid  64 and name HB1  )  5.33  3.53  1.07
 assign (resid  11 and name HZ   ) (resid  30 and name HB1  )  4.75  2.95  0.95
 assign (resid  11 and name HE*  ) (resid  41 and name HG1  )  4.87  3.07  0.97
 assign (resid  11 and name HZ   ) (resid  43 and name HD2* )  5.01  3.21  1.00
 assign (resid  28 and name HA   ) (resid  28 and name HE*  )  5.23  3.43  1.05
 assign (resid  28 and name HE*  ) (resid  60 and name HB2  )  4.17  2.37  0.83
 assign (resid  28 and name HD*  ) (resid  57 and name HB   )  5.72  3.92  1.14
 assign (resid  25 and name HD2* ) (resid  28 and name HD*  )  4.97  3.17  0.99
 assign (resid  28 and name HE*  ) (resid  57 and name HG12 )  4.73  2.93  0.95
 assign (resid  18 and name HD2  ) (resid  65 and name HA   )  4.84  3.04  0.97
 assign (resid  18 and name HD2  ) (resid  65 and name HB*  )  5.29  3.49  1.06
 assign (resid  18 and name HD2  ) (resid  64 and name HB1  )  5.42  3.62  1.08
 assign (resid   5 and name HE*  ) (resid  62 and name HA   )  5.04  3.24  1.01
 assign (resid   5 and name HE*  ) (resid  64 and name HD1* )  4.85  3.05  0.97
 assign (resid   5 and name HE*  ) (resid  64 and name HB1  )  5.28  3.48  1.06
 assign (resid  50 and name HD2  ) (resid  52 and name HD1* )  5.24  3.44  1.05
 assign (resid   5 and name HZ   ) (resid  18 and name HD2  )  5.58  3.78  1.12
 assign (resid   5 and name HE*  ) (resid  24 and name HG1* )  6.06  4.26  1.21
 assign (resid   5 and name HD*  ) (resid  62 and name HD22 )  3.98  2.18  0.80
 assign (resid  11 and name HE*  ) (resid  57 and name HG2* )  6.01  4.21  1.20
 assign (resid  11 and name HE*  ) (resid  57 and name HD1* )  6.33  4.53  1.27
 assign (resid   3 and name HA   ) (resid   4 and name HG*  )  5.91  4.11  1.18
 assign (resid   3 and name HB1  ) (resid   4 and name HG*  )  6.27  4.47  1.25
 assign (resid   4 and name HN   ) (resid   4 and name HG*  )  3.08  1.28  0.62
 assign (resid   4 and name HA   ) (resid   4 and name HG*  )  3.19  1.39  0.64
 assign (resid   4 and name HG*  ) (resid   4 and name HE*  )  3.22  1.42  0.64
 assign (resid   4 and name HG*  ) (resid   5 and name HN   )  4.56  2.76  0.91
 assign (resid   4 and name HG*  ) (resid   5 and name HE*  )  5.58  3.78  1.12
 assign (resid   4 and name HG*  ) (resid  17 and name HG2* )  4.58  2.78  0.92
 assign (resid   7 and name HA   ) (resid   7 and name HE*  )  4.95  3.15  0.99
 assign (resid   7 and name HA   ) (resid  42 and name HB*  )  5.49  3.69  1.10
 assign (resid   7 and name HB2  ) (resid   7 and name HE*  )  5.03  3.23  1.01
 assign (resid   7 and name HG1  ) (resid   7 and name HE*  )  3.54  1.74  0.71
 assign (resid   7 and name HE*  ) (resid   8 and name HN   )  5.86  4.06  1.17
 assign (resid   7 and name HE*  ) (resid  54 and name HG1* )  3.90  2.10  0.78
 assign (resid   7 and name HE*  ) (resid  54 and name HG2* )  4.48  2.68  0.90
 assign (resid   7 and name HE*  ) (resid  55 and name HN   )  6.21  4.41  1.24
 assign (resid   7 and name HE*  ) (resid  58 and name HD1* )  4.65  2.85  0.93
 assign (resid   8 and name HA   ) (resid  42 and name HB*  )  3.30  1.50  0.66
 assign (resid   8 and name HB1  ) (resid  42 and name HB*  )  6.19  4.39  1.24
 assign (resid   9 and name HG1  ) (resid  42 and name HB*  )  6.27  4.47  1.25
 assign (resid  10 and name HA   ) (resid  42 and name HB*  )  4.04  2.24  0.81
 assign (resid  10 and name HG2* ) (resid  42 and name HB*  )  4.07  2.27  0.81
 assign (resid  11 and name HZ   ) (resid  41 and name HG*  )  6.11  4.31  1.22
 assign (resid  18 and name HN   ) (resid  19 and name HD*  )  4.77  2.97  0.95
 assign (resid  18 and name HA   ) (resid  19 and name HG*  )  4.26  2.46  0.85
 assign (resid  18 and name HA   ) (resid  19 and name HD*  )  2.48  0.68  0.50
 assign (resid  18 and name HB2  ) (resid  19 and name HD*  )  4.15  2.35  0.83
 assign (resid  18 and name HB1  ) (resid  19 and name HD*  )  4.01  2.21  0.80
 assign (resid  18 and name HD2  ) (resid  19 and name HD*  )  4.59  2.79  0.92
 assign (resid  19 and name HG*  ) (resid  20 and name HA2  )  5.86  4.06  1.17
 assign (resid  19 and name HG*  ) (resid  20 and name HA1  )  5.26  3.46  1.05
 assign (resid  19 and name HG*  ) (resid  21 and name HN   )  5.79  3.99  1.16
 assign (resid  38 and name HA   ) (resid  41 and name HG*  )  4.58  2.78  0.92
 assign (resid  41 and name HN   ) (resid  41 and name HG*  )  3.92  2.12  0.78
 assign (resid  41 and name HA   ) (resid  41 and name HG*  )  3.32  1.52  0.66
 assign (resid  41 and name HA   ) (resid  42 and name HB*  )  4.87  3.07  0.97
 assign (resid  41 and name HG*  ) (resid  45 and name HN   )  5.52  3.72  1.10
 assign (resid  41 and name HG*  ) (resid  45 and name HB2  )  4.19  2.39  0.84
 assign (resid  41 and name HG*  ) (resid  45 and name HB1  )  3.83  2.03  0.77
 assign (resid  41 and name HG*  ) (resid  45 and name HG2  )  6.27  4.47  1.25
 assign (resid  41 and name HG*  ) (resid  45 and name HG1  )  4.81  3.01  0.96
 assign (resid  42 and name HN   ) (resid  42 and name HB*  )  3.11  1.31  0.62
 assign (resid  42 and name HB*  ) (resid  43 and name HN   )  3.21  1.41  0.64
 assign (resid  42 and name HB*  ) (resid  43 and name HB2  )  5.44  3.64  1.09
 assign (resid  42 and name HB*  ) (resid  44 and name HN   )  3.56  1.76  0.71
 assign (resid  42 and name HB*  ) (resid  44 and name HB1  )  4.62  2.82  0.92
 assign (resid  42 and name HB*  ) (resid  45 and name HN   )  3.87  2.07  0.77
 assign (resid  42 and name HB*  ) (resid  45 and name HB2  )  5.25  3.45  1.05
 assign (resid  42 and name HB*  ) (resid  45 and name HG2  )  6.06  4.26  1.21
 assign (resid  52 and name HB1  ) (resid  56 and name HB*  )  6.00  4.20  1.20
 assign (resid  53 and name HB1  ) (resid  56 and name HB*  )  3.80  2.00  0.76
 assign (resid  54 and name HN   ) (resid  55 and name HG*  )  5.38  3.58  1.08
 assign (resid  54 and name HB   ) (resid  55 and name HG*  )  6.27  4.47  1.25
 assign (resid  54 and name HG1* ) (resid  55 and name HG*  )  3.08  1.28  0.62
 assign (resid  54 and name HG2* ) (resid  55 and name HG*  )  4.38  2.58  0.88
 assign (resid  55 and name HN   ) (resid  55 and name HG*  )  2.85  1.05  0.57
 assign (resid  55 and name HN   ) (resid  56 and name HB*  )  4.61  2.81  0.92
 assign (resid  55 and name HA   ) (resid  55 and name HG*  )  3.16  1.36  0.63
 assign (resid  55 and name HG*  ) (resid  58 and name HB2  )  5.83  4.03  1.17
 assign (resid  55 and name HG*  ) (resid  58 and name HD1* )  4.07  2.27  0.81
 assign (resid  55 and name HG*  ) (resid  58 and name HD2* )  6.27  4.47  1.25
 assign (resid  56 and name HN   ) (resid  56 and name HB*  )  2.77  0.97  0.55
 assign (resid  56 and name HB*  ) (resid  57 and name HN   )  3.12  1.32  0.62
 assign (resid  56 and name HB*  ) (resid  57 and name HG11 )  4.40  2.60  0.88
 assign (resid  56 and name HB*  ) (resid  57 and name HD1* )  5.63  3.83  1.13
 assign (resid  67 and name HN   ) (resid  67 and name HG*  )  3.22  1.42  0.64
 assign (resid  67 and name HA   ) (resid  67 and name HG*  )  3.28  1.48  0.66
 assign (resid  67 and name HG*  ) (resid  68 and name HN   )  4.73  2.93  0.95
 assign (resid  68 and name HN   ) (resid  68 and name HB*  )  3.11  1.31  0.62
 assign (resid  68 and name HA   ) (resid  68 and name HB*  )  2.52  0.72  0.50
 assign (resid  10 and name O    ) (resid  14 and name HN   )  2.00  0.20  0.40
 assign (resid  10 and name O    ) (resid  14 and name N    )  3.00  1.20  0.60
 assign (resid  11 and name O    ) (resid  15 and name HN   )  2.00  0.20  0.40
 assign (resid  11 and name O    ) (resid  15 and name N    )  3.00  1.20  0.60
 assign (resid  12 and name O    ) (resid  16 and name HN   )  2.00  0.20  0.40
 assign (resid  12 and name O    ) (resid  16 and name N    )  3.00  1.20  0.60
 assign (resid  13 and name O    ) (resid  17 and name HN   )  2.00  0.20  0.40
 assign (resid  13 and name O    ) (resid  17 and name N    )  3.00  1.20  0.60
 assign (resid  20 and name O    ) (resid  24 and name HN   )  2.00  0.20  0.40
 assign (resid  20 and name O    ) (resid  24 and name N    )  3.00  1.20  0.60
 assign (resid  21 and name O    ) (resid  25 and name HN   )  2.00  0.20  0.40
 assign (resid  21 and name O    ) (resid  25 and name N    )  3.00  1.20  0.60
 assign (resid  22 and name O    ) (resid  26 and name HN   )  2.00  0.20  0.40
 assign (resid  22 and name O    ) (resid  26 and name N    )  3.00  1.20  0.60
 assign (resid  23 and name O    ) (resid  27 and name HN   )  2.00  0.20  0.40
 assign (resid  23 and name O    ) (resid  27 and name N    )  3.00  1.20  0.60
 assign (resid  42 and name O    ) (resid  46 and name HN   )  2.00  0.20  0.40
 assign (resid  42 and name O    ) (resid  46 and name N    )  3.00  1.20  0.60
 assign (resid  43 and name O    ) (resid  47 and name HN   )  2.00  0.20  0.40
 assign (resid  43 and name O    ) (resid  47 and name N    )  3.00  1.20  0.60
 assign (resid  44 and name O    ) (resid  48 and name HN   )  2.00  0.20  0.40
 assign (resid  44 and name O    ) (resid  48 and name N    )  3.00  1.20  0.60
 assign (resid  45 and name O    ) (resid  49 and name HN   )  2.00  0.20  0.40
 assign (resid  45 and name O    ) (resid  49 and name N    )  3.00  1.20  0.60
 assign (resid  46 and name O    ) (resid  50 and name HN   )  2.00  0.20  0.40
 assign (resid  46 and name O    ) (resid  50 and name N    )  3.00  1.20  0.60
 assign (resid  54 and name O    ) (resid  58 and name HN   )  2.00  0.20  0.40
 assign (resid  54 and name O    ) (resid  58 and name N    )  3.00  1.20  0.60
 assign (resid  55 and name O    ) (resid  59 and name HN   )  2.00  0.20  0.40
 assign (resid  55 and name O    ) (resid  59 and name N    )  3.00  1.20  0.60
 assign (resid  57 and name O    ) (resid  61 and name HN   )  2.00  0.20  0.40
 assign (resid  57 and name O    ) (resid  61 and name N    )  3.00  1.20  0.60
 assign (resid  58 and name O    ) (resid  62 and name HN   )  2.00  0.20  0.40
 assign (resid  58 and name O    ) (resid  62 and name N    )  3.00  1.20  0.60
!
! ACO file produced by PDBStat
! Version:  5.0-Exp Compiled 2007-07-09 on (europa)
!
 dihedral
   assign (resid   5 and name C   )   (resid   6 and name N   )
          (resid   6 and name CA  )   (resid   6 and name C   )   1.0   -115.00    60.00   2 
   assign (resid   6 and name N   )   (resid   6 and name CA  )
          (resid   6 and name C   )   (resid   7 and name N   )   1.0    168.00    18.00   2 
   assign (resid   9 and name C   )   (resid  10 and name N   )
          (resid  10 and name CA  )   (resid  10 and name C   )   1.0   -115.00    62.00   2 
   assign (resid  10 and name N   )   (resid  10 and name CA  )
          (resid  10 and name C   )   (resid  11 and name N   )   1.0    163.00    18.00   2 
   assign (resid  10 and name C   )   (resid  11 and name N   )
          (resid  11 and name CA  )   (resid  11 and name C   )   1.0    -58.00    10.00   2 
   assign (resid  11 and name N   )   (resid  11 and name CA  )
          (resid  11 and name C   )   (resid  12 and name N   )   1.0    -39.00    14.00   2 
   assign (resid  11 and name C   )   (resid  12 and name N   )
          (resid  12 and name CA  )   (resid  12 and name C   )   1.0    -62.00    10.00   2 
   assign (resid  12 and name N   )   (resid  12 and name CA  )
          (resid  12 and name C   )   (resid  13 and name N   )   1.0    -41.00    10.00   2 
   assign (resid  12 and name C   )   (resid  13 and name N   )
          (resid  13 and name CA  )   (resid  13 and name C   )   1.0    -66.00    10.00   2 
   assign (resid  13 and name N   )   (resid  13 and name CA  )
          (resid  13 and name C   )   (resid  14 and name N   )   1.0    -42.00    14.00   2 
   assign (resid  13 and name C   )   (resid  14 and name N   )
          (resid  14 and name CA  )   (resid  14 and name C   )   1.0    -63.00    12.00   2 
   assign (resid  14 and name N   )   (resid  14 and name CA  )
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   assign (resid  14 and name C   )   (resid  15 and name N   )
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   assign (resid  15 and name N   )   (resid  15 and name CA  )
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   assign (resid  21 and name N   )   (resid  21 and name CA  )
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   assign (resid  21 and name C   )   (resid  22 and name N   )
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   assign (resid  22 and name N   )   (resid  22 and name CA  )
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   assign (resid  22 and name C   )   (resid  23 and name N   )
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   assign (resid  23 and name N   )   (resid  23 and name CA  )
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   assign (resid  23 and name C   )   (resid  24 and name N   )
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   assign (resid  24 and name N   )   (resid  24 and name CA  )
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   assign (resid  24 and name C   )   (resid  25 and name N   )
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   assign (resid  25 and name N   )   (resid  25 and name CA  )
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   assign (resid  25 and name C   )   (resid  26 and name N   )
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   assign (resid  26 and name N   )   (resid  26 and name CA  )
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   assign (resid  26 and name C   )   (resid  27 and name N   )
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   assign (resid  27 and name N   )   (resid  27 and name CA  )
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   assign (resid  42 and name C   )   (resid  43 and name N   )
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   assign (resid  43 and name N   )   (resid  43 and name CA  )
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   assign (resid  43 and name C   )   (resid  44 and name N   )
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   assign (resid  44 and name N   )   (resid  44 and name CA  )
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   assign (resid  44 and name C   )   (resid  45 and name N   )
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   assign (resid  45 and name C   )   (resid  46 and name N   )
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   assign (resid  46 and name N   )   (resid  46 and name CA  )
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   assign (resid  46 and name C   )   (resid  47 and name N   )
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   assign (resid  47 and name N   )   (resid  47 and name CA  )
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   assign (resid  47 and name C   )   (resid  48 and name N   )
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   assign (resid  48 and name N   )   (resid  48 and name CA  )
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   assign (resid  48 and name C   )   (resid  49 and name N   )
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   assign (resid  49 and name N   )   (resid  49 and name CA  )
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   assign (resid  52 and name N   )   (resid  52 and name CA  )
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   assign (resid  52 and name C   )   (resid  53 and name N   )
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   assign (resid  53 and name N   )   (resid  53 and name CA  )
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   assign (resid  55 and name N   )   (resid  55 and name CA  )
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   assign (resid  55 and name C   )   (resid  56 and name N   )
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   assign (resid  56 and name N   )   (resid  56 and name CA  )
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   assign (resid  56 and name C   )   (resid  57 and name N   )
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   assign (resid  57 and name N   )   (resid  57 and name CA  )
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   assign (resid  57 and name C   )   (resid  58 and name N   )
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   assign (resid  58 and name N   )   (resid  58 and name CA  )
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   assign (resid  58 and name C   )   (resid  59 and name N   )
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   assign (resid  59 and name N   )   (resid  59 and name CA  )
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   assign (resid  59 and name C   )   (resid  60 and name N   )
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   assign (resid  60 and name N   )   (resid  60 and name CA  )
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   assign (resid  60 and name C   )   (resid  61 and name N   )
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   assign (resid  61 and name N   )   (resid  61 and name CA  )
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   assign (resid  61 and name C   )   (resid  62 and name N   )
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   assign (resid  62 and name N   )   (resid  62 and name CA  )
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   assign (resid  62 and name C   )   (resid  63 and name N   )
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   assign (resid  63 and name N   )   (resid  63 and name CA  )
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   assign (resid   1 and name N   )   (resid   1 and name CA  )
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   assign (resid   1 and name N   )   (resid   1 and name CA  )
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   assign (resid   1 and name N   )   (resid   1 and name CA  )
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   assign (resid   1 and name CA  )   (resid   1 and name CB  )
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   assign (resid   1 and name CA  )   (resid   1 and name CB  )
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   assign (resid   1 and name CA  )   (resid   1 and name CB  )
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   assign (resid   2 and name N   )   (resid   2 and name CA  )
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   assign (resid   2 and name N   )   (resid   2 and name CA  )
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   assign (resid   2 and name N   )   (resid   2 and name CA  )
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   assign (resid   3 and name N   )   (resid   3 and name CA  )
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   assign (resid   3 and name N   )   (resid   3 and name CA  )
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   assign (resid   3 and name N   )   (resid   3 and name CA  )
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   assign (resid   3 and name CA  )   (resid   3 and name CB  )
          (resid   3 and name CG  )   (resid   3 and name CD  )   0.2     60.00   150.00   2 
   assign (resid   3 and name CA  )   (resid   3 and name CB  )
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   assign (resid   3 and name CA  )   (resid   3 and name CB  )
          (resid   3 and name CG  )   (resid   3 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid   4 and name N   )   (resid   4 and name CA  )
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   assign (resid   4 and name N   )   (resid   4 and name CA  )
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   assign (resid   4 and name N   )   (resid   4 and name CA  )
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   assign (resid   4 and name CA  )   (resid   4 and name CB  )
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   assign (resid   4 and name CA  )   (resid   4 and name CB  )
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   assign (resid   4 and name CA  )   (resid   4 and name CB  )
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   assign (resid   4 and name CB  )   (resid   4 and name CG  )
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   assign (resid   4 and name CB  )   (resid   4 and name CG  )
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   assign (resid   4 and name CB  )   (resid   4 and name CG  )
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   assign (resid   4 and name CG  )   (resid   4 and name CD  )
          (resid   4 and name CE  )   (resid   4 and name NZ  )   0.2     60.00   150.00   2 
   assign (resid   4 and name CG  )   (resid   4 and name CD  )
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   assign (resid   4 and name CG  )   (resid   4 and name CD  )
          (resid   4 and name CE  )   (resid   4 and name NZ  )   0.2    -60.00   150.00   2 
   assign (resid   5 and name N   )   (resid   5 and name CA  )
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   assign (resid   5 and name N   )   (resid   5 and name CA  )
          (resid   5 and name CB  )   (resid   5 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid   5 and name N   )   (resid   5 and name CA  )
          (resid   5 and name CB  )   (resid   5 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid   6 and name N   )   (resid   6 and name CA  )
          (resid   6 and name CB  )   (resid   6 and name OG1 )   0.2     60.00   150.00   2 
   assign (resid   6 and name N   )   (resid   6 and name CA  )
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   assign (resid   6 and name N   )   (resid   6 and name CA  )
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   assign (resid   7 and name N   )   (resid   7 and name CA  )
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   assign (resid   7 and name N   )   (resid   7 and name CA  )
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   assign (resid   7 and name N   )   (resid   7 and name CA  )
          (resid   7 and name CB  )   (resid   7 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid   7 and name CA  )   (resid   7 and name CB  )
          (resid   7 and name CG  )   (resid   7 and name CD  )   0.2     60.00   150.00   2 
   assign (resid   7 and name CA  )   (resid   7 and name CB  )
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   assign (resid   7 and name CA  )   (resid   7 and name CB  )
          (resid   7 and name CG  )   (resid   7 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid   7 and name CB  )   (resid   7 and name CG  )
          (resid   7 and name CD  )   (resid   7 and name CE  )   0.2     60.00   150.00   2 
   assign (resid   7 and name CB  )   (resid   7 and name CG  )
          (resid   7 and name CD  )   (resid   7 and name CE  )   0.2   -180.00   150.00   2 
   assign (resid   7 and name CB  )   (resid   7 and name CG  )
          (resid   7 and name CD  )   (resid   7 and name CE  )   0.2    -60.00   150.00   2 
   assign (resid   7 and name CG  )   (resid   7 and name CD  )
          (resid   7 and name CE  )   (resid   7 and name NZ  )   0.2     60.00   150.00   2 
   assign (resid   7 and name CG  )   (resid   7 and name CD  )
          (resid   7 and name CE  )   (resid   7 and name NZ  )   0.2   -180.00   150.00   2 
   assign (resid   7 and name CG  )   (resid   7 and name CD  )
          (resid   7 and name CE  )   (resid   7 and name NZ  )   0.2    -60.00   150.00   2 
   assign (resid   8 and name N   )   (resid   8 and name CA  )
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   assign (resid   8 and name N   )   (resid   8 and name CA  )
          (resid   8 and name CB  )   (resid   8 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid   8 and name N   )   (resid   8 and name CA  )
          (resid   8 and name CB  )   (resid   8 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid   9 and name N   )   (resid   9 and name CA  )
          (resid   9 and name CB  )   (resid   9 and name CG  )   0.2     60.00   150.00   2 
   assign (resid   9 and name N   )   (resid   9 and name CA  )
          (resid   9 and name CB  )   (resid   9 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid   9 and name N   )   (resid   9 and name CA  )
          (resid   9 and name CB  )   (resid   9 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid   9 and name CA  )   (resid   9 and name CB  )
          (resid   9 and name CG  )   (resid   9 and name SD  )   0.2     60.00   150.00   2 
   assign (resid   9 and name CA  )   (resid   9 and name CB  )
          (resid   9 and name CG  )   (resid   9 and name SD  )   0.2   -180.00   150.00   2 
   assign (resid   9 and name CA  )   (resid   9 and name CB  )
          (resid   9 and name CG  )   (resid   9 and name SD  )   0.2    -60.00   150.00   2 
   assign (resid  10 and name N   )   (resid  10 and name CA  )
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   assign (resid  10 and name N   )   (resid  10 and name CA  )
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   assign (resid  10 and name N   )   (resid  10 and name CA  )
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   assign (resid  11 and name N   )   (resid  11 and name CA  )
          (resid  11 and name CB  )   (resid  11 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  11 and name N   )   (resid  11 and name CA  )
          (resid  11 and name CB  )   (resid  11 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  11 and name N   )   (resid  11 and name CA  )
          (resid  11 and name CB  )   (resid  11 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  13 and name N   )   (resid  13 and name CA  )
          (resid  13 and name CB  )   (resid  13 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  13 and name N   )   (resid  13 and name CA  )
          (resid  13 and name CB  )   (resid  13 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  13 and name N   )   (resid  13 and name CA  )
          (resid  13 and name CB  )   (resid  13 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  13 and name CA  )   (resid  13 and name CB  )
          (resid  13 and name CG  )   (resid  13 and name CD  )   0.2     60.00   150.00   2 
   assign (resid  13 and name CA  )   (resid  13 and name CB  )
          (resid  13 and name CG  )   (resid  13 and name CD  )   0.2   -180.00   150.00   2 
   assign (resid  13 and name CA  )   (resid  13 and name CB  )
          (resid  13 and name CG  )   (resid  13 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid  15 and name N   )   (resid  15 and name CA  )
          (resid  15 and name CB  )   (resid  15 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  15 and name N   )   (resid  15 and name CA  )
          (resid  15 and name CB  )   (resid  15 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  15 and name N   )   (resid  15 and name CA  )
          (resid  15 and name CB  )   (resid  15 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  15 and name CA  )   (resid  15 and name CB  )
          (resid  15 and name CG  )   (resid  15 and name CD1 )   0.2     60.00   150.00   2 
   assign (resid  15 and name CA  )   (resid  15 and name CB  )
          (resid  15 and name CG  )   (resid  15 and name CD1 )   0.2   -180.00   150.00   2 
   assign (resid  15 and name CA  )   (resid  15 and name CB  )
          (resid  15 and name CG  )   (resid  15 and name CD1 )   0.2    -60.00   150.00   2 
   assign (resid  16 and name N   )   (resid  16 and name CA  )
          (resid  16 and name CB  )   (resid  16 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  16 and name N   )   (resid  16 and name CA  )
          (resid  16 and name CB  )   (resid  16 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  16 and name N   )   (resid  16 and name CA  )
          (resid  16 and name CB  )   (resid  16 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  16 and name CA  )   (resid  16 and name CB  )
          (resid  16 and name CG  )   (resid  16 and name CD  )   0.2     60.00   150.00   2 
   assign (resid  16 and name CA  )   (resid  16 and name CB  )
          (resid  16 and name CG  )   (resid  16 and name CD  )   0.2   -180.00   150.00   2 
   assign (resid  16 and name CA  )   (resid  16 and name CB  )
          (resid  16 and name CG  )   (resid  16 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid  17 and name N   )   (resid  17 and name CA  )
          (resid  17 and name CB  )   (resid  17 and name OG1 )   0.2     60.00   150.00   2 
   assign (resid  17 and name N   )   (resid  17 and name CA  )
          (resid  17 and name CB  )   (resid  17 and name OG1 )   0.2   -180.00   150.00   2 
   assign (resid  17 and name N   )   (resid  17 and name CA  )
          (resid  17 and name CB  )   (resid  17 and name OG1 )   0.2    -60.00   150.00   2 
   assign (resid  18 and name N   )   (resid  18 and name CA  )
          (resid  18 and name CB  )   (resid  18 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  18 and name N   )   (resid  18 and name CA  )
          (resid  18 and name CB  )   (resid  18 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  18 and name N   )   (resid  18 and name CA  )
          (resid  18 and name CB  )   (resid  18 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  21 and name N   )   (resid  21 and name CA  )
          (resid  21 and name CB  )   (resid  21 and name CG1 )   0.2     60.00   150.00   2 
   assign (resid  21 and name N   )   (resid  21 and name CA  )
          (resid  21 and name CB  )   (resid  21 and name CG1 )   0.2   -180.00   150.00   2 
   assign (resid  21 and name N   )   (resid  21 and name CA  )
          (resid  21 and name CB  )   (resid  21 and name CG1 )   0.2    -60.00   150.00   2 
   assign (resid  24 and name N   )   (resid  24 and name CA  )
          (resid  24 and name CB  )   (resid  24 and name CG1 )   0.2     60.00   150.00   2 
   assign (resid  24 and name N   )   (resid  24 and name CA  )
          (resid  24 and name CB  )   (resid  24 and name CG1 )   0.2   -180.00   150.00   2 
   assign (resid  24 and name N   )   (resid  24 and name CA  )
          (resid  24 and name CB  )   (resid  24 and name CG1 )   0.2    -60.00   150.00   2 
   assign (resid  25 and name N   )   (resid  25 and name CA  )
          (resid  25 and name CB  )   (resid  25 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  25 and name N   )   (resid  25 and name CA  )
          (resid  25 and name CB  )   (resid  25 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  25 and name N   )   (resid  25 and name CA  )
          (resid  25 and name CB  )   (resid  25 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  25 and name CA  )   (resid  25 and name CB  )
          (resid  25 and name CG  )   (resid  25 and name CD1 )   0.2     60.00   150.00   2 
   assign (resid  25 and name CA  )   (resid  25 and name CB  )
          (resid  25 and name CG  )   (resid  25 and name CD1 )   0.2   -180.00   150.00   2 
   assign (resid  25 and name CA  )   (resid  25 and name CB  )
          (resid  25 and name CG  )   (resid  25 and name CD1 )   0.2    -60.00   150.00   2 
   assign (resid  26 and name N   )   (resid  26 and name CA  )
          (resid  26 and name CB  )   (resid  26 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  26 and name N   )   (resid  26 and name CA  )
          (resid  26 and name CB  )   (resid  26 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  26 and name N   )   (resid  26 and name CA  )
          (resid  26 and name CB  )   (resid  26 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  26 and name CA  )   (resid  26 and name CB  )
          (resid  26 and name CG  )   (resid  26 and name CD  )   0.2     60.00   150.00   2 
   assign (resid  26 and name CA  )   (resid  26 and name CB  )
          (resid  26 and name CG  )   (resid  26 and name CD  )   0.2   -180.00   150.00   2 
   assign (resid  26 and name CA  )   (resid  26 and name CB  )
          (resid  26 and name CG  )   (resid  26 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid  26 and name CB  )   (resid  26 and name CG  )
          (resid  26 and name CD  )   (resid  26 and name NE  )   0.2     60.00   150.00   2 
   assign (resid  26 and name CB  )   (resid  26 and name CG  )
          (resid  26 and name CD  )   (resid  26 and name NE  )   0.2   -180.00   150.00   2 
   assign (resid  26 and name CB  )   (resid  26 and name CG  )
          (resid  26 and name CD  )   (resid  26 and name NE  )   0.2    -60.00   150.00   2 
   assign (resid  27 and name N   )   (resid  27 and name CA  )
          (resid  27 and name CB  )   (resid  27 and name OG  )   0.2     60.00   150.00   2 
   assign (resid  27 and name N   )   (resid  27 and name CA  )
          (resid  27 and name CB  )   (resid  27 and name OG  )   0.2   -180.00   150.00   2 
   assign (resid  27 and name N   )   (resid  27 and name CA  )
          (resid  27 and name CB  )   (resid  27 and name OG  )   0.2    -60.00   150.00   2 
   assign (resid  28 and name N   )   (resid  28 and name CA  )
          (resid  28 and name CB  )   (resid  28 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  28 and name N   )   (resid  28 and name CA  )
          (resid  28 and name CB  )   (resid  28 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  28 and name N   )   (resid  28 and name CA  )
          (resid  28 and name CB  )   (resid  28 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  29 and name N   )   (resid  29 and name CA  )
          (resid  29 and name CB  )   (resid  29 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  29 and name N   )   (resid  29 and name CA  )
          (resid  29 and name CB  )   (resid  29 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  29 and name N   )   (resid  29 and name CA  )
          (resid  29 and name CB  )   (resid  29 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  30 and name N   )   (resid  30 and name CA  )
          (resid  30 and name CB  )   (resid  30 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  30 and name N   )   (resid  30 and name CA  )
          (resid  30 and name CB  )   (resid  30 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  30 and name N   )   (resid  30 and name CA  )
          (resid  30 and name CB  )   (resid  30 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  30 and name CA  )   (resid  30 and name CB  )
          (resid  30 and name CG  )   (resid  30 and name CD1 )   0.2     60.00   150.00   2 
   assign (resid  30 and name CA  )   (resid  30 and name CB  )
          (resid  30 and name CG  )   (resid  30 and name CD1 )   0.2   -180.00   150.00   2 
   assign (resid  30 and name CA  )   (resid  30 and name CB  )
          (resid  30 and name CG  )   (resid  30 and name CD1 )   0.2    -60.00   150.00   2 
   assign (resid  32 and name N   )   (resid  32 and name CA  )
          (resid  32 and name CB  )   (resid  32 and name SG  )   0.2     60.00   150.00   2 
   assign (resid  32 and name N   )   (resid  32 and name CA  )
          (resid  32 and name CB  )   (resid  32 and name SG  )   0.2   -180.00   150.00   2 
   assign (resid  32 and name N   )   (resid  32 and name CA  )
          (resid  32 and name CB  )   (resid  32 and name SG  )   0.2    -60.00   150.00   2 
   assign (resid  33 and name N   )   (resid  33 and name CA  )
          (resid  33 and name CB  )   (resid  33 and name CG1 )   0.2     60.00   150.00   2 
   assign (resid  33 and name N   )   (resid  33 and name CA  )
          (resid  33 and name CB  )   (resid  33 and name CG1 )   0.2   -180.00   150.00   2 
   assign (resid  33 and name N   )   (resid  33 and name CA  )
          (resid  33 and name CB  )   (resid  33 and name CG1 )   0.2    -60.00   150.00   2 
   assign (resid  33 and name CA  )   (resid  33 and name CB  )
          (resid  33 and name CG1 )   (resid  33 and name CD1 )   0.2     60.00   150.00   2 
   assign (resid  33 and name CA  )   (resid  33 and name CB  )
          (resid  33 and name CG1 )   (resid  33 and name CD1 )   0.2   -180.00   150.00   2 
   assign (resid  33 and name CA  )   (resid  33 and name CB  )
          (resid  33 and name CG1 )   (resid  33 and name CD1 )   0.2    -60.00   150.00   2 
   assign (resid  35 and name N   )   (resid  35 and name CA  )
          (resid  35 and name CB  )   (resid  35 and name SG  )   0.2     60.00   150.00   2 
   assign (resid  35 and name N   )   (resid  35 and name CA  )
          (resid  35 and name CB  )   (resid  35 and name SG  )   0.2   -180.00   150.00   2 
   assign (resid  35 and name N   )   (resid  35 and name CA  )
          (resid  35 and name CB  )   (resid  35 and name SG  )   0.2    -60.00   150.00   2 
   assign (resid  36 and name N   )   (resid  36 and name CA  )
          (resid  36 and name CB  )   (resid  36 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  36 and name N   )   (resid  36 and name CA  )
          (resid  36 and name CB  )   (resid  36 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  36 and name N   )   (resid  36 and name CA  )
          (resid  36 and name CB  )   (resid  36 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  36 and name CA  )   (resid  36 and name CB  )
          (resid  36 and name CG  )   (resid  36 and name SD  )   0.2     60.00   150.00   2 
   assign (resid  36 and name CA  )   (resid  36 and name CB  )
          (resid  36 and name CG  )   (resid  36 and name SD  )   0.2   -180.00   150.00   2 
   assign (resid  36 and name CA  )   (resid  36 and name CB  )
          (resid  36 and name CG  )   (resid  36 and name SD  )   0.2    -60.00   150.00   2 
   assign (resid  39 and name N   )   (resid  39 and name CA  )
          (resid  39 and name CB  )   (resid  39 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  39 and name N   )   (resid  39 and name CA  )
          (resid  39 and name CB  )   (resid  39 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  39 and name N   )   (resid  39 and name CA  )
          (resid  39 and name CB  )   (resid  39 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  39 and name CA  )   (resid  39 and name CB  )
          (resid  39 and name CG  )   (resid  39 and name CD  )   0.2     60.00   150.00   2 
   assign (resid  39 and name CA  )   (resid  39 and name CB  )
          (resid  39 and name CG  )   (resid  39 and name CD  )   0.2   -180.00   150.00   2 
   assign (resid  39 and name CA  )   (resid  39 and name CB  )
          (resid  39 and name CG  )   (resid  39 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid  40 and name N   )   (resid  40 and name CA  )
          (resid  40 and name CB  )   (resid  40 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  40 and name N   )   (resid  40 and name CA  )
          (resid  40 and name CB  )   (resid  40 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  40 and name N   )   (resid  40 and name CA  )
          (resid  40 and name CB  )   (resid  40 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  41 and name N   )   (resid  41 and name CA  )
          (resid  41 and name CB  )   (resid  41 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  41 and name N   )   (resid  41 and name CA  )
          (resid  41 and name CB  )   (resid  41 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  41 and name N   )   (resid  41 and name CA  )
          (resid  41 and name CB  )   (resid  41 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  41 and name CA  )   (resid  41 and name CB  )
          (resid  41 and name CG  )   (resid  41 and name CD  )   0.2     60.00   150.00   2 
   assign (resid  41 and name CA  )   (resid  41 and name CB  )
          (resid  41 and name CG  )   (resid  41 and name CD  )   0.2   -180.00   150.00   2 
   assign (resid  41 and name CA  )   (resid  41 and name CB  )
          (resid  41 and name CG  )   (resid  41 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid  42 and name N   )   (resid  42 and name CA  )
          (resid  42 and name CB  )   (resid  42 and name OG  )   0.2     60.00   150.00   2 
   assign (resid  42 and name N   )   (resid  42 and name CA  )
          (resid  42 and name CB  )   (resid  42 and name OG  )   0.2   -180.00   150.00   2 
   assign (resid  42 and name N   )   (resid  42 and name CA  )
          (resid  42 and name CB  )   (resid  42 and name OG  )   0.2    -60.00   150.00   2 
   assign (resid  43 and name N   )   (resid  43 and name CA  )
          (resid  43 and name CB  )   (resid  43 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  43 and name N   )   (resid  43 and name CA  )
          (resid  43 and name CB  )   (resid  43 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  43 and name N   )   (resid  43 and name CA  )
          (resid  43 and name CB  )   (resid  43 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  43 and name CA  )   (resid  43 and name CB  )
          (resid  43 and name CG  )   (resid  43 and name CD1 )   0.2     60.00   150.00   2 
   assign (resid  43 and name CA  )   (resid  43 and name CB  )
          (resid  43 and name CG  )   (resid  43 and name CD1 )   0.2   -180.00   150.00   2 
   assign (resid  43 and name CA  )   (resid  43 and name CB  )
          (resid  43 and name CG  )   (resid  43 and name CD1 )   0.2    -60.00   150.00   2 
   assign (resid  44 and name N   )   (resid  44 and name CA  )
          (resid  44 and name CB  )   (resid  44 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  44 and name N   )   (resid  44 and name CA  )
          (resid  44 and name CB  )   (resid  44 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  44 and name N   )   (resid  44 and name CA  )
          (resid  44 and name CB  )   (resid  44 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  44 and name CA  )   (resid  44 and name CB  )
          (resid  44 and name CG  )   (resid  44 and name CD  )   0.2     60.00   150.00   2 
   assign (resid  44 and name CA  )   (resid  44 and name CB  )
          (resid  44 and name CG  )   (resid  44 and name CD  )   0.2   -180.00   150.00   2 
   assign (resid  44 and name CA  )   (resid  44 and name CB  )
          (resid  44 and name CG  )   (resid  44 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid  45 and name N   )   (resid  45 and name CA  )
          (resid  45 and name CB  )   (resid  45 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  45 and name N   )   (resid  45 and name CA  )
          (resid  45 and name CB  )   (resid  45 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  45 and name N   )   (resid  45 and name CA  )
          (resid  45 and name CB  )   (resid  45 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  45 and name CA  )   (resid  45 and name CB  )
          (resid  45 and name CG  )   (resid  45 and name CD  )   0.2     60.00   150.00   2 
   assign (resid  45 and name CA  )   (resid  45 and name CB  )
          (resid  45 and name CG  )   (resid  45 and name CD  )   0.2   -180.00   150.00   2 
   assign (resid  45 and name CA  )   (resid  45 and name CB  )
          (resid  45 and name CG  )   (resid  45 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid  48 and name N   )   (resid  48 and name CA  )
          (resid  48 and name CB  )   (resid  48 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  48 and name N   )   (resid  48 and name CA  )
          (resid  48 and name CB  )   (resid  48 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  48 and name N   )   (resid  48 and name CA  )
          (resid  48 and name CB  )   (resid  48 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  50 and name N   )   (resid  50 and name CA  )
          (resid  50 and name CB  )   (resid  50 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  50 and name N   )   (resid  50 and name CA  )
          (resid  50 and name CB  )   (resid  50 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  50 and name N   )   (resid  50 and name CA  )
          (resid  50 and name CB  )   (resid  50 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  52 and name N   )   (resid  52 and name CA  )
          (resid  52 and name CB  )   (resid  52 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  52 and name N   )   (resid  52 and name CA  )
          (resid  52 and name CB  )   (resid  52 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  52 and name N   )   (resid  52 and name CA  )
          (resid  52 and name CB  )   (resid  52 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  52 and name CA  )   (resid  52 and name CB  )
          (resid  52 and name CG  )   (resid  52 and name CD1 )   0.2     60.00   150.00   2 
   assign (resid  52 and name CA  )   (resid  52 and name CB  )
          (resid  52 and name CG  )   (resid  52 and name CD1 )   0.2   -180.00   150.00   2 
   assign (resid  52 and name CA  )   (resid  52 and name CB  )
          (resid  52 and name CG  )   (resid  52 and name CD1 )   0.2    -60.00   150.00   2 
   assign (resid  53 and name N   )   (resid  53 and name CA  )
          (resid  53 and name CB  )   (resid  53 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  53 and name N   )   (resid  53 and name CA  )
          (resid  53 and name CB  )   (resid  53 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  53 and name N   )   (resid  53 and name CA  )
          (resid  53 and name CB  )   (resid  53 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  54 and name N   )   (resid  54 and name CA  )
          (resid  54 and name CB  )   (resid  54 and name CG1 )   0.2     60.00   150.00   2 
   assign (resid  54 and name N   )   (resid  54 and name CA  )
          (resid  54 and name CB  )   (resid  54 and name CG1 )   0.2   -180.00   150.00   2 
   assign (resid  54 and name N   )   (resid  54 and name CA  )
          (resid  54 and name CB  )   (resid  54 and name CG1 )   0.2    -60.00   150.00   2 
   assign (resid  55 and name N   )   (resid  55 and name CA  )
          (resid  55 and name CB  )   (resid  55 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  55 and name N   )   (resid  55 and name CA  )
          (resid  55 and name CB  )   (resid  55 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  55 and name N   )   (resid  55 and name CA  )
          (resid  55 and name CB  )   (resid  55 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  55 and name CA  )   (resid  55 and name CB  )
          (resid  55 and name CG  )   (resid  55 and name CD  )   0.2     60.00   150.00   2 
   assign (resid  55 and name CA  )   (resid  55 and name CB  )
          (resid  55 and name CG  )   (resid  55 and name CD  )   0.2   -180.00   150.00   2 
   assign (resid  55 and name CA  )   (resid  55 and name CB  )
          (resid  55 and name CG  )   (resid  55 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid  56 and name N   )   (resid  56 and name CA  )
          (resid  56 and name CB  )   (resid  56 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  56 and name N   )   (resid  56 and name CA  )
          (resid  56 and name CB  )   (resid  56 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  56 and name N   )   (resid  56 and name CA  )
          (resid  56 and name CB  )   (resid  56 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  57 and name N   )   (resid  57 and name CA  )
          (resid  57 and name CB  )   (resid  57 and name CG1 )   0.2     60.00   150.00   2 
   assign (resid  57 and name N   )   (resid  57 and name CA  )
          (resid  57 and name CB  )   (resid  57 and name CG1 )   0.2   -180.00   150.00   2 
   assign (resid  57 and name N   )   (resid  57 and name CA  )
          (resid  57 and name CB  )   (resid  57 and name CG1 )   0.2    -60.00   150.00   2 
   assign (resid  57 and name CA  )   (resid  57 and name CB  )
          (resid  57 and name CG1 )   (resid  57 and name CD1 )   0.2     60.00   150.00   2 
   assign (resid  57 and name CA  )   (resid  57 and name CB  )
          (resid  57 and name CG1 )   (resid  57 and name CD1 )   0.2   -180.00   150.00   2 
   assign (resid  57 and name CA  )   (resid  57 and name CB  )
          (resid  57 and name CG1 )   (resid  57 and name CD1 )   0.2    -60.00   150.00   2 
   assign (resid  58 and name N   )   (resid  58 and name CA  )
          (resid  58 and name CB  )   (resid  58 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  58 and name N   )   (resid  58 and name CA  )
          (resid  58 and name CB  )   (resid  58 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  58 and name N   )   (resid  58 and name CA  )
          (resid  58 and name CB  )   (resid  58 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  58 and name CA  )   (resid  58 and name CB  )
          (resid  58 and name CG  )   (resid  58 and name CD1 )   0.2     60.00   150.00   2 
   assign (resid  58 and name CA  )   (resid  58 and name CB  )
          (resid  58 and name CG  )   (resid  58 and name CD1 )   0.2   -180.00   150.00   2 
   assign (resid  58 and name CA  )   (resid  58 and name CB  )
          (resid  58 and name CG  )   (resid  58 and name CD1 )   0.2    -60.00   150.00   2 
   assign (resid  59 and name N   )   (resid  59 and name CA  )
          (resid  59 and name CB  )   (resid  59 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  59 and name N   )   (resid  59 and name CA  )
          (resid  59 and name CB  )   (resid  59 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  59 and name N   )   (resid  59 and name CA  )
          (resid  59 and name CB  )   (resid  59 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  59 and name CA  )   (resid  59 and name CB  )
          (resid  59 and name CG  )   (resid  59 and name CD  )   0.2     60.00   150.00   2 
   assign (resid  59 and name CA  )   (resid  59 and name CB  )
          (resid  59 and name CG  )   (resid  59 and name CD  )   0.2   -180.00   150.00   2 
   assign (resid  59 and name CA  )   (resid  59 and name CB  )
          (resid  59 and name CG  )   (resid  59 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid  59 and name CB  )   (resid  59 and name CG  )
          (resid  59 and name CD  )   (resid  59 and name NE  )   0.2     60.00   150.00   2 
   assign (resid  59 and name CB  )   (resid  59 and name CG  )
          (resid  59 and name CD  )   (resid  59 and name NE  )   0.2   -180.00   150.00   2 
   assign (resid  59 and name CB  )   (resid  59 and name CG  )
          (resid  59 and name CD  )   (resid  59 and name NE  )   0.2    -60.00   150.00   2 
   assign (resid  60 and name N   )   (resid  60 and name CA  )
          (resid  60 and name CB  )   (resid  60 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  60 and name N   )   (resid  60 and name CA  )
          (resid  60 and name CB  )   (resid  60 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  60 and name N   )   (resid  60 and name CA  )
          (resid  60 and name CB  )   (resid  60 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  61 and name N   )   (resid  61 and name CA  )
          (resid  61 and name CB  )   (resid  61 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  61 and name N   )   (resid  61 and name CA  )
          (resid  61 and name CB  )   (resid  61 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  61 and name N   )   (resid  61 and name CA  )
          (resid  61 and name CB  )   (resid  61 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  61 and name CA  )   (resid  61 and name CB  )
          (resid  61 and name CG  )   (resid  61 and name CD1 )   0.2     60.00   150.00   2 
   assign (resid  61 and name CA  )   (resid  61 and name CB  )
          (resid  61 and name CG  )   (resid  61 and name CD1 )   0.2   -180.00   150.00   2 
   assign (resid  61 and name CA  )   (resid  61 and name CB  )
          (resid  61 and name CG  )   (resid  61 and name CD1 )   0.2    -60.00   150.00   2 
   assign (resid  62 and name N   )   (resid  62 and name CA  )
          (resid  62 and name CB  )   (resid  62 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  62 and name N   )   (resid  62 and name CA  )
          (resid  62 and name CB  )   (resid  62 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  62 and name N   )   (resid  62 and name CA  )
          (resid  62 and name CB  )   (resid  62 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  64 and name N   )   (resid  64 and name CA  )
          (resid  64 and name CB  )   (resid  64 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  64 and name N   )   (resid  64 and name CA  )
          (resid  64 and name CB  )   (resid  64 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  64 and name N   )   (resid  64 and name CA  )
          (resid  64 and name CB  )   (resid  64 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  64 and name CA  )   (resid  64 and name CB  )
          (resid  64 and name CG  )   (resid  64 and name CD1 )   0.2     60.00   150.00   2 
   assign (resid  64 and name CA  )   (resid  64 and name CB  )
          (resid  64 and name CG  )   (resid  64 and name CD1 )   0.2   -180.00   150.00   2 
   assign (resid  64 and name CA  )   (resid  64 and name CB  )
          (resid  64 and name CG  )   (resid  64 and name CD1 )   0.2    -60.00   150.00   2 
   assign (resid  66 and name N   )   (resid  66 and name CA  )
          (resid  66 and name CB  )   (resid  66 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  66 and name N   )   (resid  66 and name CA  )
          (resid  66 and name CB  )   (resid  66 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  66 and name N   )   (resid  66 and name CA  )
          (resid  66 and name CB  )   (resid  66 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  66 and name CA  )   (resid  66 and name CB  )
          (resid  66 and name CG  )   (resid  66 and name CD1 )   0.2     60.00   150.00   2 
   assign (resid  66 and name CA  )   (resid  66 and name CB  )
          (resid  66 and name CG  )   (resid  66 and name CD1 )   0.2   -180.00   150.00   2 
   assign (resid  66 and name CA  )   (resid  66 and name CB  )
          (resid  66 and name CG  )   (resid  66 and name CD1 )   0.2    -60.00   150.00   2 
   assign (resid  67 and name N   )   (resid  67 and name CA  )
          (resid  67 and name CB  )   (resid  67 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  67 and name N   )   (resid  67 and name CA  )
          (resid  67 and name CB  )   (resid  67 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  67 and name N   )   (resid  67 and name CA  )
          (resid  67 and name CB  )   (resid  67 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  67 and name CA  )   (resid  67 and name CB  )
          (resid  67 and name CG  )   (resid  67 and name CD  )   0.2     60.00   150.00   2 
   assign (resid  67 and name CA  )   (resid  67 and name CB  )
          (resid  67 and name CG  )   (resid  67 and name CD  )   0.2   -180.00   150.00   2 
   assign (resid  67 and name CA  )   (resid  67 and name CB  )
          (resid  67 and name CG  )   (resid  67 and name CD  )   0.2    -60.00   150.00   2 
   assign (resid  68 and name N   )   (resid  68 and name CA  )
          (resid  68 and name CB  )   (resid  68 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  68 and name N   )   (resid  68 and name CA  )
          (resid  68 and name CB  )   (resid  68 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  68 and name N   )   (resid  68 and name CA  )
          (resid  68 and name CB  )   (resid  68 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  69 and name N   )   (resid  69 and name CA  )
          (resid  69 and name CB  )   (resid  69 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  69 and name N   )   (resid  69 and name CA  )
          (resid  69 and name CB  )   (resid  69 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  69 and name N   )   (resid  69 and name CA  )
          (resid  69 and name CB  )   (resid  69 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  70 and name N   )   (resid  70 and name CA  )
          (resid  70 and name CB  )   (resid  70 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  70 and name N   )   (resid  70 and name CA  )
          (resid  70 and name CB  )   (resid  70 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  70 and name N   )   (resid  70 and name CA  )
          (resid  70 and name CB  )   (resid  70 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  71 and name N   )   (resid  71 and name CA  )
          (resid  71 and name CB  )   (resid  71 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  71 and name N   )   (resid  71 and name CA  )
          (resid  71 and name CB  )   (resid  71 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  71 and name N   )   (resid  71 and name CA  )
          (resid  71 and name CB  )   (resid  71 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  72 and name N   )   (resid  72 and name CA  )
          (resid  72 and name CB  )   (resid  72 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  72 and name N   )   (resid  72 and name CA  )
          (resid  72 and name CB  )   (resid  72 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  72 and name N   )   (resid  72 and name CA  )
          (resid  72 and name CB  )   (resid  72 and name CG  )   0.2    -60.00   150.00   2 
   assign (resid  73 and name N   )   (resid  73 and name CA  )
          (resid  73 and name CB  )   (resid  73 and name CG  )   0.2     60.00   150.00   2 
   assign (resid  73 and name N   )   (resid  73 and name CA  )
          (resid  73 and name CB  )   (resid  73 and name CG  )   0.2   -180.00   150.00   2 
   assign (resid  73 and name N   )   (resid  73 and name CA  )
          (resid  73 and name CB  )   (resid  73 and name CG  )   0.2    -60.00   150.00   2 
 end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1 -17.929  12.819  -1.886
    2    H2   MET   1           2H       MET   1 -17.855  11.438  -0.910
    3    H3   MET   1           3H       MET   1 -17.778  11.292  -2.593
    4    HA   MET   1           HA       MET   1 -15.692  12.443  -2.665
    5    HB2  MET   1           2HB      MET   1 -14.518  13.029  -0.579
    6    HB3  MET   1           3HB      MET   1 -16.022  13.919  -0.760
    7    HG2  MET   1           2HG      MET   1 -15.536  11.548   1.037
    8    HG3  MET   1           3HG      MET   1 -15.753  13.227   1.529
    9    HE1  MET   1           3HE      MET   1 -17.636  12.419   3.279
   10    HE2  MET   1           1HE      MET   1 -17.391  10.755   2.747
   11    HE3  MET   1           2HE      MET   1 -19.019  11.431   2.811
   12    H    THR   2           H        THR   2 -14.529  10.787  -3.407
   13    HA   THR   2           HA       THR   2 -14.333   8.302  -1.837
   14    HB   THR   2           HB       THR   2 -14.998   8.043  -4.187
   15    HG1  THR   2           HG1      THR   2 -13.811   6.275  -4.358
   16   HG21  THR   2          3HG2      THR   2 -13.862   9.990  -5.142
   17   HG22  THR   2          1HG2      THR   2 -13.413   8.520  -6.006
   18   HG23  THR   2          2HG2      THR   2 -12.296   9.236  -4.845
   19    H    GLN   3           H        GLN   3 -12.030   7.173  -2.365
   20    HA   GLN   3           HA       GLN   3  -9.952   9.158  -1.661
   21    HB2  GLN   3           2HB      GLN   3 -10.114   6.259  -0.802
   22    HB3  GLN   3           3HB      GLN   3  -8.796   7.360  -0.423
   23    HG2  GLN   3           2HG      GLN   3 -10.477   8.807   0.757
   24    HG3  GLN   3           3HG      GLN   3 -11.648   7.509   0.531
   25   HE21  GLN   3          1HE2      GLN   3  -9.546   5.443   0.906
   26   HE22  GLN   3          2HE2      GLN   3  -9.262   5.406   2.608
   27    H    LYS   4           H        LYS   4  -8.205   9.286  -2.948
   28    HA   LYS   4           HA       LYS   4  -8.002   7.858  -5.369
   29    HB2  LYS   4           2HB      LYS   4  -5.928   9.474  -3.874
   30    HB3  LYS   4           3HB      LYS   4  -5.705   8.856  -5.506
   31    HG2  LYS   4           2HG      LYS   4  -7.712  10.160  -6.207
   32    HG3  LYS   4           3HG      LYS   4  -7.762  10.863  -4.589
   33    HD2  LYS   4           2HD      LYS   4  -6.640  12.347  -6.195
   34    HD3  LYS   4           3HD      LYS   4  -5.543  11.825  -4.915
   35    HE2  LYS   4           2HE      LYS   4  -4.480  11.772  -7.139
   36    HE3  LYS   4           3HE      LYS   4  -4.552  10.173  -6.401
   37    HZ1  LYS   4           3HZ      LYS   4  -6.476  11.184  -8.427
   38    HZ2  LYS   4           1HZ      LYS   4  -6.407   9.616  -7.794
   39    HZ3  LYS   4           2HZ      LYS   4  -5.154  10.192  -8.772
   40    H    PHE   5           H        PHE   5  -6.837   7.141  -2.183
   41    HA   PHE   5           HA       PHE   5  -5.671   4.634  -3.217
   42    HB2  PHE   5           2HB      PHE   5  -4.998   6.115  -0.658
   43    HB3  PHE   5           3HB      PHE   5  -4.342   4.545  -1.116
   44    HD1  PHE   5           HD2      PHE   5  -2.795   4.354  -3.031
   45    HD2  PHE   5           HD1      PHE   5  -4.158   8.140  -1.624
   46    HE1  PHE   5           HE2      PHE   5  -0.982   5.466  -4.265
   47    HE2  PHE   5           HE1      PHE   5  -2.346   9.253  -2.861
   48    HZ   PHE   5           HZ       PHE   5  -0.755   7.915  -4.182
   49    H    THR   6           H        THR   6  -7.004   2.980  -2.926
   50    HA   THR   6           HA       THR   6  -8.697   2.899  -0.497
   51    HB   THR   6           HB       THR   6 -10.170   3.251  -2.364
   52    HG1  THR   6           HG1      THR   6 -11.497   1.538  -1.990
   53   HG21  THR   6          3HG2      THR   6 -10.244   1.760  -4.304
   54   HG22  THR   6          1HG2      THR   6  -8.875   0.849  -3.667
   55   HG23  THR   6          2HG2      THR   6  -8.661   2.526  -4.168
   56    H    LYS   7           H        LYS   7  -9.347   0.711   0.182
   57    HA   LYS   7           HA       LYS   7  -7.103  -1.031   0.393
   58    HB2  LYS   7           2HB      LYS   7  -8.658  -2.515   1.615
   59    HB3  LYS   7           3HB      LYS   7  -8.724  -0.856   2.192
   60    HG2  LYS   7           2HG      LYS   7 -10.782  -0.491   0.900
   61    HG3  LYS   7           3HG      LYS   7 -10.718  -2.164   0.342
   62    HD2  LYS   7           2HD      LYS   7 -12.276  -1.930   2.211
   63    HD3  LYS   7           3HD      LYS   7 -10.907  -2.951   2.655
   64    HE2  LYS   7           2HE      LYS   7  -9.853  -0.916   3.694
   65    HE3  LYS   7           3HE      LYS   7 -11.374  -0.068   3.420
   66    HZ1  LYS   7           3HZ      LYS   7 -11.028  -2.517   5.062
   67    HZ2  LYS   7           1HZ      LYS   7 -12.485  -1.697   4.812
   68    HZ3  LYS   7           2HZ      LYS   7 -11.229  -0.946   5.660
   69    H    ASP   8           H        ASP   8  -9.637  -0.751  -1.888
   70    HA   ASP   8           HA       ASP   8  -9.737  -3.500  -2.719
   71    HB2  ASP   8           2HB      ASP   8 -11.639  -1.867  -2.878
   72    HB3  ASP   8           3HB      ASP   8 -10.768  -1.050  -4.170
   73    H    MET   9           H        MET   9  -7.929  -0.658  -3.733
   74    HA   MET   9           HA       MET   9  -7.192  -1.701  -6.312
   75    HB2  MET   9           2HB      MET   9  -5.778   0.261  -6.519
   76    HB3  MET   9           3HB      MET   9  -7.343   0.732  -5.871
   77    HG2  MET   9           2HG      MET   9  -6.286   0.645  -3.585
   78    HG3  MET   9           3HG      MET   9  -4.734   0.483  -4.400
   79    HE1  MET   9           3HE      MET   9  -3.707   2.389  -6.013
   80    HE2  MET   9           1HE      MET   9  -4.579   3.868  -6.416
   81    HE3  MET   9           2HE      MET   9  -5.185   2.308  -6.974
   82    H    THR  10           H        THR  10  -4.938  -2.101  -6.981
   83    HA   THR  10           HA       THR  10  -3.656  -3.905  -5.095
   84    HB   THR  10           HB       THR  10  -2.263  -4.615  -6.966
   85    HG1  THR  10           HG1      THR  10  -2.704  -3.581  -9.059
   86   HG21  THR  10          3HG2      THR  10  -3.995  -5.460  -8.474
   87   HG22  THR  10          1HG2      THR  10  -5.146  -4.286  -7.834
   88   HG23  THR  10          2HG2      THR  10  -4.530  -5.573  -6.797
   89    H    PHE  11           H        PHE  11  -1.338  -3.919  -4.714
   90    HA   PHE  11           HA       PHE  11  -0.235  -1.479  -3.905
   91    HB2  PHE  11           2HB      PHE  11   1.085  -4.128  -4.529
   92    HB3  PHE  11           3HB      PHE  11   1.957  -2.763  -3.843
   93    HD1  PHE  11           HD1      PHE  11   1.490  -2.008  -1.562
   94    HD2  PHE  11           HD2      PHE  11  -0.434  -5.437  -3.193
   95    HE1  PHE  11           HE1      PHE  11   0.832  -2.711   0.701
   96    HE2  PHE  11           HE2      PHE  11  -1.098  -6.142  -0.933
   97    HZ   PHE  11           HZ       PHE  11  -0.465  -4.779   1.019
   98    H    ALA  12           H        ALA  12   0.275  -3.304  -6.919
   99    HA   ALA  12           HA       ALA  12   2.335  -1.765  -8.022
  100    HB1  ALA  12           3HB      ALA  12   1.625  -3.924  -8.943
  101    HB2  ALA  12           1HB      ALA  12   1.660  -2.672 -10.185
  102    HB3  ALA  12           2HB      ALA  12   0.120  -3.193  -9.500
  103    H    GLN  13           H        GLN  13  -1.191  -1.297  -8.216
  104    HA   GLN  13           HA       GLN  13  -1.059   0.957  -9.951
  105    HB2  GLN  13           2HB      GLN  13  -3.234   0.056  -8.047
  106    HB3  GLN  13           3HB      GLN  13  -3.419   1.360  -9.214
  107    HG2  GLN  13           2HG      GLN  13  -2.951  -0.242 -11.035
  108    HG3  GLN  13           3HG      GLN  13  -2.857  -1.535  -9.842
  109   HE21  GLN  13          1HE2      GLN  13  -5.153   1.095  -9.665
  110   HE22  GLN  13          2HE2      GLN  13  -6.553   0.137  -9.979
  111    H    ALA  14           H        ALA  14  -1.251   0.656  -6.402
  112    HA   ALA  14           HA       ALA  14  -1.467   3.374  -5.768
  113    HB1  ALA  14           3HB      ALA  14  -1.778   1.562  -4.142
  114    HB2  ALA  14           1HB      ALA  14  -0.639   2.778  -3.561
  115    HB3  ALA  14           2HB      ALA  14  -0.045   1.237  -4.179
  116    H    LEU  15           H        LEU  15   1.477   1.389  -6.101
  117    HA   LEU  15           HA       LEU  15   3.386   3.347  -5.542
  118    HB2  LEU  15           2HB      LEU  15   3.575   1.007  -7.446
  119    HB3  LEU  15           3HB      LEU  15   4.947   1.945  -6.885
  120    HG   LEU  15           HG       LEU  15   3.135   0.266  -5.138
  121   HD11  LEU  15          1HD1      LEU  15   4.546  -1.124  -6.528
  122   HD12  LEU  15          2HD1      LEU  15   5.125  -1.162  -4.862
  123   HD13  LEU  15          3HD1      LEU  15   5.969  -0.190  -6.068
  124   HD21  LEU  15          3HD2      LEU  15   5.625   1.830  -4.441
  125   HD22  LEU  15          1HD2      LEU  15   4.760   0.736  -3.361
  126   HD23  LEU  15          2HD2      LEU  15   3.978   2.208  -3.933
  127    H    GLN  16           H        GLN  16   1.819   2.571  -8.637
  128    HA   GLN  16           HA       GLN  16   3.384   4.500 -10.108
  129    HB2  GLN  16           2HB      GLN  16   0.931   2.921 -10.910
  130    HB3  GLN  16           3HB      GLN  16   1.893   3.906 -12.005
  131    HG2  GLN  16           2HG      GLN  16   2.897   1.512 -10.473
  132    HG3  GLN  16           3HG      GLN  16   2.417   1.511 -12.167
  133   HE21  GLN  16          1HE2      GLN  16   4.817   2.564  -9.876
  134   HE22  GLN  16          2HE2      GLN  16   6.032   2.966 -11.034
  135    H    THR  17           H        THR  17   0.712   4.779  -8.077
  136    HA   THR  17           HA       THR  17  -0.441   7.098  -9.412
  137    HB   THR  17           HB       THR  17  -1.047   5.908  -6.685
  138    HG1  THR  17           HG1      THR  17  -1.640   4.636  -8.579
  139   HG21  THR  17          3HG2      THR  17  -1.617   8.288  -6.742
  140   HG22  THR  17          1HG2      THR  17  -3.079   7.300  -6.745
  141   HG23  THR  17          2HG2      THR  17  -2.517   8.051  -8.239
  142    H    HIS  18           H        HIS  18   1.515   6.433  -6.510
  143    HA   HIS  18           HA       HIS  18   2.729   9.074  -6.767
  144    HB2  HIS  18           2HB      HIS  18   1.221   8.179  -4.313
  145    HB3  HIS  18           3HB      HIS  18   2.550   9.321  -4.186
  146    HD1  HIS  18           HD1      HIS  18  -0.923   9.006  -5.581
  147    HD2  HIS  18           HD2      HIS  18   1.966  11.919  -4.974
  148    HE1  HIS  18           HE1      HIS  18  -2.081  11.186  -5.997
  149    HE2  HIS  18           HE2      HIS  18  -0.266  12.914  -5.823
  150    HA   PRO  19           HA       PRO  19   6.228   6.252  -6.176
  151    HB2  PRO  19           2HB      PRO  19   7.593   8.898  -5.866
  152    HB3  PRO  19           3HB      PRO  19   8.051   7.503  -6.854
  153    HG2  PRO  19           2HG      PRO  19   6.957   9.632  -7.999
  154    HG3  PRO  19           3HG      PRO  19   6.482   8.000  -8.510
  155    HD2  PRO  19           2HD      PRO  19   5.010   9.944  -6.764
  156    HD3  PRO  19           3HD      PRO  19   4.379   8.843  -8.008
  157    H    GLY  20           H        GLY  20   5.499   9.021  -4.066
  158    HA2  GLY  20           2HA      GLY  20   7.164   8.392  -1.895
  159    HA3  GLY  20           3HA      GLY  20   5.665   9.301  -1.789
  160    H    VAL  21           H        VAL  21   4.228   6.868  -2.926
  161    HA   VAL  21           HA       VAL  21   3.348   5.682  -0.547
  162    HB   VAL  21           HB       VAL  21   3.201   4.620  -3.384
  163   HG11  VAL  21          1HG1      VAL  21   2.904   2.789  -1.790
  164   HG12  VAL  21          2HG1      VAL  21   1.385   3.171  -2.599
  165   HG13  VAL  21          3HG1      VAL  21   1.663   3.714  -0.943
  166   HG21  VAL  21          3HG2      VAL  21   1.164   6.101  -1.710
  167   HG22  VAL  21          1HG2      VAL  21   0.920   5.504  -3.352
  168   HG23  VAL  21          2HG2      VAL  21   2.095   6.783  -3.044
  169    H    ALA  22           H        ALA  22   5.917   4.712  -2.776
  170    HA   ALA  22           HA       ALA  22   6.457   2.146  -1.807
  171    HB1  ALA  22           3HB      ALA  22   8.428   4.171  -2.885
  172    HB2  ALA  22           1HB      ALA  22   7.476   3.039  -3.845
  173    HB3  ALA  22           2HB      ALA  22   8.708   2.436  -2.736
  174    H    GLY  23           H        GLY  23   7.774   5.282  -0.716
  175    HA2  GLY  23           2HA      GLY  23   9.458   4.302   1.314
  176    HA3  GLY  23           3HA      GLY  23   8.760   5.914   1.264
  177    H    VAL  24           H        VAL  24   6.076   5.392   1.487
  178    HA   VAL  24           HA       VAL  24   5.681   4.996   4.238
  179    HB   VAL  24           HB       VAL  24   3.636   4.731   2.013
  180   HG11  VAL  24          1HG1      VAL  24   2.821   3.758   4.105
  181   HG12  VAL  24          2HG1      VAL  24   1.964   5.256   3.732
  182   HG13  VAL  24          3HG1      VAL  24   3.225   5.244   4.968
  183   HG21  VAL  24          3HG2      VAL  24   4.425   7.135   3.669
  184   HG22  VAL  24          1HG2      VAL  24   3.105   7.082   2.499
  185   HG23  VAL  24          2HG2      VAL  24   4.772   6.889   1.958
  186    H    LEU  25           H        LEU  25   4.969   2.780   1.519
  187    HA   LEU  25           HA       LEU  25   4.029   0.631   3.035
  188    HB2  LEU  25           2HB      LEU  25   5.478   0.590   0.381
  189    HB3  LEU  25           3HB      LEU  25   4.625  -0.779   1.069
  190    HG   LEU  25           HG       LEU  25   3.389   1.839   0.194
  191   HD11  LEU  25          1HD1      LEU  25   3.158  -0.945  -0.949
  192   HD12  LEU  25          2HD1      LEU  25   4.040   0.405  -1.662
  193   HD13  LEU  25          3HD1      LEU  25   2.284   0.480  -1.512
  194   HD21  LEU  25          3HD2      LEU  25   2.059  -0.605   1.374
  195   HD22  LEU  25          1HD2      LEU  25   1.231   0.811   0.723
  196   HD23  LEU  25          2HD2      LEU  25   2.236   0.962   2.163
  197    H    ARG  26           H        ARG  26   7.375   1.216   1.870
  198    HA   ARG  26           HA       ARG  26   8.497  -1.094   3.028
  199    HB2  ARG  26           2HB      ARG  26   9.825   1.562   2.434
  200    HB3  ARG  26           3HB      ARG  26  10.682   0.077   2.833
  201    HG2  ARG  26           2HG      ARG  26   9.613  -0.975   0.818
  202    HG3  ARG  26           3HG      ARG  26   8.999   0.622   0.391
  203    HD2  ARG  26           2HD      ARG  26  11.015   0.242  -0.848
  204    HD3  ARG  26           3HD      ARG  26  11.356   1.454   0.388
  205    HE   ARG  26           HE       ARG  26  12.007  -1.048   1.436
  206   HH11  ARG  26          1HH1      ARG  26  13.104   1.036  -1.087
  207   HH12  ARG  26          2HH1      ARG  26  14.729   0.464  -0.989
  208   HH21  ARG  26          1HH2      ARG  26  14.081  -1.766   1.535
  209   HH22  ARG  26          2HH2      ARG  26  15.281  -1.099   0.479
  210    H    SER  27           H        SER  27   7.994   2.146   4.373
  211    HA   SER  27           HA       SER  27   9.255   1.708   6.873
  212    HB2  SER  27           2HB      SER  27   8.666   3.968   6.125
  213    HB3  SER  27           3HB      SER  27   6.952   3.559   6.174
  214    HG   SER  27           HG       SER  27   8.739   3.656   8.392
  215    H    TYR  28           H        TYR  28   6.081   0.892   5.647
  216    HA   TYR  28           HA       TYR  28   5.152  -0.041   8.260
  217    HB2  TYR  28           2HB      TYR  28   3.829   0.309   5.572
  218    HB3  TYR  28           3HB      TYR  28   3.058  -0.636   6.840
  219    HD1  TYR  28           HD1      TYR  28   4.889   2.637   6.754
  220    HD2  TYR  28           HD2      TYR  28   1.354   0.539   7.870
  221    HE1  TYR  28           HE1      TYR  28   3.982   4.695   7.734
  222    HE2  TYR  28           HE2      TYR  28   0.437   2.597   8.852
  223    HH   TYR  28           HH       TYR  28   1.231   4.715   9.759
  224    H    ASN  29           H        ASN  29   7.330  -1.400   6.555
  225    HA   ASN  29           HA       ASN  29   8.102  -3.537   6.355
  226    HB2  ASN  29           2HB      ASN  29   7.100  -3.880   8.587
  227    HB3  ASN  29           3HB      ASN  29   5.569  -4.304   7.836
  228   HD21  ASN  29          1HD2      ASN  29   8.839  -5.324   8.432
  229   HD22  ASN  29          2HD2      ASN  29   8.592  -6.988   8.043
  230    H    LEU  30           H        LEU  30   5.621  -2.348   4.676
  231    HA   LEU  30           HA       LEU  30   4.812  -4.777   3.276
  232    HB2  LEU  30           2HB      LEU  30   4.037  -1.885   2.860
  233    HB3  LEU  30           3HB      LEU  30   3.359  -3.238   1.973
  234    HG   LEU  30           HG       LEU  30   3.092  -2.795   4.956
  235   HD11  LEU  30          1HD1      LEU  30   0.737  -2.329   4.455
  236   HD12  LEU  30          2HD1      LEU  30   1.080  -2.449   2.730
  237   HD13  LEU  30          3HD1      LEU  30   1.812  -1.161   3.688
  238   HD21  LEU  30          3HD2      LEU  30   1.479  -4.642   4.859
  239   HD22  LEU  30          1HD2      LEU  30   3.098  -5.161   4.389
  240   HD23  LEU  30          2HD2      LEU  30   1.867  -4.888   3.155
  241    H    GLY  31           H        GLY  31   7.599  -3.325   3.139
  242    HA2  GLY  31           2HA      GLY  31   7.918  -2.520   0.419
  243    HA3  GLY  31           3HA      GLY  31   9.210  -2.932   1.534
  244    H    CYS  32           H        CYS  32   8.028  -5.606   2.026
  245    HA   CYS  32           HA       CYS  32   9.479  -7.080   0.105
  246    HB2  CYS  32           2HB      CYS  32   7.351  -8.064   2.020
  247    HB3  CYS  32           3HB      CYS  32   8.538  -9.069   1.194
  248    HG   CYS  32           HG       CYS  32   9.160  -8.712   3.958
  249    H    ILE  33           H        ILE  33   6.486  -5.633  -0.322
  250    HA   ILE  33           HA       ILE  33   4.888  -7.517  -1.596
  251    HB   ILE  33           HB       ILE  33   3.880  -5.612  -2.861
  252   HG12  ILE  33          2HG1      ILE  33   5.998  -3.977  -1.422
  253   HG13  ILE  33          3HG1      ILE  33   5.948  -4.279  -3.155
  254   HG21  ILE  33          1HG2      ILE  33   4.284  -5.174   0.101
  255   HG22  ILE  33          2HG2      ILE  33   3.076  -6.220  -0.646
  256   HG23  ILE  33          3HG2      ILE  33   2.992  -4.474  -0.877
  257   HD11  ILE  33          3HD1      ILE  33   5.133  -2.064  -2.630
  258   HD12  ILE  33          1HD1      ILE  33   3.902  -2.745  -1.565
  259   HD13  ILE  33          2HD1      ILE  33   3.838  -3.055  -3.301
  260    H    GLY  34           H        GLY  34   7.679  -5.800  -2.881
  261    HA2  GLY  34           2HA      GLY  34   7.240  -6.483  -5.620
  262    HA3  GLY  34           3HA      GLY  34   8.759  -5.952  -4.918
  263    H    CYS  35           H        CYS  35   8.999  -8.054  -2.987
  264    HA   CYS  35           HA       CYS  35  10.180 -10.065  -4.672
  265    HB2  CYS  35           2HB      CYS  35  11.275  -9.330  -2.605
  266    HB3  CYS  35           3HB      CYS  35   9.921  -9.933  -1.657
  267    HG   CYS  35           HG       CYS  35  10.648 -12.559  -3.160
  268    H    MET  36           H        MET  36   7.613 -10.160  -2.173
  269    HA   MET  36           HA       MET  36   6.925 -12.880  -2.647
  270    HB2  MET  36           2HB      MET  36   5.005 -12.461  -1.195
  271    HB3  MET  36           3HB      MET  36   6.463 -11.762  -0.512
  272    HG2  MET  36           2HG      MET  36   5.764  -9.553  -1.386
  273    HG3  MET  36           3HG      MET  36   4.261 -10.285  -1.939
  274    HE1  MET  36           3HE      MET  36   3.651 -12.347   0.418
  275    HE2  MET  36           1HE      MET  36   2.410 -11.304  -0.276
  276    HE3  MET  36           2HE      MET  36   2.623 -11.376   1.473
  277    H    GLY  37           H        GLY  37   6.445 -10.303  -4.665
  278    HA2  GLY  37           2HA      GLY  37   5.261 -10.127  -6.635
  279    HA3  GLY  37           3HA      GLY  37   4.652 -11.749  -6.353
  280    H    ALA  38           H        ALA  38   4.182  -9.176  -4.022
  281    HA   ALA  38           HA       ALA  38   1.314  -9.519  -4.187
  282    HB1  ALA  38           3HB      ALA  38   2.435  -9.306  -2.017
  283    HB2  ALA  38           1HB      ALA  38   1.215  -8.054  -2.249
  284    HB3  ALA  38           2HB      ALA  38   2.927  -7.665  -2.435
  285    H    GLN  39           H        GLN  39   3.202  -7.898  -6.190
  286    HA   GLN  39           HA       GLN  39   2.278  -5.259  -6.310
  287    HB2  GLN  39           2HB      GLN  39   3.062  -7.071  -8.611
  288    HB3  GLN  39           3HB      GLN  39   2.944  -5.319  -8.692
  289    HG2  GLN  39           2HG      GLN  39   4.876  -6.882  -6.988
  290    HG3  GLN  39           3HG      GLN  39   5.260  -6.061  -8.499
  291   HE21  GLN  39          1HE2      GLN  39   4.541  -5.665  -5.130
  292   HE22  GLN  39          2HE2      GLN  39   4.990  -4.002  -5.025
  293    H    ASN  40           H        ASN  40   0.917  -8.217  -7.689
  294    HA   ASN  40           HA       ASN  40  -1.324  -6.805  -8.904
  295    HB2  ASN  40           2HB      ASN  40  -0.768  -9.784  -8.741
  296    HB3  ASN  40           3HB      ASN  40  -1.953  -8.997  -9.783
  297   HD21  ASN  40          1HD2      ASN  40   0.382 -10.685 -10.410
  298   HD22  ASN  40          2HD2      ASN  40   1.346  -9.750 -11.497
  299    H    GLU  41           H        GLU  41  -0.811  -7.253  -5.852
  300    HA   GLU  41           HA       GLU  41  -3.383  -8.527  -5.172
  301    HB2  GLU  41           2HB      GLU  41  -1.366  -9.613  -4.260
  302    HB3  GLU  41           3HB      GLU  41  -0.912  -8.110  -3.470
  303    HG2  GLU  41           2HG      GLU  41  -2.810  -8.226  -2.017
  304    HG3  GLU  41           3HG      GLU  41  -3.451  -9.617  -2.890
  305    H    SER  42           H        SER  42  -4.807  -7.510  -3.713
  306    HA   SER  42           HA       SER  42  -4.859  -4.661  -3.828
  307    HB2  SER  42           2HB      SER  42  -6.576  -6.561  -2.204
  308    HB3  SER  42           3HB      SER  42  -6.900  -4.843  -2.425
  309    HG   SER  42           HG       SER  42  -7.870  -5.378  -4.197
  310    H    LEU  43           H        LEU  43  -4.808  -3.142  -2.124
  311    HA   LEU  43           HA       LEU  43  -2.614  -3.305  -0.446
  312    HB2  LEU  43           2HB      LEU  43  -5.052  -1.546  -0.137
  313    HB3  LEU  43           3HB      LEU  43  -3.535  -1.307   0.707
  314    HG   LEU  43           HG       LEU  43  -3.958  -1.109  -2.283
  315   HD11  LEU  43          1HD1      LEU  43  -3.449   1.257  -1.973
  316   HD12  LEU  43          2HD1      LEU  43  -3.297   1.009  -0.233
  317   HD13  LEU  43          3HD1      LEU  43  -4.859   0.790  -1.020
  318   HD21  LEU  43          3HD2      LEU  43  -1.755  -2.035  -1.781
  319   HD22  LEU  43          1HD2      LEU  43  -1.442  -0.711  -0.656
  320   HD23  LEU  43          2HD2      LEU  43  -1.617  -0.382  -2.380
  321    H    GLU  44           H        GLU  44  -6.026  -3.892   0.422
  322    HA   GLU  44           HA       GLU  44  -5.565  -4.200   3.198
  323    HB2  GLU  44           2HB      GLU  44  -7.792  -3.751   2.237
  324    HB3  GLU  44           3HB      GLU  44  -7.817  -5.367   1.541
  325    HG2  GLU  44           2HG      GLU  44  -7.832  -6.366   3.735
  326    HG3  GLU  44           3HG      GLU  44  -7.618  -4.791   4.494
  327    H    GLN  45           H        GLN  45  -5.437  -6.506   0.536
  328    HA   GLN  45           HA       GLN  45  -5.400  -8.876   2.083
  329    HB2  GLN  45           2HB      GLN  45  -4.216  -8.349  -0.655
  330    HB3  GLN  45           3HB      GLN  45  -4.464  -9.941   0.049
  331    HG2  GLN  45           2HG      GLN  45  -6.878  -9.554   0.087
  332    HG3  GLN  45           3HG      GLN  45  -6.632  -7.950  -0.601
  333   HE21  GLN  45          1HE2      GLN  45  -7.869  -8.417  -2.416
  334   HE22  GLN  45          2HE2      GLN  45  -7.316  -9.472  -3.668
  335    H    GLY  46           H        GLY  46  -2.709  -7.001   0.652
  336    HA2  GLY  46           2HA      GLY  46  -0.623  -8.497   1.848
  337    HA3  GLY  46           3HA      GLY  46  -0.490  -6.853   1.241
  338    H    ALA  47           H        ALA  47  -2.470  -5.715   2.996
  339    HA   ALA  47           HA       ALA  47  -0.932  -4.992   5.209
  340    HB1  ALA  47           3HB      ALA  47  -2.793  -3.648   4.362
  341    HB2  ALA  47           1HB      ALA  47  -2.966  -3.960   6.089
  342    HB3  ALA  47           2HB      ALA  47  -3.936  -4.865   4.926
  343    H    ASN  48           H        ASN  48  -3.852  -7.088   5.249
  344    HA   ASN  48           HA       ASN  48  -3.552  -7.928   7.915
  345    HB2  ASN  48           2HB      ASN  48  -4.944  -9.273   5.593
  346    HB3  ASN  48           3HB      ASN  48  -5.034  -9.862   7.252
  347   HD21  ASN  48          1HD2      ASN  48  -6.108  -7.476   5.017
  348   HD22  ASN  48          2HD2      ASN  48  -7.252  -6.717   6.063
  349    H    ALA  49           H        ALA  49  -2.189  -9.249   4.934
  350    HA   ALA  49           HA       ALA  49  -1.106 -11.631   5.933
  351    HB1  ALA  49           3HB      ALA  49   0.472 -11.510   4.067
  352    HB2  ALA  49           1HB      ALA  49   0.044  -9.818   3.811
  353    HB3  ALA  49           2HB      ALA  49  -1.159 -11.080   3.553
  354    H    HIS  50           H        HIS  50   0.054  -8.319   6.184
  355    HA   HIS  50           HA       HIS  50   2.452  -9.211   7.644
  356    HB2  HIS  50           2HB      HIS  50   1.690  -6.517   6.491
  357    HB3  HIS  50           3HB      HIS  50   3.135  -6.791   7.455
  358    HD1  HIS  50           HD1      HIS  50   5.034  -6.692   5.849
  359    HD2  HIS  50           HD2      HIS  50   1.856  -8.904   4.344
  360    HE1  HIS  50           HE1      HIS  50   5.820  -7.580   3.644
  361    HE2  HIS  50           HE2      HIS  50   3.990  -9.127   2.899
  362    H    GLY  51           H        GLY  51  -0.572  -8.820   8.506
  363    HA2  GLY  51           2HA      GLY  51  -1.584  -8.547  10.551
  364    HA3  GLY  51           3HA      GLY  51   0.016  -8.395  11.251
  365    H    LEU  52           H        LEU  52  -1.403  -6.270   8.808
  366    HA   LEU  52           HA       LEU  52  -1.421  -4.081  10.799
  367    HB2  LEU  52           2HB      LEU  52  -0.794  -3.913   7.843
  368    HB3  LEU  52           3HB      LEU  52  -0.881  -2.548   8.941
  369    HG   LEU  52           HG       LEU  52   1.145  -4.792   9.104
  370   HD11  LEU  52          1HD1      LEU  52   2.753  -3.074   8.417
  371   HD12  LEU  52          2HD1      LEU  52   1.432  -1.924   8.209
  372   HD13  LEU  52          3HD1      LEU  52   1.528  -3.353   7.181
  373   HD21  LEU  52          3HD2      LEU  52   2.226  -3.400  10.805
  374   HD22  LEU  52          1HD2      LEU  52   0.603  -3.879  11.306
  375   HD23  LEU  52          2HD2      LEU  52   0.896  -2.245  10.709
  376    H    ASN  53           H        ASN  53  -2.970  -2.333  10.363
  377    HA   ASN  53           HA       ASN  53  -5.427  -3.328   9.094
  378    HB2  ASN  53           2HB      ASN  53  -5.478  -2.419  11.453
  379    HB3  ASN  53           3HB      ASN  53  -5.097  -0.835  10.786
  380   HD21  ASN  53          1HD2      ASN  53  -7.428  -1.581  12.261
  381   HD22  ASN  53          2HD2      ASN  53  -8.786  -1.310  11.229
  382    H    VAL  54           H        VAL  54  -6.029  -2.612   7.152
  383    HA   VAL  54           HA       VAL  54  -4.364  -0.989   5.586
  384    HB   VAL  54           HB       VAL  54  -5.905  -2.711   4.682
  385   HG11  VAL  54          1HG1      VAL  54  -7.868  -2.238   6.028
  386   HG12  VAL  54          2HG1      VAL  54  -8.264  -2.152   4.313
  387   HG13  VAL  54          3HG1      VAL  54  -8.057  -0.668   5.244
  388   HG21  VAL  54          3HG2      VAL  54  -4.907  -1.041   3.199
  389   HG22  VAL  54          1HG2      VAL  54  -6.270   0.043   3.486
  390   HG23  VAL  54          2HG2      VAL  54  -6.522  -1.491   2.653
  391    H    GLU  55           H        GLU  55  -7.036  -0.145   7.667
  392    HA   GLU  55           HA       GLU  55  -7.852   2.289   6.592
  393    HB2  GLU  55           2HB      GLU  55  -7.640   1.541   9.518
  394    HB3  GLU  55           3HB      GLU  55  -8.583   2.879   8.879
  395    HG2  GLU  55           2HG      GLU  55  -9.043  -0.058   8.390
  396    HG3  GLU  55           3HG      GLU  55 -10.022   1.021   9.380
  397    H    ASP  56           H        ASP  56  -5.316   1.741   9.049
  398    HA   ASP  56           HA       ASP  56  -4.504   4.430   9.280
  399    HB2  ASP  56           2HB      ASP  56  -3.962   2.699  10.952
  400    HB3  ASP  56           3HB      ASP  56  -2.897   1.909   9.792
  401    H    ILE  57           H        ILE  57  -3.512   1.851   7.104
  402    HA   ILE  57           HA       ILE  57  -1.264   3.133   5.955
  403    HB   ILE  57           HB       ILE  57  -3.104   1.094   4.666
  404   HG12  ILE  57          2HG1      ILE  57  -0.563   0.677   6.276
  405   HG13  ILE  57          3HG1      ILE  57  -2.194   0.339   6.847
  406   HG21  ILE  57          1HG2      ILE  57  -1.150   0.545   3.270
  407   HG22  ILE  57          2HG2      ILE  57  -0.249   1.859   4.028
  408   HG23  ILE  57          3HG2      ILE  57  -1.668   2.216   3.046
  409   HD11  ILE  57          3HD1      ILE  57  -0.809  -1.027   4.549
  410   HD12  ILE  57          1HD1      ILE  57  -2.443  -1.365   5.120
  411   HD13  ILE  57          2HD1      ILE  57  -1.060  -1.689   6.165
  412    H    LEU  58           H        LEU  58  -4.634   2.872   4.792
  413    HA   LEU  58           HA       LEU  58  -4.409   4.500   2.531
  414    HB2  LEU  58           2HB      LEU  58  -6.815   4.147   4.333
  415    HB3  LEU  58           3HB      LEU  58  -6.852   4.797   2.703
  416    HG   LEU  58           HG       LEU  58  -6.136   1.963   3.485
  417   HD11  LEU  58          1HD1      LEU  58  -8.180   1.373   2.264
  418   HD12  LEU  58          2HD1      LEU  58  -8.521   3.084   2.010
  419   HD13  LEU  58          3HD1      LEU  58  -8.517   2.418   3.643
  420   HD21  LEU  58          3HD2      LEU  58  -6.018   1.518   1.074
  421   HD22  LEU  58          1HD2      LEU  58  -4.791   2.677   1.581
  422   HD23  LEU  58          2HD2      LEU  58  -6.240   3.237   0.745
  423    H    ARG  59           H        ARG  59  -5.019   5.340   5.900
  424    HA   ARG  59           HA       ARG  59  -5.657   8.023   5.730
  425    HB2  ARG  59           2HB      ARG  59  -5.680   6.947   7.864
  426    HB3  ARG  59           3HB      ARG  59  -3.981   6.510   7.738
  427    HG2  ARG  59           2HG      ARG  59  -3.507   9.026   7.757
  428    HG3  ARG  59           3HG      ARG  59  -5.178   9.215   8.286
  429    HD2  ARG  59           2HD      ARG  59  -3.551   9.163  10.163
  430    HD3  ARG  59           3HD      ARG  59  -4.757   7.880  10.254
  431    HE   ARG  59           HE       ARG  59  -3.072   6.359  10.101
  432   HH11  ARG  59          1HH1      ARG  59  -1.852   9.375   8.934
  433   HH12  ARG  59          2HH1      ARG  59  -0.259   8.751   8.688
  434   HH21  ARG  59          1HH2      ARG  59  -1.033   5.593   9.808
  435   HH22  ARG  59          2HH2      ARG  59   0.203   6.632   9.187
  436    H    ASP  60           H        ASP  60  -2.351   6.665   6.016
  437    HA   ASP  60           HA       ASP  60  -1.126   9.237   5.754
  438    HB2  ASP  60           2HB      ASP  60  -0.298   6.987   6.906
  439    HB3  ASP  60           3HB      ASP  60   0.449   6.729   5.332
  440    H    LEU  61           H        LEU  61  -1.707   6.538   3.534
  441    HA   LEU  61           HA       LEU  61  -0.165   7.468   1.363
  442    HB2  LEU  61           2HB      LEU  61  -2.678   5.788   1.358
  443    HB3  LEU  61           3HB      LEU  61  -1.665   6.054  -0.047
  444    HG   LEU  61           HG       LEU  61  -0.888   4.584   2.477
  445   HD11  LEU  61          1HD1      LEU  61  -2.333   3.298   1.008
  446   HD12  LEU  61          2HD1      LEU  61  -0.691   2.654   0.970
  447   HD13  LEU  61          3HD1      LEU  61  -1.281   3.646  -0.365
  448   HD21  LEU  61          3HD2      LEU  61   1.033   5.819   1.694
  449   HD22  LEU  61          1HD2      LEU  61   0.764   5.260   0.041
  450   HD23  LEU  61          2HD2      LEU  61   1.238   4.114   1.295
  451    H    ASN  62           H        ASN  62  -3.629   7.949   2.068
  452    HA   ASN  62           HA       ASN  62  -4.196   9.596  -0.147
  453    HB2  ASN  62           2HB      ASN  62  -5.507   9.332   2.560
  454    HB3  ASN  62           3HB      ASN  62  -6.127  10.417   1.319
  455   HD21  ASN  62          1HD2      ASN  62  -7.139   7.870   2.586
  456   HD22  ASN  62          2HD2      ASN  62  -7.568   6.874   1.242
  457    H    ALA  63           H        ALA  63  -2.767  10.323   2.966
  458    HA   ALA  63           HA       ALA  63  -2.886  13.139   2.853
  459    HB1  ALA  63           3HB      ALA  63  -2.298  11.904   4.887
  460    HB2  ALA  63           1HB      ALA  63  -1.071  13.106   4.485
  461    HB3  ALA  63           2HB      ALA  63  -0.780  11.400   4.143
  462    H    LEU  64           H        LEU  64  -0.742  10.813   1.318
  463    HA   LEU  64           HA       LEU  64   1.209  12.644   0.344
  464    HB2  LEU  64           2HB      LEU  64   0.306  10.010  -0.845
  465    HB3  LEU  64           3HB      LEU  64   1.765  10.874  -1.285
  466    HG   LEU  64           HG       LEU  64   1.219   9.702   1.448
  467   HD11  LEU  64          1HD1      LEU  64   2.894   8.019   0.829
  468   HD12  LEU  64          2HD1      LEU  64   2.973   8.697  -0.798
  469   HD13  LEU  64          3HD1      LEU  64   1.480   7.952  -0.224
  470   HD21  LEU  64          3HD2      LEU  64   3.715  10.943   0.278
  471   HD22  LEU  64          1HD2      LEU  64   3.595  10.163   1.857
  472   HD23  LEU  64          2HD2      LEU  64   2.694  11.643   1.535
  473    H    ALA  65           H        ALA  65  -2.010  11.816  -0.697
  474    HA   ALA  65           HA       ALA  65  -1.765  12.969  -3.331
  475    HB1  ALA  65           3HB      ALA  65  -4.251  12.202  -1.794
  476    HB2  ALA  65           1HB      ALA  65  -3.345  11.142  -2.874
  477    HB3  ALA  65           2HB      ALA  65  -4.161  12.568  -3.518
  478    H    LEU  66           H        LEU  66  -3.083  13.996  -0.207
  479    HA   LEU  66           HA       LEU  66  -4.115  16.490  -1.123
  480    HB2  LEU  66           2HB      LEU  66  -3.335  15.618   1.663
  481    HB3  LEU  66           3HB      LEU  66  -4.269  17.052   1.278
  482    HG   LEU  66           HG       LEU  66  -5.141  14.198   0.776
  483   HD11  LEU  66          1HD1      LEU  66  -6.103  16.210   2.809
  484   HD12  LEU  66          2HD1      LEU  66  -5.136  14.774   3.147
  485   HD13  LEU  66          3HD1      LEU  66  -6.781  14.604   2.536
  486   HD21  LEU  66          3HD2      LEU  66  -6.036  15.706  -0.917
  487   HD22  LEU  66          1HD2      LEU  66  -6.616  16.800   0.339
  488   HD23  LEU  66          2HD2      LEU  66  -7.311  15.187   0.183
  489    H    GLU  67           H        GLU  67  -1.123  15.634   0.629
  490    HA   GLU  67           HA       GLU  67   0.950  16.567   0.655
  491    HB2  GLU  67           2HB      GLU  67  -0.042  18.263  -1.647
  492    HB3  GLU  67           3HB      GLU  67   1.636  18.079  -1.155
  493    HG2  GLU  67           2HG      GLU  67   1.569  15.720  -1.733
  494    HG3  GLU  67           3HG      GLU  67  -0.134  15.861  -2.171
  495    H    HIS  68           H        HIS  68  -1.711  18.223   1.621
  496    HA   HIS  68           HA       HIS  68  -0.577  20.862   1.920
  497    HB2  HIS  68           2HB      HIS  68  -3.100  19.644   3.069
  498    HB3  HIS  68           3HB      HIS  68  -2.642  21.334   3.249
  499    HD1  HIS  68           HD1      HIS  68  -2.505  22.735   0.955
  500    HD2  HIS  68           HD2      HIS  68  -4.424  19.057   0.721
  501    HE1  HIS  68           HE1      HIS  68  -3.835  22.806  -1.164
  502    HE2  HIS  68           HE2      HIS  68  -4.833  20.510  -1.379
  503    H    HIS  69           H        HIS  69  -0.803  17.990   3.890
  504    HA   HIS  69           HA       HIS  69  -0.105  19.240   6.367
  505    HB2  HIS  69           2HB      HIS  69   0.100  17.004   7.250
  506    HB3  HIS  69           3HB      HIS  69  -1.301  17.053   6.186
  507    HD1  HIS  69           HD1      HIS  69   1.259  14.850   7.002
  508    HD2  HIS  69           HD2      HIS  69  -0.255  16.165   3.369
  509    HE1  HIS  69           HE1      HIS  69   1.958  13.127   5.324
  510    HE2  HIS  69           HE2      HIS  69   1.238  14.068   3.110
  511    H    HIS  70           H        HIS  70   1.844  20.020   6.934
  512    HA   HIS  70           HA       HIS  70   4.251  19.054   5.527
  513    HB2  HIS  70           2HB      HIS  70   3.835  21.510   7.257
  514    HB3  HIS  70           3HB      HIS  70   5.358  21.067   6.491
  515    HD1  HIS  70           HD1      HIS  70   2.226  22.864   5.896
  516    HD2  HIS  70           HD2      HIS  70   5.240  21.164   3.587
  517    HE1  HIS  70           HE1      HIS  70   1.965  23.855   3.603
  518    HE2  HIS  70           HE2      HIS  70   3.871  22.914   2.266
  519    H    HIS  71           H        HIS  71   5.697  17.771   6.527
  520    HA   HIS  71           HA       HIS  71   5.136  16.812   9.176
  521    HB2  HIS  71           2HB      HIS  71   6.989  15.279   8.831
  522    HB3  HIS  71           3HB      HIS  71   5.979  15.327   7.392
  523    HD1  HIS  71           HD1      HIS  71   7.124  15.879   5.219
  524    HD2  HIS  71           HD2      HIS  71   9.509  16.699   8.522
  525    HE1  HIS  71           HE1      HIS  71   9.389  16.434   4.296
  526    HE2  HIS  71           HE2      HIS  71  10.764  17.077   6.299
  527    H    HIS  72           H        HIS  72   6.902  19.450   8.048
  528    HA   HIS  72           HA       HIS  72   8.166  19.768  10.682
  529    HB2  HIS  72           2HB      HIS  72   9.933  18.950   9.216
  530    HB3  HIS  72           3HB      HIS  72   9.554  20.181   8.020
  531    HD1  HIS  72           HD1      HIS  72  10.663  22.419   8.273
  532    HD2  HIS  72           HD2      HIS  72  11.190  19.977  11.596
  533    HE1  HIS  72           HE1      HIS  72  12.317  23.615   9.732
  534    HE2  HIS  72           HE2      HIS  72  12.754  22.038  11.638
  535    H    HIS  73           H        HIS  73   7.837  21.721  11.549
  536    HA   HIS  73           HA       HIS  73   6.409  23.742  10.030
  537    HB2  HIS  73           2HB      HIS  73   5.641  23.201  12.285
  538    HB3  HIS  73           3HB      HIS  73   7.210  23.649  12.950
  539    HD1  HIS  73           HD1      HIS  73   7.716  26.159  13.197
  540    HD2  HIS  73           HD2      HIS  73   3.972  25.362  11.587
  541    HE1  HIS  73           HE1      HIS  73   6.481  28.339  13.261
  542    HE2  HIS  73           HE2      HIS  73   4.297  27.869  12.113
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1 -13.288  13.083  -3.842
    2    H2   MET   1           2H       MET   1 -14.571  14.155  -3.601
    3    H3   MET   1           3H       MET   1 -14.839  12.689  -4.391
    4    HA   MET   1           HA       MET   1 -14.089  13.055  -1.548
    5    HB2  MET   1           2HB      MET   1 -16.628  11.977  -2.803
    6    HB3  MET   1           3HB      MET   1 -16.307  12.098  -1.077
    7    HG2  MET   1           2HG      MET   1 -17.762  13.892  -1.873
    8    HG3  MET   1           3HG      MET   1 -16.244  14.514  -1.229
    9    HE1  MET   1           3HE      MET   1 -18.331  16.146  -3.144
   10    HE2  MET   1           1HE      MET   1 -17.157  17.022  -4.125
   11    HE3  MET   1           2HE      MET   1 -16.890  16.832  -2.393
   12    H    THR   2           H        THR   2 -14.747  10.748  -4.176
   13    HA   THR   2           HA       THR   2 -14.281   8.375  -2.730
   14    HB   THR   2           HB       THR   2 -13.739   8.825  -5.680
   15    HG1  THR   2           HG1      THR   2 -16.166   7.910  -4.490
   16   HG21  THR   2          3HG2      THR   2 -14.246   6.431  -5.888
   17   HG22  THR   2          1HG2      THR   2 -14.463   6.320  -4.141
   18   HG23  THR   2          2HG2      THR   2 -12.876   6.695  -4.811
   19    H    GLN   3           H        GLN   3 -12.446   7.757  -1.754
   20    HA   GLN   3           HA       GLN   3  -9.942   9.023  -2.159
   21    HB2  GLN   3           2HB      GLN   3 -10.635   6.441  -0.737
   22    HB3  GLN   3           3HB      GLN   3  -9.056   7.215  -0.668
   23    HG2  GLN   3           2HG      GLN   3 -10.050   9.175   0.396
   24    HG3  GLN   3           3HG      GLN   3 -11.644   8.432   0.292
   25   HE21  GLN   3          1HE2      GLN   3  -8.762   6.610   1.081
   26   HE22  GLN   3          2HE2      GLN   3  -9.190   6.289   2.722
   27    H    LYS   4           H        LYS   4  -8.558   8.741  -3.801
   28    HA   LYS   4           HA       LYS   4  -8.653   6.656  -5.692
   29    HB2  LYS   4           2HB      LYS   4  -6.323   8.453  -4.961
   30    HB3  LYS   4           3HB      LYS   4  -6.399   7.433  -6.391
   31    HG2  LYS   4           2HG      LYS   4  -8.378   8.710  -7.157
   32    HG3  LYS   4           3HG      LYS   4  -8.198   9.770  -5.758
   33    HD2  LYS   4           2HD      LYS   4  -7.195  10.811  -7.708
   34    HD3  LYS   4           3HD      LYS   4  -5.933  10.386  -6.551
   35    HE2  LYS   4           2HE      LYS   4  -5.243   9.839  -8.822
   36    HE3  LYS   4           3HE      LYS   4  -5.415   8.374  -7.859
   37    HZ1  LYS   4           3HZ      LYS   4  -6.366   8.212 -10.119
   38    HZ2  LYS   4           1HZ      LYS   4  -7.498   9.401  -9.710
   39    HZ3  LYS   4           2HZ      LYS   4  -7.500   7.918  -8.902
   40    H    PHE   5           H        PHE   5  -6.376   7.176  -2.994
   41    HA   PHE   5           HA       PHE   5  -5.272   4.526  -3.209
   42    HB2  PHE   5           2HB      PHE   5  -4.993   6.600  -1.014
   43    HB3  PHE   5           3HB      PHE   5  -4.070   5.102  -1.118
   44    HD1  PHE   5           HD1      PHE   5  -2.584   4.748  -3.159
   45    HD2  PHE   5           HD2      PHE   5  -4.254   8.531  -2.121
   46    HE1  PHE   5           HE1      PHE   5  -0.890   5.875  -4.542
   47    HE2  PHE   5           HE2      PHE   5  -2.560   9.659  -3.503
   48    HZ   PHE   5           HZ       PHE   5  -0.877   8.332  -4.715
   49    H    THR   6           H        THR   6  -6.952   3.086  -2.984
   50    HA   THR   6           HA       THR   6  -8.246   3.000  -0.323
   51    HB   THR   6           HB       THR   6  -9.960   3.568  -1.919
   52    HG1  THR   6           HG1      THR   6 -11.333   2.047  -1.245
   53   HG21  THR   6          3HG2      THR   6  -9.099   1.118  -3.475
   54   HG22  THR   6          1HG2      THR   6  -8.848   2.793  -3.969
   55   HG23  THR   6          2HG2      THR   6 -10.483   2.144  -3.847
   56    H    LYS   7           H        LYS   7  -8.828   0.907   0.467
   57    HA   LYS   7           HA       LYS   7  -6.780  -0.969   0.429
   58    HB2  LYS   7           2HB      LYS   7  -8.431  -2.483   1.530
   59    HB3  LYS   7           3HB      LYS   7  -8.350  -0.876   2.243
   60    HG2  LYS   7           2HG      LYS   7 -10.391  -0.224   1.139
   61    HG3  LYS   7           3HG      LYS   7 -10.442  -1.746   0.249
   62    HD2  LYS   7           2HD      LYS   7 -11.992  -1.760   2.148
   63    HD3  LYS   7           3HD      LYS   7 -10.731  -2.979   2.331
   64    HE2  LYS   7           2HE      LYS   7  -9.497  -1.382   3.806
   65    HE3  LYS   7           3HE      LYS   7 -10.880  -0.292   3.708
   66    HZ1  LYS   7           3HZ      LYS   7 -12.257  -1.996   4.706
   67    HZ2  LYS   7           1HZ      LYS   7 -10.936  -1.649   5.708
   68    HZ3  LYS   7           2HZ      LYS   7 -10.944  -3.062   4.775
   69    H    ASP   8           H        ASP   8  -9.428  -0.615  -1.773
   70    HA   ASP   8           HA       ASP   8  -9.466  -3.354  -2.660
   71    HB2  ASP   8           2HB      ASP   8 -11.492  -1.939  -2.565
   72    HB3  ASP   8           3HB      ASP   8 -10.818  -0.908  -3.825
   73    H    MET   9           H        MET   9  -7.564  -0.619  -3.493
   74    HA   MET   9           HA       MET   9  -7.038  -1.542  -6.216
   75    HB2  MET   9           2HB      MET   9  -5.728   0.425  -6.513
   76    HB3  MET   9           3HB      MET   9  -7.160   0.913  -5.621
   77    HG2  MET   9           2HG      MET   9  -5.796   0.775  -3.526
   78    HG3  MET   9           3HG      MET   9  -4.381   0.508  -4.536
   79    HE1  MET   9           3HE      MET   9  -5.121   2.442  -7.042
   80    HE2  MET   9           1HE      MET   9  -3.513   2.284  -6.336
   81    HE3  MET   9           2HE      MET   9  -4.225   3.880  -6.558
   82    H    THR  10           H        THR  10  -4.797  -1.981  -6.943
   83    HA   THR  10           HA       THR  10  -3.478  -3.755  -5.053
   84    HB   THR  10           HB       THR  10  -2.131  -4.529  -6.903
   85    HG1  THR  10           HG1      THR  10  -2.590  -3.482  -9.034
   86   HG21  THR  10          3HG2      THR  10  -4.396  -5.434  -6.789
   87   HG22  THR  10          1HG2      THR  10  -3.884  -5.273  -8.471
   88   HG23  THR  10          2HG2      THR  10  -4.997  -4.097  -7.771
   89    H    PHE  11           H        PHE  11  -1.184  -3.731  -4.648
   90    HA   PHE  11           HA       PHE  11  -0.048  -1.303  -3.903
   91    HB2  PHE  11           2HB      PHE  11   1.305  -3.915  -4.619
   92    HB3  PHE  11           3HB      PHE  11   2.138  -2.555  -3.871
   93    HD1  PHE  11           HD1      PHE  11   1.720  -1.952  -1.561
   94    HD2  PHE  11           HD2      PHE  11  -0.275  -5.264  -3.352
   95    HE1  PHE  11           HE1      PHE  11   1.053  -2.755   0.664
   96    HE2  PHE  11           HE2      PHE  11  -0.941  -6.070  -1.125
   97    HZ   PHE  11           HZ       PHE  11  -0.277  -4.813   0.888
   98    H    ALA  12           H        ALA  12   0.424  -3.119  -6.916
   99    HA   ALA  12           HA       ALA  12   2.413  -1.576  -8.097
  100    HB1  ALA  12           3HB      ALA  12   1.627  -3.733  -8.980
  101    HB2  ALA  12           1HB      ALA  12   1.669  -2.485 -10.227
  102    HB3  ALA  12           2HB      ALA  12   0.130  -2.965  -9.507
  103    H    GLN  13           H        GLN  13  -1.131  -1.177  -8.382
  104    HA   GLN  13           HA       GLN  13  -1.161   1.049 -10.070
  105    HB2  GLN  13           2HB      GLN  13  -3.087   0.362  -7.837
  106    HB3  GLN  13           3HB      GLN  13  -3.395   1.536  -9.109
  107    HG2  GLN  13           2HG      GLN  13  -3.277  -0.233 -10.786
  108    HG3  GLN  13           3HG      GLN  13  -2.938  -1.413  -9.522
  109   HE21  GLN  13          1HE2      GLN  13  -5.209   1.237  -9.193
  110   HE22  GLN  13          2HE2      GLN  13  -6.627   0.251  -9.135
  111    H    ALA  14           H        ALA  14  -1.142   0.973  -6.505
  112    HA   ALA  14           HA       ALA  14  -1.137   3.734  -6.050
  113    HB1  ALA  14           3HB      ALA  14  -1.521   2.047  -4.301
  114    HB2  ALA  14           1HB      ALA  14  -0.284   3.213  -3.834
  115    HB3  ALA  14           2HB      ALA  14   0.184   1.598  -4.370
  116    H    LEU  15           H        LEU  15   1.596   1.501  -6.490
  117    HA   LEU  15           HA       LEU  15   3.675   3.370  -6.155
  118    HB2  LEU  15           2HB      LEU  15   3.610   0.826  -7.781
  119    HB3  LEU  15           3HB      LEU  15   5.068   1.727  -7.411
  120    HG   LEU  15           HG       LEU  15   3.267   0.405  -5.368
  121   HD11  LEU  15          1HD1      LEU  15   5.998  -0.396  -6.384
  122   HD12  LEU  15          2HD1      LEU  15   4.477  -1.232  -6.706
  123   HD13  LEU  15          3HD1      LEU  15   5.117  -1.170  -5.064
  124   HD21  LEU  15          3HD2      LEU  15   5.912   1.831  -5.035
  125   HD22  LEU  15          1HD2      LEU  15   5.056   0.947  -3.773
  126   HD23  LEU  15          2HD2      LEU  15   4.340   2.397  -4.471
  127    H    GLN  16           H        GLN  16   1.660   2.665  -8.939
  128    HA   GLN  16           HA       GLN  16   3.291   4.237 -10.752
  129    HB2  GLN  16           2HB      GLN  16   0.463   3.225 -11.154
  130    HB3  GLN  16           3HB      GLN  16   1.531   3.856 -12.400
  131    HG2  GLN  16           2HG      GLN  16   1.733   1.255 -10.910
  132    HG3  GLN  16           3HG      GLN  16   1.541   1.515 -12.639
  133   HE21  GLN  16          1HE2      GLN  16   3.764   1.413  -9.997
  134   HE22  GLN  16          2HE2      GLN  16   5.210   1.514 -10.931
  135    H    THR  17           H        THR  17   0.484   4.735  -8.717
  136    HA   THR  17           HA       THR  17  -0.417   7.167  -9.876
  137    HB   THR  17           HB       THR  17  -0.812   6.174  -7.037
  138    HG1  THR  17           HG1      THR  17  -1.653   4.809  -8.776
  139   HG21  THR  17          3HG2      THR  17  -2.763   7.673  -7.005
  140   HG22  THR  17          1HG2      THR  17  -2.322   8.281  -8.603
  141   HG23  THR  17          2HG2      THR  17  -1.262   8.576  -7.223
  142    H    HIS  18           H        HIS  18   1.401   6.655  -6.816
  143    HA   HIS  18           HA       HIS  18   2.849   9.160  -7.342
  144    HB2  HIS  18           2HB      HIS  18   1.375   8.486  -4.791
  145    HB3  HIS  18           3HB      HIS  18   2.661   9.686  -4.847
  146    HD1  HIS  18           HD1      HIS  18   1.535  10.672  -7.798
  147    HD2  HIS  18           HD2      HIS  18  -0.452  10.541  -4.155
  148    HE1  HIS  18           HE1      HIS  18  -0.324  12.342  -7.990
  149    HE2  HIS  18           HE2      HIS  18  -1.621  12.105  -5.848
  150    HA   PRO  19           HA       PRO  19   6.341   6.547  -6.416
  151    HB2  PRO  19           2HB      PRO  19   7.731   9.109  -5.833
  152    HB3  PRO  19           3HB      PRO  19   8.136   7.850  -7.003
  153    HG2  PRO  19           2HG      PRO  19   7.118  10.187  -7.800
  154    HG3  PRO  19           3HG      PRO  19   6.659   8.669  -8.597
  155    HD2  PRO  19           2HD      PRO  19   5.140  10.284  -6.573
  156    HD3  PRO  19           3HD      PRO  19   4.548   9.462  -8.033
  157    H    GLY  20           H        GLY  20   5.427   9.185  -4.234
  158    HA2  GLY  20           2HA      GLY  20   6.987   8.557  -2.008
  159    HA3  GLY  20           3HA      GLY  20   5.429   9.364  -1.945
  160    H    VAL  21           H        VAL  21   4.148   6.935  -3.216
  161    HA   VAL  21           HA       VAL  21   3.214   5.654  -0.922
  162    HB   VAL  21           HB       VAL  21   3.287   4.580  -3.755
  163   HG11  VAL  21          1HG1      VAL  21   1.602   3.700  -1.402
  164   HG12  VAL  21          2HG1      VAL  21   2.907   2.779  -2.146
  165   HG13  VAL  21          3HG1      VAL  21   1.440   3.118  -3.058
  166   HG21  VAL  21          3HG2      VAL  21   1.123   6.076  -2.263
  167   HG22  VAL  21          1HG2      VAL  21   0.987   5.421  -3.896
  168   HG23  VAL  21          2HG2      VAL  21   2.127   6.726  -3.561
  169    H    ALA  22           H        ALA  22   5.911   4.788  -3.051
  170    HA   ALA  22           HA       ALA  22   6.513   2.248  -2.065
  171    HB1  ALA  22           3HB      ALA  22   7.570   3.213  -4.056
  172    HB2  ALA  22           1HB      ALA  22   8.775   2.613  -2.914
  173    HB3  ALA  22           2HB      ALA  22   8.460   4.346  -3.038
  174    H    GLY  23           H        GLY  23   7.531   5.429  -0.863
  175    HA2  GLY  23           2HA      GLY  23   9.198   4.491   1.229
  176    HA3  GLY  23           3HA      GLY  23   8.474   6.087   1.127
  177    H    VAL  24           H        VAL  24   5.775   5.473   1.199
  178    HA   VAL  24           HA       VAL  24   5.244   5.122   3.929
  179    HB   VAL  24           HB       VAL  24   3.361   4.761   1.580
  180   HG11  VAL  24          1HG1      VAL  24   2.447   3.703   3.578
  181   HG12  VAL  24          2HG1      VAL  24   1.561   5.184   3.213
  182   HG13  VAL  24          3HG1      VAL  24   2.752   5.166   4.515
  183   HG21  VAL  24          3HG2      VAL  24   4.389   6.976   1.656
  184   HG22  VAL  24          1HG2      VAL  24   3.901   7.158   3.342
  185   HG23  VAL  24          2HG2      VAL  24   2.678   7.066   2.074
  186    H    LEU  25           H        LEU  25   4.810   2.820   1.233
  187    HA   LEU  25           HA       LEU  25   3.867   0.637   2.679
  188    HB2  LEU  25           2HB      LEU  25   5.656   0.639   0.236
  189    HB3  LEU  25           3HB      LEU  25   4.794  -0.764   0.841
  190    HG   LEU  25           HG       LEU  25   3.527   1.762  -0.235
  191   HD11  LEU  25          1HD1      LEU  25   3.651  -1.020  -1.395
  192   HD12  LEU  25          2HD1      LEU  25   4.540   0.389  -1.976
  193   HD13  LEU  25          3HD1      LEU  25   2.780   0.354  -2.079
  194   HD21  LEU  25          3HD2      LEU  25   2.237  -0.781   0.761
  195   HD22  LEU  25          1HD2      LEU  25   1.401   0.557  -0.029
  196   HD23  LEU  25          2HD2      LEU  25   2.166   0.799   1.541
  197    H    ARG  26           H        ARG  26   7.271   1.363   1.820
  198    HA   ARG  26           HA       ARG  26   8.478  -0.712   3.257
  199    HB2  ARG  26           2HB      ARG  26   9.498   2.076   2.663
  200    HB3  ARG  26           3HB      ARG  26  10.500   0.775   3.296
  201    HG2  ARG  26           2HG      ARG  26  10.179  -0.525   1.296
  202    HG3  ARG  26           3HG      ARG  26   9.008   0.642   0.678
  203    HD2  ARG  26           2HD      ARG  26  11.201   0.909  -0.386
  204    HD3  ARG  26           3HD      ARG  26  10.739   2.342   0.530
  205    HE   ARG  26           HE       ARG  26  12.351   0.549   2.065
  206   HH11  ARG  26          1HH1      ARG  26  12.474   3.037  -0.323
  207   HH12  ARG  26          2HH1      ARG  26  14.093   3.490   0.070
  208   HH21  ARG  26          1HH2      ARG  26  14.426   1.156   2.568
  209   HH22  ARG  26          2HH2      ARG  26  15.185   2.441   1.691
  210    H    SER  27           H        SER  27   7.473   2.504   4.342
  211    HA   SER  27           HA       SER  27   8.543   2.449   6.942
  212    HB2  SER  27           2HB      SER  27   7.719   4.519   5.974
  213    HB3  SER  27           3HB      SER  27   6.082   3.872   5.892
  214    HG   SER  27           HG       SER  27   5.928   4.846   7.762
  215    H    TYR  28           H        TYR  28   5.482   1.188   5.694
  216    HA   TYR  28           HA       TYR  28   4.609   0.342   8.344
  217    HB2  TYR  28           2HB      TYR  28   3.378   0.225   5.599
  218    HB3  TYR  28           3HB      TYR  28   2.696  -0.703   6.928
  219    HD1  TYR  28           HD1      TYR  28   3.550   2.766   5.868
  220    HD2  TYR  28           HD2      TYR  28   1.256   0.308   8.485
  221    HE1  TYR  28           HE1      TYR  28   2.283   4.737   6.605
  222    HE2  TYR  28           HE2      TYR  28  -0.014   2.277   9.226
  223    HH   TYR  28           HH       TYR  28  -0.057   4.543   9.230
  224    H    ASN  29           H        ASN  29   6.903  -0.863   6.445
  225    HA   ASN  29           HA       ASN  29   7.923  -2.880   6.188
  226    HB2  ASN  29           2HB      ASN  29   7.252  -3.186   8.612
  227    HB3  ASN  29           3HB      ASN  29   5.836  -4.060   8.037
  228   HD21  ASN  29          1HD2      ASN  29   8.051  -4.975   9.684
  229   HD22  ASN  29          2HD2      ASN  29   8.731  -6.330   8.857
  230    H    LEU  30           H        LEU  30   6.391  -2.149   4.182
  231    HA   LEU  30           HA       LEU  30   5.216  -4.686   3.225
  232    HB2  LEU  30           2HB      LEU  30   4.347  -1.858   2.609
  233    HB3  LEU  30           3HB      LEU  30   3.790  -3.259   1.715
  234    HG   LEU  30           HG       LEU  30   3.335  -2.845   4.678
  235   HD11  LEU  30          1HD1      LEU  30   1.014  -2.343   4.075
  236   HD12  LEU  30          2HD1      LEU  30   1.440  -2.423   2.366
  237   HD13  LEU  30          3HD1      LEU  30   2.129  -1.161   3.387
  238   HD21  LEU  30          3HD2      LEU  30   3.353  -5.190   4.043
  239   HD22  LEU  30          1HD2      LEU  30   2.217  -4.868   2.730
  240   HD23  LEU  30          2HD2      LEU  30   1.708  -4.672   4.409
  241    H    GLY  31           H        GLY  31   7.951  -3.214   3.048
  242    HA2  GLY  31           2HA      GLY  31   8.357  -2.539   0.312
  243    HA3  GLY  31           3HA      GLY  31   9.615  -2.899   1.481
  244    H    CYS  32           H        CYS  32   8.179  -5.569   1.934
  245    HA   CYS  32           HA       CYS  32   9.723  -7.067  -0.000
  246    HB2  CYS  32           2HB      CYS  32   9.610  -7.741   2.379
  247    HB3  CYS  32           3HB      CYS  32   7.886  -8.046   2.204
  248    HG   CYS  32           HG       CYS  32   8.165 -10.507   1.573
  249    H    ILE  33           H        ILE  33   6.898  -5.599  -0.456
  250    HA   ILE  33           HA       ILE  33   5.035  -7.479  -1.300
  251    HB   ILE  33           HB       ILE  33   4.252  -5.689  -2.944
  252   HG12  ILE  33          2HG1      ILE  33   6.458  -4.123  -1.568
  253   HG13  ILE  33          3HG1      ILE  33   6.412  -4.566  -3.270
  254   HG21  ILE  33          1HG2      ILE  33   4.526  -5.003  -0.017
  255   HG22  ILE  33          2HG2      ILE  33   3.253  -5.971  -0.758
  256   HG23  ILE  33          3HG2      ILE  33   3.387  -4.255  -1.137
  257   HD11  ILE  33          3HD1      ILE  33   5.809  -2.244  -2.954
  258   HD12  ILE  33          1HD1      ILE  33   4.499  -2.711  -1.869
  259   HD13  ILE  33          2HD1      ILE  33   4.434  -3.159  -3.574
  260    H    GLY  34           H        GLY  34   7.904  -6.348  -3.016
  261    HA2  GLY  34           2HA      GLY  34   7.254  -7.546  -5.528
  262    HA3  GLY  34           3HA      GLY  34   8.858  -7.059  -4.995
  263    H    CYS  35           H        CYS  35   9.032  -8.682  -2.680
  264    HA   CYS  35           HA       CYS  35   9.932 -11.123  -3.832
  265    HB2  CYS  35           2HB      CYS  35   9.551 -10.419  -0.912
  266    HB3  CYS  35           3HB      CYS  35  10.476 -11.787  -1.525
  267    HG   CYS  35           HG       CYS  35  12.507 -10.334  -2.610
  268    H    MET  36           H        MET  36   7.087 -10.292  -1.874
  269    HA   MET  36           HA       MET  36   6.125 -13.039  -1.933
  270    HB2  MET  36           2HB      MET  36   4.212 -12.192  -0.639
  271    HB3  MET  36           3HB      MET  36   5.745 -11.737   0.088
  272    HG2  MET  36           2HG      MET  36   5.522  -9.491  -0.843
  273    HG3  MET  36           3HG      MET  36   3.992  -9.947  -1.587
  274    HE1  MET  36           3HE      MET  36   1.704 -10.556   1.529
  275    HE2  MET  36           1HE      MET  36   2.663 -11.768   0.680
  276    HE3  MET  36           2HE      MET  36   1.795 -10.532  -0.229
  277    H    GLY  37           H        GLY  37   6.194 -10.775  -4.256
  278    HA2  GLY  37           2HA      GLY  37   5.082 -10.514  -6.250
  279    HA3  GLY  37           3HA      GLY  37   4.316 -12.054  -5.913
  280    H    ALA  38           H        ALA  38   3.940  -9.235  -3.841
  281    HA   ALA  38           HA       ALA  38   1.068  -9.434  -4.057
  282    HB1  ALA  38           3HB      ALA  38   2.155  -9.053  -1.896
  283    HB2  ALA  38           1HB      ALA  38   1.017  -7.763  -2.288
  284    HB3  ALA  38           2HB      ALA  38   2.751  -7.494  -2.470
  285    H    GLN  39           H        GLN  39   2.995  -8.142  -6.250
  286    HA   GLN  39           HA       GLN  39   2.104  -5.455  -6.534
  287    HB2  GLN  39           2HB      GLN  39   3.098  -7.338  -8.693
  288    HB3  GLN  39           3HB      GLN  39   2.986  -5.588  -8.821
  289    HG2  GLN  39           2HG      GLN  39   4.805  -7.157  -7.000
  290    HG3  GLN  39           3HG      GLN  39   5.270  -6.234  -8.427
  291   HE21  GLN  39          1HE2      GLN  39   4.303  -6.061  -5.099
  292   HE22  GLN  39          2HE2      GLN  39   4.683  -4.394  -4.869
  293    H    ASN  40           H        ASN  40   0.784  -8.532  -7.516
  294    HA   ASN  40           HA       ASN  40  -1.427  -7.246  -8.967
  295    HB2  ASN  40           2HB      ASN  40  -0.715 -10.176  -8.648
  296    HB3  ASN  40           3HB      ASN  40  -2.015  -9.546  -9.656
  297   HD21  ASN  40          1HD2      ASN  40   0.379 -11.105 -10.340
  298   HD22  ASN  40          2HD2      ASN  40   1.194 -10.181 -11.550
  299    H    GLU  41           H        GLU  41  -1.012  -7.281  -5.950
  300    HA   GLU  41           HA       GLU  41  -3.594  -8.510  -5.204
  301    HB2  GLU  41           2HB      GLU  41  -1.605  -9.748  -4.341
  302    HB3  GLU  41           3HB      GLU  41  -1.118  -8.302  -3.470
  303    HG2  GLU  41           2HG      GLU  41  -3.052  -8.409  -2.069
  304    HG3  GLU  41           3HG      GLU  41  -3.746  -9.708  -3.038
  305    H    SER  42           H        SER  42  -4.794  -7.421  -3.519
  306    HA   SER  42           HA       SER  42  -4.650  -4.565  -3.843
  307    HB2  SER  42           2HB      SER  42  -6.737  -4.464  -2.635
  308    HB3  SER  42           3HB      SER  42  -6.820  -5.819  -3.758
  309    HG   SER  42           HG       SER  42  -7.475  -6.051  -1.377
  310    H    LEU  43           H        LEU  43  -4.615  -3.010  -2.139
  311    HA   LEU  43           HA       LEU  43  -2.459  -3.186  -0.412
  312    HB2  LEU  43           2HB      LEU  43  -4.910  -1.431  -0.175
  313    HB3  LEU  43           3HB      LEU  43  -3.423  -1.189   0.725
  314    HG   LEU  43           HG       LEU  43  -3.654  -1.064  -2.290
  315   HD11  LEU  43          1HD1      LEU  43  -3.340   1.354  -2.009
  316   HD12  LEU  43          2HD1      LEU  43  -3.422   1.158  -0.258
  317   HD13  LEU  43          3HD1      LEU  43  -4.831   0.792  -1.253
  318   HD21  LEU  43          3HD2      LEU  43  -1.384  -0.130  -2.187
  319   HD22  LEU  43          1HD2      LEU  43  -1.444  -1.776  -1.558
  320   HD23  LEU  43          2HD2      LEU  43  -1.351  -0.411  -0.446
  321    H    GLU  44           H        GLU  44  -5.883  -3.817   0.314
  322    HA   GLU  44           HA       GLU  44  -5.563  -4.124   3.105
  323    HB2  GLU  44           2HB      GLU  44  -7.748  -3.729   2.092
  324    HB3  GLU  44           3HB      GLU  44  -7.677  -5.287   1.280
  325    HG2  GLU  44           2HG      GLU  44  -7.730  -6.434   3.422
  326    HG3  GLU  44           3HG      GLU  44  -7.713  -4.891   4.271
  327    H    GLN  45           H        GLN  45  -5.641  -6.568   0.498
  328    HA   GLN  45           HA       GLN  45  -5.428  -8.830   2.146
  329    HB2  GLN  45           2HB      GLN  45  -4.463  -8.441  -0.693
  330    HB3  GLN  45           3HB      GLN  45  -4.600  -9.998   0.115
  331    HG2  GLN  45           2HG      GLN  45  -7.007  -9.692   0.329
  332    HG3  GLN  45           3HG      GLN  45  -6.883  -8.106  -0.432
  333   HE21  GLN  45          1HE2      GLN  45  -8.228  -8.668  -2.122
  334   HE22  GLN  45          2HE2      GLN  45  -7.761  -9.762  -3.372
  335    H    GLY  46           H        GLY  46  -2.861  -6.954   0.528
  336    HA2  GLY  46           2HA      GLY  46  -0.673  -8.444   1.488
  337    HA3  GLY  46           3HA      GLY  46  -0.614  -6.766   0.976
  338    H    ALA  47           H        ALA  47  -2.205  -5.522   2.847
  339    HA   ALA  47           HA       ALA  47  -0.559  -5.208   5.092
  340    HB1  ALA  47           3HB      ALA  47  -2.419  -3.936   6.065
  341    HB2  ALA  47           1HB      ALA  47  -3.501  -4.567   4.823
  342    HB3  ALA  47           2HB      ALA  47  -2.160  -3.512   4.373
  343    H    ASN  48           H        ASN  48  -3.682  -6.911   4.854
  344    HA   ASN  48           HA       ASN  48  -3.811  -7.941   7.432
  345    HB2  ASN  48           2HB      ASN  48  -4.885  -9.030   4.826
  346    HB3  ASN  48           3HB      ASN  48  -5.259  -9.750   6.391
  347   HD21  ASN  48          1HD2      ASN  48  -6.973  -8.387   4.392
  348   HD22  ASN  48          2HD2      ASN  48  -7.773  -7.140   5.276
  349    H    ALA  49           H        ALA  49  -2.025  -9.176   4.645
  350    HA   ALA  49           HA       ALA  49  -1.269 -11.663   5.804
  351    HB1  ALA  49           3HB      ALA  49  -1.132 -11.252   3.397
  352    HB2  ALA  49           1HB      ALA  49   0.429 -11.755   4.044
  353    HB3  ALA  49           2HB      ALA  49   0.137 -10.057   3.666
  354    H    HIS  50           H        HIS  50   0.149  -8.432   5.885
  355    HA   HIS  50           HA       HIS  50   2.437  -9.350   7.459
  356    HB2  HIS  50           2HB      HIS  50   1.671  -6.620   6.393
  357    HB3  HIS  50           3HB      HIS  50   3.100  -6.919   7.376
  358    HD1  HIS  50           HD1      HIS  50   4.973  -6.620   5.757
  359    HD2  HIS  50           HD2      HIS  50   1.948  -9.019   4.207
  360    HE1  HIS  50           HE1      HIS  50   5.838  -7.460   3.556
  361    HE2  HIS  50           HE2      HIS  50   4.059  -9.024   2.712
  362    H    GLY  51           H        GLY  51  -0.652  -8.851   8.225
  363    HA2  GLY  51           2HA      GLY  51  -1.752  -8.540  10.216
  364    HA3  GLY  51           3HA      GLY  51  -0.185  -8.596  11.004
  365    H    LEU  52           H        LEU  52  -1.190  -6.232   8.588
  366    HA   LEU  52           HA       LEU  52  -0.690  -4.090  10.545
  367    HB2  LEU  52           2HB      LEU  52  -0.843  -3.953   7.531
  368    HB3  LEU  52           3HB      LEU  52  -0.385  -2.639   8.601
  369    HG   LEU  52           HG       LEU  52   1.171  -5.207   8.226
  370   HD11  LEU  52          1HD1      LEU  52   2.794  -3.806   7.053
  371   HD12  LEU  52          2HD1      LEU  52   1.725  -2.415   7.224
  372   HD13  LEU  52          3HD1      LEU  52   1.229  -3.792   6.240
  373   HD21  LEU  52          3HD2      LEU  52   2.927  -4.051   9.513
  374   HD22  LEU  52          1HD2      LEU  52   1.464  -4.302  10.465
  375   HD23  LEU  52          2HD2      LEU  52   1.820  -2.709   9.800
  376    H    ASN  53           H        ASN  53  -2.038  -2.167  10.504
  377    HA   ASN  53           HA       ASN  53  -4.857  -2.721  10.077
  378    HB2  ASN  53           2HB      ASN  53  -4.100  -1.435  12.068
  379    HB3  ASN  53           3HB      ASN  53  -3.500  -0.163  11.006
  380   HD21  ASN  53          1HD2      ASN  53  -5.408   0.276  13.006
  381   HD22  ASN  53          2HD2      ASN  53  -6.896   0.717  12.258
  382    H    VAL  54           H        VAL  54  -5.464  -2.706   7.970
  383    HA   VAL  54           HA       VAL  54  -4.307  -1.232   5.897
  384    HB   VAL  54           HB       VAL  54  -5.718  -3.163   5.451
  385   HG11  VAL  54          1HG1      VAL  54  -7.380  -2.847   7.220
  386   HG12  VAL  54          2HG1      VAL  54  -8.153  -3.071   5.650
  387   HG13  VAL  54          3HG1      VAL  54  -8.044  -1.458   6.357
  388   HG21  VAL  54          3HG2      VAL  54  -5.426  -1.520   3.663
  389   HG22  VAL  54          1HG2      VAL  54  -6.853  -0.643   4.219
  390   HG23  VAL  54          2HG2      VAL  54  -7.017  -2.275   3.567
  391    H    GLU  55           H        GLU  55  -6.886  -0.331   8.131
  392    HA   GLU  55           HA       GLU  55  -7.892   1.925   6.786
  393    HB2  GLU  55           2HB      GLU  55  -7.675   1.539   9.783
  394    HB3  GLU  55           3HB      GLU  55  -8.793   2.602   8.949
  395    HG2  GLU  55           2HG      GLU  55  -8.784  -0.413   8.878
  396    HG3  GLU  55           3HG      GLU  55  -9.925   0.617   9.737
  397    H    ASP  56           H        ASP  56  -5.285   1.624   9.187
  398    HA   ASP  56           HA       ASP  56  -4.690   4.401   9.315
  399    HB2  ASP  56           2HB      ASP  56  -4.103   2.634  11.052
  400    HB3  ASP  56           3HB      ASP  56  -2.784   2.151   9.991
  401    H    ILE  57           H        ILE  57  -3.487   1.755   7.310
  402    HA   ILE  57           HA       ILE  57  -1.308   3.101   6.117
  403    HB   ILE  57           HB       ILE  57  -3.051   0.927   4.926
  404   HG12  ILE  57          2HG1      ILE  57  -0.437   0.763   6.453
  405   HG13  ILE  57          3HG1      ILE  57  -2.013   0.248   7.043
  406   HG21  ILE  57          1HG2      ILE  57  -1.146   0.464   3.447
  407   HG22  ILE  57          2HG2      ILE  57  -0.288   1.853   4.115
  408   HG23  ILE  57          3HG2      ILE  57  -1.777   2.090   3.200
  409   HD11  ILE  57          3HD1      ILE  57  -2.094  -1.472   5.305
  410   HD12  ILE  57          1HD1      ILE  57  -0.680  -1.647   6.346
  411   HD13  ILE  57          2HD1      ILE  57  -0.505  -0.958   4.731
  412    H    LEU  58           H        LEU  58  -4.654   2.651   4.926
  413    HA   LEU  58           HA       LEU  58  -4.476   4.188   2.606
  414    HB2  LEU  58           2HB      LEU  58  -6.874   3.904   4.429
  415    HB3  LEU  58           3HB      LEU  58  -6.917   4.424   2.754
  416    HG   LEU  58           HG       LEU  58  -6.140   1.680   3.759
  417   HD11  LEU  58          1HD1      LEU  58  -8.159   0.939   2.583
  418   HD12  LEU  58          2HD1      LEU  58  -8.541   2.617   2.191
  419   HD13  LEU  58          3HD1      LEU  58  -8.529   2.084   3.873
  420   HD21  LEU  58          3HD2      LEU  58  -6.260   2.724   0.925
  421   HD22  LEU  58          1HD2      LEU  58  -5.989   1.045   1.397
  422   HD23  LEU  58          2HD2      LEU  58  -4.800   2.279   1.814
  423    H    ARG  59           H        ARG  59  -5.124   5.167   5.921
  424    HA   ARG  59           HA       ARG  59  -5.712   7.849   5.680
  425    HB2  ARG  59           2HB      ARG  59  -5.717   6.757   7.821
  426    HB3  ARG  59           3HB      ARG  59  -4.010   6.373   7.693
  427    HG2  ARG  59           2HG      ARG  59  -3.810   9.030   7.589
  428    HG3  ARG  59           3HG      ARG  59  -5.333   8.913   8.473
  429    HD2  ARG  59           2HD      ARG  59  -3.434   9.026  10.010
  430    HD3  ARG  59           3HD      ARG  59  -4.254   7.470  10.141
  431    HE   ARG  59           HE       ARG  59  -2.424   6.604   8.652
  432   HH11  ARG  59          1HH1      ARG  59  -1.926   9.260  10.788
  433   HH12  ARG  59          2HH1      ARG  59  -0.210   9.061  10.809
  434   HH21  ARG  59          1HH2      ARG  59  -0.214   6.372   8.676
  435   HH22  ARG  59          2HH2      ARG  59   0.749   7.472   9.606
  436    H    ASP  60           H        ASP  60  -2.421   6.437   5.962
  437    HA   ASP  60           HA       ASP  60  -1.136   8.970   5.628
  438    HB2  ASP  60           2HB      ASP  60  -0.221   6.958   6.896
  439    HB3  ASP  60           3HB      ASP  60   0.175   6.258   5.328
  440    H    LEU  61           H        LEU  61  -1.948   6.324   3.456
  441    HA   LEU  61           HA       LEU  61  -0.429   7.086   1.217
  442    HB2  LEU  61           2HB      LEU  61  -3.093   5.669   1.372
  443    HB3  LEU  61           3HB      LEU  61  -2.164   5.844  -0.107
  444    HG   LEU  61           HG       LEU  61  -1.264   4.353   2.368
  445   HD11  LEU  61          1HD1      LEU  61  -1.492   2.355   0.963
  446   HD12  LEU  61          2HD1      LEU  61  -2.160   3.348  -0.333
  447   HD13  LEU  61          3HD1      LEU  61  -3.035   3.178   1.189
  448   HD21  LEU  61          3HD2      LEU  61   0.624   5.364   1.208
  449   HD22  LEU  61          1HD2      LEU  61   0.069   4.685  -0.324
  450   HD23  LEU  61          2HD2      LEU  61   0.618   3.617   0.967
  451    H    ASN  62           H        ASN  62  -3.813   7.931   2.030
  452    HA   ASN  62           HA       ASN  62  -4.072   9.736  -0.177
  453    HB2  ASN  62           2HB      ASN  62  -5.744   9.330   2.310
  454    HB3  ASN  62           3HB      ASN  62  -6.145  10.516   1.070
  455   HD21  ASN  62          1HD2      ASN  62  -5.967   7.138   1.837
  456   HD22  ASN  62          2HD2      ASN  62  -6.802   6.573   0.437
  457    H    ALA  63           H        ALA  63  -2.933  10.057   3.112
  458    HA   ALA  63           HA       ALA  63  -2.917  12.859   3.331
  459    HB1  ALA  63           3HB      ALA  63  -0.935  10.890   4.486
  460    HB2  ALA  63           1HB      ALA  63  -2.462  11.379   5.223
  461    HB3  ALA  63           2HB      ALA  63  -1.167  12.558   5.015
  462    H    LEU  64           H        LEU  64  -0.910  10.709   1.469
  463    HA   LEU  64           HA       LEU  64   1.260  12.436   0.910
  464    HB2  LEU  64           2HB      LEU  64   0.039  10.249  -0.783
  465    HB3  LEU  64           3HB      LEU  64   1.563  11.039  -1.134
  466    HG   LEU  64           HG       LEU  64   1.002   9.395   1.342
  467   HD11  LEU  64          1HD1      LEU  64   2.466   7.725   0.318
  468   HD12  LEU  64          2HD1      LEU  64   2.586   8.713  -1.137
  469   HD13  LEU  64          3HD1      LEU  64   1.034   8.015  -0.671
  470   HD21  LEU  64          3HD2      LEU  64   3.580  10.580   0.303
  471   HD22  LEU  64          1HD2      LEU  64   3.407   9.552   1.726
  472   HD23  LEU  64          2HD2      LEU  64   2.674  11.155   1.703
  473    H    ALA  65           H        ALA  65  -1.986  12.271  -0.381
  474    HA   ALA  65           HA       ALA  65  -1.432  14.078  -2.584
  475    HB1  ALA  65           3HB      ALA  65  -3.817  13.908  -3.058
  476    HB2  ALA  65           1HB      ALA  65  -4.073  13.053  -1.535
  477    HB3  ALA  65           2HB      ALA  65  -3.115  12.309  -2.815
  478    H    LEU  66           H        LEU  66  -2.900  14.241   0.621
  479    HA   LEU  66           HA       LEU  66  -3.838  16.923   0.417
  480    HB2  LEU  66           2HB      LEU  66  -3.181  15.277   2.866
  481    HB3  LEU  66           3HB      LEU  66  -4.063  16.793   2.878
  482    HG   LEU  66           HG       LEU  66  -4.991  14.226   1.567
  483   HD11  LEU  66          1HD1      LEU  66  -6.689  14.187   3.325
  484   HD12  LEU  66          2HD1      LEU  66  -5.974  15.623   4.059
  485   HD13  LEU  66          3HD1      LEU  66  -5.063  14.113   4.005
  486   HD21  LEU  66          3HD2      LEU  66  -6.367  16.907   1.829
  487   HD22  LEU  66          1HD2      LEU  66  -7.117  15.425   1.233
  488   HD23  LEU  66          2HD2      LEU  66  -5.792  16.163   0.337
  489    H    GLU  67           H        GLU  67  -0.979  15.545   2.070
  490    HA   GLU  67           HA       GLU  67   1.033  16.420   2.664
  491    HB2  GLU  67           2HB      GLU  67   0.414  18.324   0.400
  492    HB3  GLU  67           3HB      GLU  67   1.978  18.205   1.194
  493    HG2  GLU  67           2HG      GLU  67   2.129  15.849   0.470
  494    HG3  GLU  67           3HG      GLU  67   0.601  16.042  -0.392
  495    H    HIS  68           H        HIS  68  -1.483  17.650   3.897
  496    HA   HIS  68           HA       HIS  68  -1.160  20.380   4.332
  497    HB2  HIS  68           2HB      HIS  68  -2.489  20.022   6.446
  498    HB3  HIS  68           3HB      HIS  68  -3.221  19.389   4.979
  499    HD1  HIS  68           HD1      HIS  68  -1.293  18.143   8.011
  500    HD2  HIS  68           HD2      HIS  68  -3.941  16.760   5.122
  501    HE1  HIS  68           HE1      HIS  68  -1.891  15.810   8.708
  502    HE2  HIS  68           HE2      HIS  68  -3.656  15.086   7.071
  503    H    HIS  69           H        HIS  69   1.068  20.726   4.517
  504    HA   HIS  69           HA       HIS  69   2.158  21.195   7.009
  505    HB2  HIS  69           2HB      HIS  69   2.180  18.712   7.275
  506    HB3  HIS  69           3HB      HIS  69   3.235  18.594   5.870
  507    HD1  HIS  69           HD1      HIS  69   5.654  18.500   6.412
  508    HD2  HIS  69           HD2      HIS  69   3.470  20.348   9.426
  509    HE1  HIS  69           HE1      HIS  69   7.308  19.001   8.230
  510    HE2  HIS  69           HE2      HIS  69   5.914  19.883  10.127
  511    H    HIS  70           H        HIS  70   2.777  20.250   3.671
  512    HA   HIS  70           HA       HIS  70   5.327  21.603   3.503
  513    HB2  HIS  70           2HB      HIS  70   3.509  20.503   1.338
  514    HB3  HIS  70           3HB      HIS  70   5.107  21.182   1.042
  515    HD1  HIS  70           HD1      HIS  70   3.937  18.128   0.683
  516    HD2  HIS  70           HD2      HIS  70   6.742  19.545   3.401
  517    HE1  HIS  70           HE1      HIS  70   5.286  16.129   1.353
  518    HE2  HIS  70           HE2      HIS  70   7.099  17.045   2.830
  519    H    HIS  71           H        HIS  71   5.413  23.792   3.572
  520    HA   HIS  71           HA       HIS  71   3.783  25.279   1.650
  521    HB2  HIS  71           2HB      HIS  71   2.574  25.456   3.801
  522    HB3  HIS  71           3HB      HIS  71   4.022  26.114   4.558
  523    HD1  HIS  71           HD1      HIS  71   4.604  28.580   4.056
  524    HD2  HIS  71           HD2      HIS  71   1.195  27.235   2.098
  525    HE1  HIS  71           HE1      HIS  71   3.518  30.635   3.113
  526    HE2  HIS  71           HE2      HIS  71   1.558  29.776   1.788
  527    H    HIS  72           H        HIS  72   5.164  26.374   0.404
  528    HA   HIS  72           HA       HIS  72   7.829  27.042   1.404
  529    HB2  HIS  72           2HB      HIS  72   7.540  25.952  -0.819
  530    HB3  HIS  72           3HB      HIS  72   6.675  27.377  -1.379
  531    HD1  HIS  72           HD1      HIS  72   8.099  29.549  -1.758
  532    HD2  HIS  72           HD2      HIS  72  10.312  26.178  -0.756
  533    HE1  HIS  72           HE1      HIS  72  10.483  30.135  -2.270
  534    HE2  HIS  72           HE2      HIS  72  11.779  28.029  -1.804
  535    H    HIS  73           H        HIS  73   8.566  29.102   1.753
  536    HA   HIS  73           HA       HIS  73   6.616  31.293   1.402
  537    HB2  HIS  73           2HB      HIS  73   7.875  32.444   3.266
  538    HB3  HIS  73           3HB      HIS  73   6.995  30.995   3.731
  539    HD1  HIS  73           HD1      HIS  73  10.475  32.323   3.312
  540    HD2  HIS  73           HD2      HIS  73   8.579  28.885   4.660
  541    HE1  HIS  73           HE1      HIS  73  12.249  30.999   4.495
  542    HE2  HIS  73           HE2      HIS  73  11.057  28.974   5.381
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1 -16.645  13.458  -2.953
    2    H2   MET   1           2H       MET   1 -17.244  11.876  -2.974
    3    H3   MET   1           3H       MET   1 -15.703  12.204  -3.583
    4    HA   MET   1           HA       MET   1 -14.909  12.817  -1.415
    5    HB2  MET   1           2HB      MET   1 -17.655  11.988  -0.435
    6    HB3  MET   1           3HB      MET   1 -16.309  12.525   0.563
    7    HG2  MET   1           2HG      MET   1 -17.822  14.178  -1.451
    8    HG3  MET   1           3HG      MET   1 -17.917  14.305   0.304
    9    HE1  MET   1           3HE      MET   1 -14.367  15.661   1.225
   10    HE2  MET   1           1HE      MET   1 -14.896  13.979   1.192
   11    HE3  MET   1           2HE      MET   1 -15.963  15.227   1.838
   12    H    THR   2           H        THR   2 -13.557  11.117  -1.947
   13    HA   THR   2           HA       THR   2 -14.124   8.572  -0.688
   14    HB   THR   2           HB       THR   2 -13.712   8.657  -3.697
   15    HG1  THR   2           HG1      THR   2 -15.965   8.262  -2.048
   16   HG21  THR   2          3HG2      THR   2 -12.573   6.733  -2.686
   17   HG22  THR   2          1HG2      THR   2 -13.979   6.216  -3.617
   18   HG23  THR   2          2HG2      THR   2 -14.061   6.278  -1.856
   19    H    GLN   3           H        GLN   3 -12.254   7.403  -0.231
   20    HA   GLN   3           HA       GLN   3  -9.780   8.762  -0.212
   21    HB2  GLN   3           2HB      GLN   3 -10.343   5.800   0.116
   22    HB3  GLN   3           3HB      GLN   3  -8.821   6.587   0.515
   23    HG2  GLN   3           2HG      GLN   3  -9.940   7.915   2.229
   24    HG3  GLN   3           3HG      GLN   3 -11.482   7.169   1.813
   25   HE21  GLN   3          1HE2      GLN   3 -10.264   4.528   1.415
   26   HE22  GLN   3          2HE2      GLN   3  -9.929   3.926   2.998
   27    H    LYS   4           H        LYS   4  -8.565   9.220  -1.961
   28    HA   LYS   4           HA       LYS   4  -8.782   8.036  -4.486
   29    HB2  LYS   4           2HB      LYS   4  -6.380   9.452  -3.299
   30    HB3  LYS   4           3HB      LYS   4  -6.627   9.126  -5.010
   31    HG2  LYS   4           2HG      LYS   4  -8.682  10.539  -4.921
   32    HG3  LYS   4           3HG      LYS   4  -8.273  10.944  -3.251
   33    HD2  LYS   4           2HD      LYS   4  -7.504  12.710  -4.725
   34    HD3  LYS   4           3HD      LYS   4  -6.115  11.867  -4.036
   35    HE2  LYS   4           2HE      LYS   4  -5.792  12.323  -6.420
   36    HE3  LYS   4           3HE      LYS   4  -5.845  10.592  -6.098
   37    HZ1  LYS   4           3HZ      LYS   4  -8.021  12.256  -7.242
   38    HZ2  LYS   4           1HZ      LYS   4  -8.203  10.631  -6.797
   39    HZ3  LYS   4           2HZ      LYS   4  -7.132  11.049  -8.031
   40    H    PHE   5           H        PHE   5  -6.445   7.413  -1.895
   41    HA   PHE   5           HA       PHE   5  -5.520   4.986  -3.238
   42    HB2  PHE   5           2HB      PHE   5  -4.662   6.265  -0.623
   43    HB3  PHE   5           3HB      PHE   5  -3.940   4.820  -1.322
   44    HD1  PHE   5           HD1      PHE   5  -4.502   8.446  -1.915
   45    HD2  PHE   5           HD2      PHE   5  -2.231   4.984  -2.925
   46    HE1  PHE   5           HE1      PHE   5  -2.929   9.848  -3.187
   47    HE2  PHE   5           HE2      PHE   5  -0.660   6.385  -4.196
   48    HZ   PHE   5           HZ       PHE   5  -1.011   8.819  -4.328
   49    H    THR   6           H        THR   6  -7.241   3.600  -3.129
   50    HA   THR   6           HA       THR   6  -8.611   3.195  -0.567
   51    HB   THR   6           HB       THR   6 -10.128   3.493  -2.397
   52    HG1  THR   6           HG1      THR   6 -11.363   1.867  -1.800
   53   HG21  THR   6          3HG2      THR   6  -8.622   2.890  -4.243
   54   HG22  THR   6          1HG2      THR   6 -10.160   2.035  -4.364
   55   HG23  THR   6          2HG2      THR   6  -8.728   1.194  -3.773
   56    H    LYS   7           H        LYS   7  -9.152   0.998   0.108
   57    HA   LYS   7           HA       LYS   7  -6.852  -0.681   0.249
   58    HB2  LYS   7           2HB      LYS   7  -8.349  -2.216   1.495
   59    HB3  LYS   7           3HB      LYS   7  -8.400  -0.567   2.101
   60    HG2  LYS   7           2HG      LYS   7 -10.497  -0.197   0.852
   61    HG3  LYS   7           3HG      LYS   7 -10.451  -1.881   0.322
   62    HD2  LYS   7           2HD      LYS   7 -11.949  -1.554   2.251
   63    HD3  LYS   7           3HD      LYS   7 -10.608  -2.640   2.627
   64    HE2  LYS   7           2HE      LYS   7  -9.430  -0.813   3.740
   65    HE3  LYS   7           3HE      LYS   7 -10.732   0.299   3.326
   66    HZ1  LYS   7           3HZ      LYS   7 -11.012  -2.090   5.065
   67    HZ2  LYS   7           1HZ      LYS   7 -12.230  -0.974   4.702
   68    HZ3  LYS   7           2HZ      LYS   7 -10.885  -0.493   5.607
   69    H    ASP   8           H        ASP   8  -9.427  -0.432  -1.975
   70    HA   ASP   8           HA       ASP   8  -9.512  -3.135  -2.898
   71    HB2  ASP   8           2HB      ASP   8 -11.422  -1.695  -3.214
   72    HB3  ASP   8           3HB      ASP   8 -10.456  -0.528  -4.112
   73    H    MET   9           H        MET   9  -7.686  -0.261  -3.882
   74    HA   MET   9           HA       MET   9  -6.808  -1.344  -6.371
   75    HB2  MET   9           2HB      MET   9  -5.361   0.591  -6.518
   76    HB3  MET   9           3HB      MET   9  -6.943   1.085  -5.934
   77    HG2  MET   9           2HG      MET   9  -5.956   0.981  -3.602
   78    HG3  MET   9           3HG      MET   9  -4.384   0.843  -4.383
   79    HE1  MET   9           3HE      MET   9  -3.444   2.727  -6.098
   80    HE2  MET   9           1HE      MET   9  -4.291   4.238  -6.427
   81    HE3  MET   9           2HE      MET   9  -4.961   2.710  -6.998
   82    H    THR  10           H        THR  10  -4.740  -2.082  -6.959
   83    HA   THR  10           HA       THR  10  -3.476  -3.725  -4.949
   84    HB   THR  10           HB       THR  10  -2.162  -4.669  -6.732
   85    HG1  THR  10           HG1      THR  10  -2.745  -3.567  -8.939
   86   HG21  THR  10          3HG2      THR  10  -3.906  -5.403  -8.287
   87   HG22  THR  10          1HG2      THR  10  -4.950  -4.087  -7.752
   88   HG23  THR  10          2HG2      THR  10  -4.515  -5.378  -6.632
   89    H    PHE  11           H        PHE  11  -1.087  -3.826  -4.731
   90    HA   PHE  11           HA       PHE  11   0.091  -1.425  -3.948
   91    HB2  PHE  11           2HB      PHE  11   1.415  -4.018  -4.792
   92    HB3  PHE  11           3HB      PHE  11   2.258  -2.691  -3.999
   93    HD1  PHE  11           HD2      PHE  11   1.864  -2.181  -1.660
   94    HD2  PHE  11           HD1      PHE  11  -0.115  -5.442  -3.557
   95    HE1  PHE  11           HE2      PHE  11   1.242  -3.082   0.538
   96    HE2  PHE  11           HE1      PHE  11  -0.742  -6.345  -1.356
   97    HZ   PHE  11           HZ       PHE  11  -0.060  -5.163   0.697
   98    H    ALA  12           H        ALA  12   0.392  -3.172  -7.028
   99    HA   ALA  12           HA       ALA  12   2.269  -1.511  -8.279
  100    HB1  ALA  12           3HB      ALA  12  -0.004  -3.011  -9.588
  101    HB2  ALA  12           1HB      ALA  12   1.564  -3.697  -9.161
  102    HB3  ALA  12           2HB      ALA  12   1.461  -2.426 -10.380
  103    H    GLN  13           H        GLN  13  -1.298  -1.298  -8.287
  104    HA   GLN  13           HA       GLN  13  -1.549   0.987  -9.895
  105    HB2  GLN  13           2HB      GLN  13  -3.311   0.157  -7.573
  106    HB3  GLN  13           3HB      GLN  13  -3.748   1.309  -8.827
  107    HG2  GLN  13           2HG      GLN  13  -3.602  -0.468 -10.506
  108    HG3  GLN  13           3HG      GLN  13  -3.175  -1.619  -9.242
  109   HE21  GLN  13          1HE2      GLN  13  -5.564   0.955  -8.941
  110   HE22  GLN  13          2HE2      GLN  13  -6.928  -0.095  -8.776
  111    H    ALA  14           H        ALA  14  -1.231   0.723  -6.353
  112    HA   ALA  14           HA       ALA  14  -1.391   3.443  -5.719
  113    HB1  ALA  14           3HB      ALA  14  -1.508   1.631  -4.065
  114    HB2  ALA  14           1HB      ALA  14  -0.319   2.854  -3.614
  115    HB3  ALA  14           2HB      ALA  14   0.212   1.315  -4.295
  116    H    LEU  15           H        LEU  15   1.522   1.472  -6.337
  117    HA   LEU  15           HA       LEU  15   3.452   3.455  -6.031
  118    HB2  LEU  15           2HB      LEU  15   3.445   1.052  -7.864
  119    HB3  LEU  15           3HB      LEU  15   4.861   2.031  -7.537
  120    HG   LEU  15           HG       LEU  15   3.333   0.440  -5.463
  121   HD11  LEU  15          1HD1      LEU  15   6.002  -0.106  -6.765
  122   HD12  LEU  15          2HD1      LEU  15   4.515  -1.020  -7.012
  123   HD13  LEU  15          3HD1      LEU  15   5.298  -1.023  -5.432
  124   HD21  LEU  15          3HD2      LEU  15   4.390   2.454  -4.540
  125   HD22  LEU  15          1HD2      LEU  15   5.936   1.960  -5.233
  126   HD23  LEU  15          2HD2      LEU  15   5.183   0.986  -3.968
  127    H    GLN  16           H        GLN  16   1.524   2.642  -8.888
  128    HA   GLN  16           HA       GLN  16   2.854   4.516 -10.609
  129    HB2  GLN  16           2HB      GLN  16   0.208   3.078 -10.899
  130    HB3  GLN  16           3HB      GLN  16   0.939   4.071 -12.155
  131    HG2  GLN  16           2HG      GLN  16   2.118   1.557 -10.972
  132    HG3  GLN  16           3HG      GLN  16   1.344   1.708 -12.548
  133   HE21  GLN  16          1HE2      GLN  16   4.180   2.403 -10.680
  134   HE22  GLN  16          2HE2      GLN  16   5.178   2.885 -12.003
  135    H    THR  17           H        THR  17   0.137   4.691  -8.417
  136    HA   THR  17           HA       THR  17  -1.068   7.038  -9.478
  137    HB   THR  17           HB       THR  17  -1.215   5.954  -6.649
  138    HG1  THR  17           HG1      THR  17  -2.025   4.621  -8.469
  139   HG21  THR  17          3HG2      THR  17  -1.884   8.317  -6.728
  140   HG22  THR  17          1HG2      THR  17  -3.288   7.281  -6.466
  141   HG23  THR  17          2HG2      THR  17  -2.983   7.968  -8.061
  142    H    HIS  18           H        HIS  18   1.350   6.558  -6.899
  143    HA   HIS  18           HA       HIS  18   2.281   9.293  -7.288
  144    HB2  HIS  18           2HB      HIS  18   0.908   8.370  -4.811
  145    HB3  HIS  18           3HB      HIS  18   2.337   9.376  -4.599
  146    HD1  HIS  18           HD1      HIS  18  -0.978   9.516  -6.474
  147    HD2  HIS  18           HD2      HIS  18   1.829  12.034  -4.749
  148    HE1  HIS  18           HE1      HIS  18  -1.969  11.812  -6.606
  149    HE2  HIS  18           HE2      HIS  18  -0.157  13.335  -5.774
  150    HA   PRO  19           HA       PRO  19   6.185   7.287  -6.733
  151    HB2  PRO  19           2HB      PRO  19   7.780   9.437  -6.314
  152    HB3  PRO  19           3HB      PRO  19   7.057   9.083  -7.888
  153    HG2  PRO  19           2HG      PRO  19   6.139  11.011  -5.778
  154    HG3  PRO  19           3HG      PRO  19   6.272  11.255  -7.531
  155    HD2  PRO  19           2HD      PRO  19   3.914  10.690  -6.316
  156    HD3  PRO  19           3HD      PRO  19   4.290  10.140  -7.963
  157    H    GLY  20           H        GLY  20   4.927   9.352  -4.189
  158    HA2  GLY  20           2HA      GLY  20   6.939   8.736  -2.241
  159    HA3  GLY  20           3HA      GLY  20   5.383   9.484  -1.929
  160    H    VAL  21           H        VAL  21   4.295   6.938  -3.432
  161    HA   VAL  21           HA       VAL  21   3.346   5.631  -1.146
  162    HB   VAL  21           HB       VAL  21   3.508   4.574  -3.978
  163   HG11  VAL  21          1HG1      VAL  21   1.844   3.611  -1.645
  164   HG12  VAL  21          2HG1      VAL  21   3.169   2.738  -2.416
  165   HG13  VAL  21          3HG1      VAL  21   1.683   3.054  -3.311
  166   HG21  VAL  21          3HG2      VAL  21   1.278   5.996  -2.515
  167   HG22  VAL  21          1HG2      VAL  21   1.170   5.320  -4.141
  168   HG23  VAL  21          2HG2      VAL  21   2.265   6.664  -3.814
  169    H    ALA  22           H        ALA  22   6.093   4.839  -3.237
  170    HA   ALA  22           HA       ALA  22   6.819   2.352  -2.285
  171    HB1  ALA  22           3HB      ALA  22   8.703   4.595  -3.031
  172    HB2  ALA  22           1HB      ALA  22   7.928   3.483  -4.161
  173    HB3  ALA  22           2HB      ALA  22   9.095   2.877  -2.986
  174    H    GLY  23           H        GLY  23   7.745   5.515  -0.918
  175    HA2  GLY  23           2HA      GLY  23   9.296   4.532   1.228
  176    HA3  GLY  23           3HA      GLY  23   8.527   6.111   1.155
  177    H    VAL  24           H        VAL  24   5.836   5.335   1.031
  178    HA   VAL  24           HA       VAL  24   5.206   4.954   3.748
  179    HB   VAL  24           HB       VAL  24   3.372   4.488   1.381
  180   HG11  VAL  24          1HG1      VAL  24   2.760   5.167   4.263
  181   HG12  VAL  24          2HG1      VAL  24   2.452   3.625   3.463
  182   HG13  VAL  24          3HG1      VAL  24   1.575   5.070   2.962
  183   HG21  VAL  24          3HG2      VAL  24   3.944   7.047   2.890
  184   HG22  VAL  24          1HG2      VAL  24   2.708   6.841   1.648
  185   HG23  VAL  24          2HG2      VAL  24   4.414   6.689   1.228
  186    H    LEU  25           H        LEU  25   4.890   2.693   0.992
  187    HA   LEU  25           HA       LEU  25   3.909   0.492   2.397
  188    HB2  LEU  25           2HB      LEU  25   5.714   0.503  -0.029
  189    HB3  LEU  25           3HB      LEU  25   4.805  -0.884   0.542
  190    HG   LEU  25           HG       LEU  25   3.635   1.694  -0.530
  191   HD11  LEU  25          1HD1      LEU  25   2.857   0.319  -2.383
  192   HD12  LEU  25          2HD1      LEU  25   3.647  -1.094  -1.683
  193   HD13  LEU  25          3HD1      LEU  25   4.616   0.264  -2.257
  194   HD21  LEU  25          3HD2      LEU  25   1.463   0.548  -0.360
  195   HD22  LEU  25          1HD2      LEU  25   2.206   0.797   1.221
  196   HD23  LEU  25          2HD2      LEU  25   2.248  -0.798   0.467
  197    H    ARG  26           H        ARG  26   7.307   1.337   1.683
  198    HA   ARG  26           HA       ARG  26   8.479  -0.843   3.030
  199    HB2  ARG  26           2HB      ARG  26   9.568   1.941   2.551
  200    HB3  ARG  26           3HB      ARG  26  10.527   0.582   3.121
  201    HG2  ARG  26           2HG      ARG  26  10.032  -0.628   1.042
  202    HG3  ARG  26           3HG      ARG  26   9.101   0.756   0.469
  203    HD2  ARG  26           2HD      ARG  26  11.325   0.781  -0.503
  204    HD3  ARG  26           3HD      ARG  26  11.117   2.152   0.585
  205    HE   ARG  26           HE       ARG  26  12.352   0.684   2.253
  206   HH11  ARG  26          1HH1      ARG  26  12.879   0.551  -1.146
  207   HH12  ARG  26          2HH1      ARG  26  14.510  -0.005  -0.983
  208   HH21  ARG  26          1HH2      ARG  26  14.452  -0.021   2.452
  209   HH22  ARG  26          2HH2      ARG  26  15.389  -0.319   1.028
  210    H    SER  27           H        SER  27   7.631   2.409   4.188
  211    HA   SER  27           HA       SER  27   8.592   2.207   6.811
  212    HB2  SER  27           2HB      SER  27   7.837   4.332   5.879
  213    HB3  SER  27           3HB      SER  27   6.185   3.727   5.767
  214    HG   SER  27           HG       SER  27   6.018   4.600   7.675
  215    H    TYR  28           H        TYR  28   5.610   1.033   5.380
  216    HA   TYR  28           HA       TYR  28   4.654   0.034   7.967
  217    HB2  TYR  28           2HB      TYR  28   3.389   0.369   5.257
  218    HB3  TYR  28           3HB      TYR  28   2.658  -0.691   6.458
  219    HD1  TYR  28           HD2      TYR  28   3.838   2.831   5.994
  220    HD2  TYR  28           HD1      TYR  28   1.224   0.185   8.071
  221    HE1  TYR  28           HE2      TYR  28   2.718   4.758   7.039
  222    HE2  TYR  28           HE1      TYR  28   0.107   2.103   9.119
  223    HH   TYR  28           HH       TYR  28   0.294   4.310   9.558
  224    H    ASN  29           H        ASN  29   6.995  -1.151   6.446
  225    HA   ASN  29           HA       ASN  29   7.926  -3.220   6.309
  226    HB2  ASN  29           2HB      ASN  29   6.708  -3.760   8.368
  227    HB3  ASN  29           3HB      ASN  29   5.289  -4.211   7.429
  228   HD21  ASN  29          1HD2      ASN  29   8.509  -5.116   8.361
  229   HD22  ASN  29          2HD2      ASN  29   8.406  -6.759   7.840
  230    H    LEU  30           H        LEU  30   5.031  -2.486   4.640
  231    HA   LEU  30           HA       LEU  30   4.627  -4.821   3.129
  232    HB2  LEU  30           2HB      LEU  30   3.993  -1.946   2.453
  233    HB3  LEU  30           3HB      LEU  30   3.376  -3.335   1.579
  234    HG   LEU  30           HG       LEU  30   2.835  -2.798   4.504
  235   HD11  LEU  30          1HD1      LEU  30   0.589  -2.124   3.800
  236   HD12  LEU  30          2HD1      LEU  30   1.074  -2.262   2.112
  237   HD13  LEU  30          3HD1      LEU  30   1.826  -1.052   3.151
  238   HD21  LEU  30          3HD2      LEU  30   1.110  -4.512   4.259
  239   HD22  LEU  30          1HD2      LEU  30   2.704  -5.163   3.881
  240   HD23  LEU  30          2HD2      LEU  30   1.582  -4.767   2.579
  241    H    GLY  31           H        GLY  31   7.216  -2.639   2.983
  242    HA2  GLY  31           2HA      GLY  31   7.887  -2.439   0.303
  243    HA3  GLY  31           3HA      GLY  31   9.059  -2.547   1.606
  244    H    CYS  32           H        CYS  32   7.939  -5.314   2.261
  245    HA   CYS  32           HA       CYS  32   9.768  -6.812   0.652
  246    HB2  CYS  32           2HB      CYS  32   7.671  -7.737   2.629
  247    HB3  CYS  32           3HB      CYS  32   8.885  -8.783   1.899
  248    HG   CYS  32           HG       CYS  32  10.522  -8.455   3.833
  249    H    ILE  33           H        ILE  33   6.838  -5.653  -0.251
  250    HA   ILE  33           HA       ILE  33   5.443  -7.759  -1.413
  251    HB   ILE  33           HB       ILE  33   4.667  -6.079  -3.139
  252   HG12  ILE  33          2HG1      ILE  33   6.414  -4.211  -1.504
  253   HG13  ILE  33          3HG1      ILE  33   6.690  -4.678  -3.179
  254   HG21  ILE  33          1HG2      ILE  33   4.426  -5.363  -0.219
  255   HG22  ILE  33          2HG2      ILE  33   3.403  -6.478  -1.123
  256   HG23  ILE  33          3HG2      ILE  33   3.379  -4.757  -1.501
  257   HD11  ILE  33          3HD1      ILE  33   4.598  -3.579  -3.817
  258   HD12  ILE  33          1HD1      ILE  33   5.729  -2.467  -3.049
  259   HD13  ILE  33          2HD1      ILE  33   4.354  -3.090  -2.138
  260    H    GLY  34           H        GLY  34   8.381  -6.200  -2.530
  261    HA2  GLY  34           2HA      GLY  34   8.410  -7.217  -5.176
  262    HA3  GLY  34           3HA      GLY  34   9.816  -6.703  -4.258
  263    H    CYS  35           H        CYS  35   9.703  -8.518  -2.139
  264    HA   CYS  35           HA       CYS  35  10.850 -10.858  -3.303
  265    HB2  CYS  35           2HB      CYS  35  11.692 -10.097  -1.183
  266    HB3  CYS  35           3HB      CYS  35  10.093 -10.188  -0.454
  267    HG   CYS  35           HG       CYS  35  10.602 -13.172  -1.507
  268    H    MET  36           H        MET  36   7.876 -10.402  -1.366
  269    HA   MET  36           HA       MET  36   7.104 -13.143  -1.591
  270    HB2  MET  36           2HB      MET  36   5.013 -12.428  -0.490
  271    HB3  MET  36           3HB      MET  36   6.447 -11.850   0.345
  272    HG2  MET  36           2HG      MET  36   6.147  -9.645  -0.714
  273    HG3  MET  36           3HG      MET  36   4.674 -10.233  -1.481
  274    HE1  MET  36           3HE      MET  36   2.470 -10.889  -0.147
  275    HE2  MET  36           1HE      MET  36   2.363 -10.886   1.614
  276    HE3  MET  36           2HE      MET  36   3.416 -12.041   0.796
  277    H    GLY  37           H        GLY  37   6.810 -10.594  -3.795
  278    HA2  GLY  37           2HA      GLY  37   5.823 -10.526  -5.881
  279    HA3  GLY  37           3HA      GLY  37   5.234 -12.158  -5.614
  280    H    ALA  38           H        ALA  38   4.634  -9.104  -3.891
  281    HA   ALA  38           HA       ALA  38   1.743  -9.510  -4.336
  282    HB1  ALA  38           3HB      ALA  38   2.394  -9.612  -1.976
  283    HB2  ALA  38           1HB      ALA  38   1.361  -8.218  -2.295
  284    HB3  ALA  38           2HB      ALA  38   3.101  -8.002  -2.096
  285    H    GLN  39           H        GLN  39   2.537  -8.476  -6.477
  286    HA   GLN  39           HA       GLN  39   2.498  -5.535  -6.311
  287    HB2  GLN  39           2HB      GLN  39   2.972  -7.339  -8.705
  288    HB3  GLN  39           3HB      GLN  39   3.110  -5.584  -8.697
  289    HG2  GLN  39           2HG      GLN  39   4.812  -7.460  -7.058
  290    HG3  GLN  39           3HG      GLN  39   5.288  -6.740  -8.595
  291   HE21  GLN  39          1HE2      GLN  39   4.636  -6.123  -5.229
  292   HE22  GLN  39          2HE2      GLN  39   5.391  -4.573  -5.171
  293    H    ASN  40           H        ASN  40   0.749  -8.272  -7.658
  294    HA   ASN  40           HA       ASN  40  -1.341  -6.587  -8.797
  295    HB2  ASN  40           2HB      ASN  40  -1.114  -9.608  -8.740
  296    HB3  ASN  40           3HB      ASN  40  -2.208  -8.657  -9.740
  297   HD21  ASN  40          1HD2      ASN  40   1.074  -9.712  -9.286
  298   HD22  ASN  40          2HD2      ASN  40   1.649  -9.198 -10.832
  299    H    GLU  41           H        GLU  41  -0.728  -7.623  -5.764
  300    HA   GLU  41           HA       GLU  41  -3.427  -8.482  -5.071
  301    HB2  GLU  41           2HB      GLU  41  -1.519  -9.672  -4.092
  302    HB3  GLU  41           3HB      GLU  41  -0.942  -8.180  -3.361
  303    HG2  GLU  41           2HG      GLU  41  -2.799  -8.093  -1.874
  304    HG3  GLU  41           3HG      GLU  41  -3.629  -9.389  -2.734
  305    H    SER  42           H        SER  42  -4.834  -7.350  -3.729
  306    HA   SER  42           HA       SER  42  -4.690  -4.498  -3.883
  307    HB2  SER  42           2HB      SER  42  -6.643  -6.215  -2.318
  308    HB3  SER  42           3HB      SER  42  -6.846  -4.507  -2.706
  309    HG   SER  42           HG       SER  42  -7.460  -5.023  -4.658
  310    H    LEU  43           H        LEU  43  -4.682  -2.975  -2.160
  311    HA   LEU  43           HA       LEU  43  -2.611  -3.270  -0.344
  312    HB2  LEU  43           2HB      LEU  43  -4.960  -1.376  -0.211
  313    HB3  LEU  43           3HB      LEU  43  -3.500  -1.219   0.752
  314    HG   LEU  43           HG       LEU  43  -3.632  -1.077  -2.268
  315   HD11  LEU  43          1HD1      LEU  43  -3.198   1.105  -0.229
  316   HD12  LEU  43          2HD1      LEU  43  -4.646   0.871  -1.209
  317   HD13  LEU  43          3HD1      LEU  43  -3.119   1.292  -1.981
  318   HD21  LEU  43          3HD2      LEU  43  -1.288  -0.371  -2.138
  319   HD22  LEU  43          1HD2      LEU  43  -1.507  -2.001  -1.501
  320   HD23  LEU  43          2HD2      LEU  43  -1.299  -0.644  -0.394
  321    H    GLU  44           H        GLU  44  -6.112  -3.584   0.352
  322    HA   GLU  44           HA       GLU  44  -5.851  -4.066   3.119
  323    HB2  GLU  44           2HB      GLU  44  -8.001  -3.512   2.098
  324    HB3  GLU  44           3HB      GLU  44  -7.991  -5.024   1.200
  325    HG2  GLU  44           2HG      GLU  44  -8.112  -6.275   3.304
  326    HG3  GLU  44           3HG      GLU  44  -8.122  -4.761   4.206
  327    H    GLN  45           H        GLN  45  -6.037  -6.329   0.393
  328    HA   GLN  45           HA       GLN  45  -5.913  -8.735   1.798
  329    HB2  GLN  45           2HB      GLN  45  -4.817  -8.048  -0.941
  330    HB3  GLN  45           3HB      GLN  45  -5.048  -9.684  -0.337
  331    HG2  GLN  45           2HG      GLN  45  -7.408  -9.444  -0.309
  332    HG3  GLN  45           3HG      GLN  45  -7.303  -7.701  -0.549
  333   HE21  GLN  45          1HE2      GLN  45  -8.650  -7.830  -2.361
  334   HE22  GLN  45          2HE2      GLN  45  -8.075  -8.426  -3.874
  335    H    GLY  46           H        GLY  46  -3.267  -6.689   0.576
  336    HA2  GLY  46           2HA      GLY  46  -1.143  -8.323   1.509
  337    HA3  GLY  46           3HA      GLY  46  -1.034  -6.616   1.113
  338    H    ALA  47           H        ALA  47  -2.866  -5.603   3.000
  339    HA   ALA  47           HA       ALA  47  -1.313  -5.324   5.315
  340    HB1  ALA  47           3HB      ALA  47  -3.014  -3.699   4.654
  341    HB2  ALA  47           1HB      ALA  47  -3.281  -4.253   6.307
  342    HB3  ALA  47           2HB      ALA  47  -4.283  -4.875   4.994
  343    H    ASN  48           H        ASN  48  -4.319  -7.210   4.878
  344    HA   ASN  48           HA       ASN  48  -4.464  -8.464   7.339
  345    HB2  ASN  48           2HB      ASN  48  -5.171  -9.588   4.612
  346    HB3  ASN  48           3HB      ASN  48  -5.675 -10.301   6.142
  347   HD21  ASN  48          1HD2      ASN  48  -7.277  -9.217   3.949
  348   HD22  ASN  48          2HD2      ASN  48  -8.262  -7.986   4.653
  349    H    ALA  49           H        ALA  49  -2.659  -9.548   4.461
  350    HA   ALA  49           HA       ALA  49  -1.652 -11.945   5.530
  351    HB1  ALA  49           3HB      ALA  49  -0.028 -11.881   3.712
  352    HB2  ALA  49           1HB      ALA  49  -0.403 -10.181   3.421
  353    HB3  ALA  49           2HB      ALA  49  -1.630 -11.416   3.137
  354    H    HIS  50           H        HIS  50  -0.514  -8.639   5.883
  355    HA   HIS  50           HA       HIS  50   1.899  -9.555   7.298
  356    HB2  HIS  50           2HB      HIS  50   1.062  -6.865   6.208
  357    HB3  HIS  50           3HB      HIS  50   2.448  -7.054   7.278
  358    HD1  HIS  50           HD1      HIS  50   4.615  -7.619   6.201
  359    HD2  HIS  50           HD2      HIS  50   1.384  -8.403   3.701
  360    HE1  HIS  50           HE1      HIS  50   5.613  -8.248   3.987
  361    HE2  HIS  50           HE2      HIS  50   3.651  -8.874   2.545
  362    H    GLY  51           H        GLY  51  -1.197  -9.044   8.142
  363    HA2  GLY  51           2HA      GLY  51  -2.260  -8.689  10.151
  364    HA3  GLY  51           3HA      GLY  51  -0.687  -8.849  10.915
  365    H    LEU  52           H        LEU  52  -1.608  -6.408   8.545
  366    HA   LEU  52           HA       LEU  52  -0.993  -4.306  10.520
  367    HB2  LEU  52           2HB      LEU  52  -1.044  -4.181   7.500
  368    HB3  LEU  52           3HB      LEU  52  -0.590  -2.865   8.570
  369    HG   LEU  52           HG       LEU  52   0.907  -5.484   8.324
  370   HD11  LEU  52          1HD1      LEU  52   2.617  -4.147   7.176
  371   HD12  LEU  52          2HD1      LEU  52   1.535  -2.754   7.204
  372   HD13  LEU  52          3HD1      LEU  52   1.096  -4.193   6.283
  373   HD21  LEU  52          3HD2      LEU  52   1.615  -2.929   9.772
  374   HD22  LEU  52          1HD2      LEU  52   2.636  -4.360   9.631
  375   HD23  LEU  52          2HD2      LEU  52   1.123  -4.443  10.531
  376    H    ASN  53           H        ASN  53  -2.264  -2.355  10.527
  377    HA   ASN  53           HA       ASN  53  -5.080  -2.792   9.992
  378    HB2  ASN  53           2HB      ASN  53  -4.364  -1.666  12.070
  379    HB3  ASN  53           3HB      ASN  53  -3.665  -0.358  11.117
  380   HD21  ASN  53          1HD2      ASN  53  -5.006   1.184  12.036
  381   HD22  ASN  53          2HD2      ASN  53  -6.696   1.271  11.683
  382    H    VAL  54           H        VAL  54  -5.670  -2.621   7.912
  383    HA   VAL  54           HA       VAL  54  -4.354  -1.264   5.890
  384    HB   VAL  54           HB       VAL  54  -5.986  -3.010   5.432
  385   HG11  VAL  54          1HG1      VAL  54  -7.636  -2.435   7.157
  386   HG12  VAL  54          2HG1      VAL  54  -8.385  -2.627   5.573
  387   HG13  VAL  54          3HG1      VAL  54  -8.110  -1.011   6.227
  388   HG21  VAL  54          3HG2      VAL  54  -5.431  -1.432   3.642
  389   HG22  VAL  54          1HG2      VAL  54  -6.763  -0.388   4.138
  390   HG23  VAL  54          2HG2      VAL  54  -7.094  -2.000   3.500
  391    H    GLU  55           H        GLU  55  -6.953  -0.044   7.983
  392    HA   GLU  55           HA       GLU  55  -7.507   2.322   6.574
  393    HB2  GLU  55           2HB      GLU  55  -7.690   1.821   9.555
  394    HB3  GLU  55           3HB      GLU  55  -8.446   3.157   8.699
  395    HG2  GLU  55           2HG      GLU  55  -9.059   0.230   8.302
  396    HG3  GLU  55           3HG      GLU  55 -10.046   1.384   9.194
  397    H    ASP  56           H        ASP  56  -5.096   1.663   9.094
  398    HA   ASP  56           HA       ASP  56  -4.189   4.340   9.364
  399    HB2  ASP  56           2HB      ASP  56  -3.845   2.392  10.981
  400    HB3  ASP  56           3HB      ASP  56  -2.551   1.859   9.912
  401    H    ILE  57           H        ILE  57  -3.253   1.660   7.287
  402    HA   ILE  57           HA       ILE  57  -0.964   2.822   6.086
  403    HB   ILE  57           HB       ILE  57  -2.893   0.830   4.856
  404   HG12  ILE  57          2HG1      ILE  57  -0.380   0.315   6.479
  405   HG13  ILE  57          3HG1      ILE  57  -2.027   0.077   7.057
  406   HG21  ILE  57          1HG2      ILE  57  -1.392   1.837   3.214
  407   HG22  ILE  57          2HG2      ILE  57  -0.969   0.146   3.487
  408   HG23  ILE  57          3HG2      ILE  57   0.001   1.426   4.215
  409   HD11  ILE  57          3HD1      ILE  57  -2.376  -1.660   5.402
  410   HD12  ILE  57          1HD1      ILE  57  -0.964  -2.017   6.398
  411   HD13  ILE  57          2HD1      ILE  57  -0.755  -1.395   4.762
  412    H    LEU  58           H        LEU  58  -4.346   2.623   4.937
  413    HA   LEU  58           HA       LEU  58  -4.083   4.146   2.611
  414    HB2  LEU  58           2HB      LEU  58  -6.493   3.965   4.427
  415    HB3  LEU  58           3HB      LEU  58  -6.509   4.523   2.765
  416    HG   LEU  58           HG       LEU  58  -5.891   1.718   3.703
  417   HD11  LEU  58          1HD1      LEU  58  -8.261   2.329   3.813
  418   HD12  LEU  58          2HD1      LEU  58  -7.951   1.115   2.574
  419   HD13  LEU  58          3HD1      LEU  58  -8.215   2.797   2.113
  420   HD21  LEU  58          3HD2      LEU  58  -5.928   2.859   0.908
  421   HD22  LEU  58          1HD2      LEU  58  -5.816   1.144   1.309
  422   HD23  LEU  58          2HD2      LEU  58  -4.520   2.244   1.776
  423    H    ARG  59           H        ARG  59  -4.570   5.154   5.936
  424    HA   ARG  59           HA       ARG  59  -5.166   7.835   5.689
  425    HB2  ARG  59           2HB      ARG  59  -5.075   6.737   7.837
  426    HB3  ARG  59           3HB      ARG  59  -3.353   6.434   7.660
  427    HG2  ARG  59           2HG      ARG  59  -3.116   9.001   7.585
  428    HG3  ARG  59           3HG      ARG  59  -4.756   9.022   8.241
  429    HD2  ARG  59           2HD      ARG  59  -3.058   9.146  10.014
  430    HD3  ARG  59           3HD      ARG  59  -4.034   7.681  10.141
  431    HE   ARG  59           HE       ARG  59  -1.848   6.951   8.664
  432   HH11  ARG  59          1HH1      ARG  59  -2.365   8.258  11.801
  433   HH12  ARG  59          2HH1      ARG  59  -0.921   7.555  12.446
  434   HH21  ARG  59          1HH2      ARG  59  -0.008   6.054   9.499
  435   HH22  ARG  59          2HH2      ARG  59   0.397   6.325  11.160
  436    H    ASP  60           H        ASP  60  -1.871   6.433   5.847
  437    HA   ASP  60           HA       ASP  60  -0.592   8.957   5.409
  438    HB2  ASP  60           2HB      ASP  60   0.325   6.857   6.628
  439    HB3  ASP  60           3HB      ASP  60   0.745   6.280   5.019
  440    H    LEU  61           H        LEU  61  -1.486   6.238   3.351
  441    HA   LEU  61           HA       LEU  61  -0.158   7.000   0.994
  442    HB2  LEU  61           2HB      LEU  61  -2.734   5.482   1.406
  443    HB3  LEU  61           3HB      LEU  61  -1.973   5.680  -0.162
  444    HG   LEU  61           HG       LEU  61  -0.705   4.292   2.211
  445   HD11  LEU  61          1HD1      LEU  61  -2.579   3.010   1.340
  446   HD12  LEU  61          2HD1      LEU  61  -1.052   2.236   0.918
  447   HD13  LEU  61          3HD1      LEU  61  -1.941   3.154  -0.298
  448   HD21  LEU  61          3HD2      LEU  61   0.989   3.576   0.586
  449   HD22  LEU  61          1HD2      LEU  61   0.942   5.332   0.733
  450   HD23  LEU  61          2HD2      LEU  61   0.204   4.545  -0.663
  451    H    ASN  62           H        ASN  62  -3.497   7.767   2.049
  452    HA   ASN  62           HA       ASN  62  -4.033   9.451  -0.190
  453    HB2  ASN  62           2HB      ASN  62  -5.417   9.075   2.463
  454    HB3  ASN  62           3HB      ASN  62  -5.951  10.294   1.310
  455   HD21  ASN  62          1HD2      ASN  62  -5.730   6.907   1.979
  456   HD22  ASN  62          2HD2      ASN  62  -6.731   6.378   0.679
  457    H    ALA  63           H        ALA  63  -2.513   9.984   2.908
  458    HA   ALA  63           HA       ALA  63  -2.587  12.784   3.024
  459    HB1  ALA  63           3HB      ALA  63  -1.766  11.422   4.869
  460    HB2  ALA  63           1HB      ALA  63  -0.554  12.614   4.394
  461    HB3  ALA  63           2HB      ALA  63  -0.374  10.929   3.906
  462    H    LEU  64           H        LEU  64  -0.650  10.617   1.054
  463    HA   LEU  64           HA       LEU  64   1.240  12.450   0.051
  464    HB2  LEU  64           2HB      LEU  64   0.007  10.075  -1.362
  465    HB3  LEU  64           3HB      LEU  64   1.493  10.884  -1.825
  466    HG   LEU  64           HG       LEU  64   1.079   9.384   0.770
  467   HD11  LEU  64          1HD1      LEU  64   2.577   7.699  -0.221
  468   HD12  LEU  64          2HD1      LEU  64   2.536   8.578  -1.750
  469   HD13  LEU  64          3HD1      LEU  64   1.061   7.855  -1.108
  470   HD21  LEU  64          3HD2      LEU  64   3.570  10.591  -0.447
  471   HD22  LEU  64          1HD2      LEU  64   3.506   9.618   1.024
  472   HD23  LEU  64          2HD2      LEU  64   2.708  11.190   0.972
  473    H    ALA  65           H        ALA  65  -2.098  11.819  -0.837
  474    HA   ALA  65           HA       ALA  65  -2.038  13.397  -3.247
  475    HB1  ALA  65           3HB      ALA  65  -4.397  12.358  -1.670
  476    HB2  ALA  65           1HB      ALA  65  -3.591  11.518  -2.995
  477    HB3  ALA  65           2HB      ALA  65  -4.453  13.027  -3.301
  478    H    LEU  66           H        LEU  66  -3.066  13.888   0.099
  479    HA   LEU  66           HA       LEU  66  -4.160  16.495  -0.335
  480    HB2  LEU  66           2HB      LEU  66  -3.239  15.182   2.229
  481    HB3  LEU  66           3HB      LEU  66  -4.206  16.641   2.123
  482    HG   LEU  66           HG       LEU  66  -5.069  13.887   1.218
  483   HD11  LEU  66          1HD1      LEU  66  -5.923  15.541   3.594
  484   HD12  LEU  66          2HD1      LEU  66  -4.968  14.059   3.638
  485   HD13  LEU  66          3HD1      LEU  66  -6.644  14.009   3.093
  486   HD21  LEU  66          3HD2      LEU  66  -6.590  16.496   1.264
  487   HD22  LEU  66          1HD2      LEU  66  -7.273  14.913   0.889
  488   HD23  LEU  66          2HD2      LEU  66  -6.056  15.621  -0.173
  489    H    GLU  67           H        GLU  67  -1.018  15.255   0.644
  490    HA   GLU  67           HA       GLU  67   1.043  16.157   0.835
  491    HB2  GLU  67           2HB      GLU  67  -0.175  18.505  -0.628
  492    HB3  GLU  67           3HB      GLU  67   1.537  18.339  -0.267
  493    HG2  GLU  67           2HG      GLU  67   1.439  16.148  -1.563
  494    HG3  GLU  67           3HG      GLU  67  -0.144  16.684  -2.126
  495    H    HIS  68           H        HIS  68  -1.117  18.955   1.335
  496    HA   HIS  68           HA       HIS  68   0.407  20.441   3.003
  497    HB2  HIS  68           2HB      HIS  68  -1.802  21.327   3.936
  498    HB3  HIS  68           3HB      HIS  68  -1.557  21.419   2.198
  499    HD1  HIS  68           HD1      HIS  68  -3.408  20.543   0.806
  500    HD2  HIS  68           HD2      HIS  68  -3.519  18.985   4.658
  501    HE1  HIS  68           HE1      HIS  68  -5.537  19.227   0.941
  502    HE2  HIS  68           HE2      HIS  68  -5.651  18.407   3.316
  503    H    HIS  69           H        HIS  69   1.604  19.076   4.439
  504    HA   HIS  69           HA       HIS  69   0.149  18.409   6.908
  505    HB2  HIS  69           2HB      HIS  69   2.976  17.840   5.996
  506    HB3  HIS  69           3HB      HIS  69   2.469  17.613   7.665
  507    HD1  HIS  69           HD1      HIS  69   0.758  15.683   8.133
  508    HD2  HIS  69           HD2      HIS  69   2.195  15.841   4.236
  509    HE1  HIS  69           HE1      HIS  69   0.191  13.462   7.117
  510    HE2  HIS  69           HE2      HIS  69   1.284  13.502   4.854
  511    H    HIS  70           H        HIS  70   0.084  19.844   8.537
  512    HA   HIS  70           HA       HIS  70   1.248  22.436   8.180
  513    HB2  HIS  70           2HB      HIS  70  -0.242  21.289  10.555
  514    HB3  HIS  70           3HB      HIS  70   0.152  22.990  10.325
  515    HD1  HIS  70           HD1      HIS  70  -2.661  21.011  10.148
  516    HD2  HIS  70           HD2      HIS  70  -0.943  23.644   7.432
  517    HE1  HIS  70           HE1      HIS  70  -4.503  21.640   8.566
  518    HE2  HIS  70           HE2      HIS  70  -3.387  23.060   6.822
  519    H    HIS  71           H        HIS  71   3.089  23.266   8.971
  520    HA   HIS  71           HA       HIS  71   5.049  21.638  10.212
  521    HB2  HIS  71           2HB      HIS  71   5.646  23.529   8.769
  522    HB3  HIS  71           3HB      HIS  71   4.923  24.655   9.914
  523    HD1  HIS  71           HD1      HIS  71   6.413  25.538  11.713
  524    HD2  HIS  71           HD2      HIS  71   8.022  22.202   9.833
  525    HE1  HIS  71           HE1      HIS  71   8.730  25.303  12.632
  526    HE2  HIS  71           HE2      HIS  71   9.639  23.212  11.577
  527    H    HIS  72           H        HIS  72   3.022  24.281  11.476
  528    HA   HIS  72           HA       HIS  72   3.134  23.052  14.124
  529    HB2  HIS  72           2HB      HIS  72   4.952  24.732  14.134
  530    HB3  HIS  72           3HB      HIS  72   3.796  25.981  13.683
  531    HD1  HIS  72           HD1      HIS  72   2.347  26.966  15.531
  532    HD2  HIS  72           HD2      HIS  72   4.695  23.785  16.813
  533    HE1  HIS  72           HE1      HIS  72   2.155  26.956  18.028
  534    HE2  HIS  72           HE2      HIS  72   3.456  24.939  18.771
  535    H    HIS  73           H        HIS  73   1.169  23.019  15.029
  536    HA   HIS  73           HA       HIS  73  -1.094  24.138  13.701
  537    HB2  HIS  73           2HB      HIS  73  -1.240  22.006  14.882
  538    HB3  HIS  73           3HB      HIS  73  -0.855  22.796  16.408
  539    HD1  HIS  73           HD1      HIS  73  -2.715  24.209  17.518
  540    HD2  HIS  73           HD2      HIS  73  -3.896  22.302  14.020
  541    HE1  HIS  73           HE1      HIS  73  -5.215  24.373  17.476
  542    HE2  HIS  73           HE2      HIS  73  -5.887  23.385  15.266
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1 -16.264  13.094   0.909
    2    H2   MET   1           2H       MET   1 -17.164  13.984  -0.205
    3    H3   MET   1           3H       MET   1 -15.493  13.837  -0.402
    4    HA   MET   1           HA       MET   1 -17.479  11.652  -0.574
    5    HB2  MET   1           2HB      MET   1 -15.871  13.084  -2.696
    6    HB3  MET   1           3HB      MET   1 -16.730  11.575  -2.983
    7    HG2  MET   1           2HG      MET   1 -18.840  12.670  -2.385
    8    HG3  MET   1           3HG      MET   1 -17.973  14.184  -2.128
    9    HE1  MET   1           3HE      MET   1 -20.540  13.481  -4.177
   10    HE2  MET   1           1HE      MET   1 -20.115  14.606  -5.470
   11    HE3  MET   1           2HE      MET   1 -19.963  15.101  -3.785
   12    H    THR   2           H        THR   2 -16.236   9.867  -2.056
   13    HA   THR   2           HA       THR   2 -14.612   8.549  -0.190
   14    HB   THR   2           HB       THR   2 -15.962   7.334  -1.828
   15    HG1  THR   2           HG1      THR   2 -14.576   5.697  -1.851
   16   HG21  THR   2          3HG2      THR   2 -15.225   7.095  -4.151
   17   HG22  THR   2          1HG2      THR   2 -13.911   8.235  -3.862
   18   HG23  THR   2          2HG2      THR   2 -15.587   8.782  -3.781
   19    H    GLN   3           H        GLN   3 -12.499   7.401  -1.015
   20    HA   GLN   3           HA       GLN   3 -10.553   9.585  -1.238
   21    HB2  GLN   3           2HB      GLN   3 -10.099   6.687  -0.491
   22    HB3  GLN   3           3HB      GLN   3  -8.968   8.017  -0.285
   23    HG2  GLN   3           2HG      GLN   3 -10.367   9.018   1.397
   24    HG3  GLN   3           3HG      GLN   3 -11.629   7.821   1.116
   25   HE21  GLN   3          1HE2      GLN   3  -8.218   7.054   1.197
   26   HE22  GLN   3          2HE2      GLN   3  -8.271   6.143   2.661
   27    H    LYS   4           H        LYS   4  -8.535   9.226  -2.472
   28    HA   LYS   4           HA       LYS   4  -8.957   7.975  -5.048
   29    HB2  LYS   4           2HB      LYS   4  -6.554   9.360  -3.836
   30    HB3  LYS   4           3HB      LYS   4  -6.568   8.685  -5.460
   31    HG2  LYS   4           2HG      LYS   4  -8.446  10.195  -6.033
   32    HG3  LYS   4           3HG      LYS   4  -8.322  10.911  -4.427
   33    HD2  LYS   4           2HD      LYS   4  -7.167  12.270  -6.119
   34    HD3  LYS   4           3HD      LYS   4  -6.045  11.649  -4.906
   35    HE2  LYS   4           2HE      LYS   4  -5.115  11.476  -7.166
   36    HE3  LYS   4           3HE      LYS   4  -5.331   9.888  -6.437
   37    HZ1  LYS   4           3HZ      LYS   4  -7.221  11.126  -8.362
   38    HZ2  LYS   4           1HZ      LYS   4  -7.302   9.553  -7.743
   39    HZ3  LYS   4           2HZ      LYS   4  -6.037   9.995  -8.776
   40    H    PHE   5           H        PHE   5  -6.600   7.465  -2.399
   41    HA   PHE   5           HA       PHE   5  -5.912   4.834  -3.405
   42    HB2  PHE   5           2HB      PHE   5  -5.102   6.319  -0.893
   43    HB3  PHE   5           3HB      PHE   5  -4.535   4.702  -1.291
   44    HD1  PHE   5           HD1      PHE   5  -4.323   8.261  -2.130
   45    HD2  PHE   5           HD2      PHE   5  -2.939   4.344  -3.072
   46    HE1  PHE   5           HE1      PHE   5  -2.479   9.227  -3.437
   47    HE2  PHE   5           HE2      PHE   5  -1.093   5.307  -4.379
   48    HZ   PHE   5           HZ       PHE   5  -0.859   7.749  -4.559
   49    H    THR   6           H        THR   6  -7.254   3.187  -3.124
   50    HA   THR   6           HA       THR   6  -8.824   3.004  -0.615
   51    HB   THR   6           HB       THR   6 -10.330   3.291  -2.484
   52    HG1  THR   6           HG1      THR   6 -11.613   1.719  -1.831
   53   HG21  THR   6          3HG2      THR   6  -8.957   0.900  -3.739
   54   HG22  THR   6          1HG2      THR   6  -8.870   2.568  -4.310
   55   HG23  THR   6          2HG2      THR   6 -10.403   1.697  -4.362
   56    H    LYS   7           H        LYS   7  -9.412   0.725  -0.005
   57    HA   LYS   7           HA       LYS   7  -7.038  -0.850   0.220
   58    HB2  LYS   7           2HB      LYS   7  -8.478  -2.453   1.427
   59    HB3  LYS   7           3HB      LYS   7  -8.664  -0.808   2.022
   60    HG2  LYS   7           2HG      LYS   7 -10.753  -0.571   0.801
   61    HG3  LYS   7           3HG      LYS   7 -10.556  -2.184   0.112
   62    HD2  LYS   7           2HD      LYS   7 -12.122  -2.240   1.977
   63    HD3  LYS   7           3HD      LYS   7 -10.664  -3.155   2.369
   64    HE2  LYS   7           2HE      LYS   7  -9.817  -1.154   3.597
   65    HE3  LYS   7           3HE      LYS   7 -11.364  -0.365   3.298
   66    HZ1  LYS   7           3HZ      LYS   7 -12.471  -2.070   4.561
   67    HZ2  LYS   7           1HZ      LYS   7 -11.227  -1.405   5.495
   68    HZ3  LYS   7           2HZ      LYS   7 -11.025  -2.920   4.770
   69    H    ASP   8           H        ASP   8  -9.507  -0.690  -2.111
   70    HA   ASP   8           HA       ASP   8  -9.427  -3.423  -3.006
   71    HB2  ASP   8           2HB      ASP   8 -11.469  -2.158  -3.222
   72    HB3  ASP   8           3HB      ASP   8 -10.654  -0.910  -4.155
   73    H    MET   9           H        MET   9  -7.651  -0.516  -3.809
   74    HA   MET   9           HA       MET   9  -6.807  -1.459  -6.409
   75    HB2  MET   9           2HB      MET   9  -5.409   0.528  -6.503
   76    HB3  MET   9           3HB      MET   9  -7.026   0.954  -5.961
   77    HG2  MET   9           2HG      MET   9  -6.149   0.927  -3.617
   78    HG3  MET   9           3HG      MET   9  -4.533   0.733  -4.291
   79    HE1  MET   9           3HE      MET   9  -3.352   2.595  -5.850
   80    HE2  MET   9           1HE      MET   9  -4.165   4.078  -6.347
   81    HE3  MET   9           2HE      MET   9  -4.746   2.517  -6.929
   82    H    THR  10           H        THR  10  -4.651  -2.034  -7.004
   83    HA   THR  10           HA       THR  10  -3.422  -3.754  -5.025
   84    HB   THR  10           HB       THR  10  -2.053  -4.618  -6.826
   85    HG1  THR  10           HG1      THR  10  -2.528  -3.597  -9.003
   86   HG21  THR  10          3HG2      THR  10  -3.799  -5.353  -8.400
   87   HG22  THR  10          1HG2      THR  10  -4.888  -4.127  -7.754
   88   HG23  THR  10          2HG2      THR  10  -4.342  -5.452  -6.725
   89    H    PHE  11           H        PHE  11  -1.140  -3.798  -4.578
   90    HA   PHE  11           HA       PHE  11   0.036  -1.413  -3.798
   91    HB2  PHE  11           2HB      PHE  11   1.350  -4.047  -4.513
   92    HB3  PHE  11           3HB      PHE  11   2.190  -2.719  -3.720
   93    HD1  PHE  11           HD2      PHE  11   1.691  -2.129  -1.412
   94    HD2  PHE  11           HD1      PHE  11  -0.253  -5.411  -3.313
   95    HE1  PHE  11           HE2      PHE  11   0.948  -2.956   0.778
   96    HE2  PHE  11           HE1      PHE  11  -0.999  -6.240  -1.119
   97    HZ   PHE  11           HZ       PHE  11  -0.400  -5.013   0.929
   98    H    ALA  12           H        ALA  12   0.507  -3.193  -6.837
   99    HA   ALA  12           HA       ALA  12   2.509  -1.628  -7.988
  100    HB1  ALA  12           3HB      ALA  12   1.745  -3.759  -8.927
  101    HB2  ALA  12           1HB      ALA  12   1.728  -2.479 -10.141
  102    HB3  ALA  12           2HB      ALA  12   0.220  -3.009  -9.396
  103    H    GLN  13           H        GLN  13  -1.038  -1.229  -8.222
  104    HA   GLN  13           HA       GLN  13  -1.061   1.061  -9.842
  105    HB2  GLN  13           2HB      GLN  13  -3.022   0.291  -7.666
  106    HB3  GLN  13           3HB      GLN  13  -3.316   1.485  -8.924
  107    HG2  GLN  13           2HG      GLN  13  -3.161  -0.255 -10.628
  108    HG3  GLN  13           3HG      GLN  13  -2.828  -1.455  -9.381
  109   HE21  GLN  13          1HE2      GLN  13  -5.145   1.167  -9.085
  110   HE22  GLN  13          2HE2      GLN  13  -6.544   0.158  -9.021
  111    H    ALA  14           H        ALA  14  -1.029   0.791  -6.288
  112    HA   ALA  14           HA       ALA  14  -1.189   3.486  -5.622
  113    HB1  ALA  14           3HB      ALA  14  -1.361   1.667  -3.991
  114    HB2  ALA  14           1HB      ALA  14  -0.170   2.868  -3.490
  115    HB3  ALA  14           2HB      ALA  14   0.360   1.332  -4.178
  116    H    LEU  15           H        LEU  15   1.768   1.539  -6.102
  117    HA   LEU  15           HA       LEU  15   3.638   3.598  -5.761
  118    HB2  LEU  15           2HB      LEU  15   3.827   1.132  -7.505
  119    HB3  LEU  15           3HB      LEU  15   5.185   2.143  -7.043
  120    HG   LEU  15           HG       LEU  15   3.472   0.531  -5.138
  121   HD11  LEU  15          1HD1      LEU  15   4.880  -0.890  -6.529
  122   HD12  LEU  15          2HD1      LEU  15   5.463  -0.867  -4.865
  123   HD13  LEU  15          3HD1      LEU  15   6.297   0.072  -6.105
  124   HD21  LEU  15          3HD2      LEU  15   4.320   2.562  -4.096
  125   HD22  LEU  15          1HD2      LEU  15   5.954   2.177  -4.635
  126   HD23  LEU  15          2HD2      LEU  15   5.145   1.142  -3.457
  127    H    GLN  16           H        GLN  16   1.896   2.545  -8.654
  128    HA   GLN  16           HA       GLN  16   3.292   4.390 -10.397
  129    HB2  GLN  16           2HB      GLN  16   0.902   2.591 -10.870
  130    HB3  GLN  16           3HB      GLN  16   1.686   3.550 -12.121
  131    HG2  GLN  16           2HG      GLN  16   3.012   1.376 -10.499
  132    HG3  GLN  16           3HG      GLN  16   2.397   1.194 -12.141
  133   HE21  GLN  16          1HE2      GLN  16   4.883   2.591 -10.155
  134   HE22  GLN  16          2HE2      GLN  16   5.951   3.021 -11.440
  135    H    THR  17           H        THR  17   0.930   4.893  -8.140
  136    HA   THR  17           HA       THR  17  -0.373   7.046  -9.675
  137    HB   THR  17           HB       THR  17  -1.048   5.997  -6.908
  138    HG1  THR  17           HG1      THR  17  -1.511   4.635  -8.836
  139   HG21  THR  17          3HG2      THR  17  -1.691   8.345  -7.155
  140   HG22  THR  17          1HG2      THR  17  -3.118   7.310  -7.141
  141   HG23  THR  17          2HG2      THR  17  -2.524   7.973  -8.664
  142    H    HIS  18           H        HIS  18   1.530   6.500  -6.723
  143    HA   HIS  18           HA       HIS  18   2.644   9.184  -6.957
  144    HB2  HIS  18           2HB      HIS  18   1.122   8.250  -4.521
  145    HB3  HIS  18           3HB      HIS  18   2.345   9.511  -4.423
  146    HD1  HIS  18           HD1      HIS  18  -1.108   8.847  -5.690
  147    HD2  HIS  18           HD2      HIS  18   1.583  11.998  -5.483
  148    HE1  HIS  18           HE1      HIS  18  -2.442  10.897  -6.232
  149    HE2  HIS  18           HE2      HIS  18  -0.765  12.767  -6.250
  150    HA   PRO  19           HA       PRO  19   6.256   6.505  -6.283
  151    HB2  PRO  19           2HB      PRO  19   7.401   9.249  -5.882
  152    HB3  PRO  19           3HB      PRO  19   8.046   7.887  -6.807
  153    HG2  PRO  19           2HG      PRO  19   6.861   9.901  -8.064
  154    HG3  PRO  19           3HG      PRO  19   6.583   8.228  -8.584
  155    HD2  PRO  19           2HD      PRO  19   4.784  10.063  -7.061
  156    HD3  PRO  19           3HD      PRO  19   4.374   8.810  -8.252
  157    H    GLY  20           H        GLY  20   5.333   9.203  -4.151
  158    HA2  GLY  20           2HA      GLY  20   6.974   8.684  -1.961
  159    HA3  GLY  20           3HA      GLY  20   5.390   9.437  -1.866
  160    H    VAL  21           H        VAL  21   4.128   6.945  -2.992
  161    HA   VAL  21           HA       VAL  21   3.350   5.665  -0.652
  162    HB   VAL  21           HB       VAL  21   3.348   4.587  -3.484
  163   HG11  VAL  21          1HG1      VAL  21   3.165   2.737  -1.913
  164   HG12  VAL  21          2HG1      VAL  21   1.622   3.011  -2.720
  165   HG13  VAL  21          3HG1      VAL  21   1.858   3.563  -1.061
  166   HG21  VAL  21          3HG2      VAL  21   1.176   5.933  -1.864
  167   HG22  VAL  21          1HG2      VAL  21   0.982   5.262  -3.485
  168   HG23  VAL  21          2HG2      VAL  21   2.052   6.639  -3.222
  169    H    ALA  22           H        ALA  22   6.088   4.974  -2.761
  170    HA   ALA  22           HA       ALA  22   6.802   2.428  -1.906
  171    HB1  ALA  22           3HB      ALA  22   8.667   4.690  -2.633
  172    HB2  ALA  22           1HB      ALA  22   7.888   3.586  -3.768
  173    HB3  ALA  22           2HB      ALA  22   9.073   2.973  -2.615
  174    H    GLY  23           H        GLY  23   7.696   5.561  -0.468
  175    HA2  GLY  23           2HA      GLY  23   9.277   4.492   1.641
  176    HA3  GLY  23           3HA      GLY  23   8.579   6.104   1.588
  177    H    VAL  24           H        VAL  24   5.867   5.465   1.470
  178    HA   VAL  24           HA       VAL  24   5.179   5.089   4.154
  179    HB   VAL  24           HB       VAL  24   3.421   4.618   1.730
  180   HG11  VAL  24          1HG1      VAL  24   2.446   3.687   3.769
  181   HG12  VAL  24          2HG1      VAL  24   1.551   5.114   3.246
  182   HG13  VAL  24          3HG1      VAL  24   2.678   5.228   4.597
  183   HG21  VAL  24          3HG2      VAL  24   3.895   7.136   3.339
  184   HG22  VAL  24          1HG2      VAL  24   2.704   6.953   2.049
  185   HG23  VAL  24          2HG2      VAL  24   4.425   6.840   1.682
  186    H    LEU  25           H        LEU  25   4.868   2.777   1.440
  187    HA   LEU  25           HA       LEU  25   3.940   0.576   2.880
  188    HB2  LEU  25           2HB      LEU  25   5.734   0.595   0.444
  189    HB3  LEU  25           3HB      LEU  25   4.866  -0.808   1.036
  190    HG   LEU  25           HG       LEU  25   3.641   1.718  -0.085
  191   HD11  LEU  25          1HD1      LEU  25   3.705  -1.105  -1.156
  192   HD12  LEU  25          2HD1      LEU  25   4.626   0.264  -1.777
  193   HD13  LEU  25          3HD1      LEU  25   2.867   0.266  -1.889
  194   HD21  LEU  25          3HD2      LEU  25   2.275  -0.761   0.975
  195   HD22  LEU  25          1HD2      LEU  25   1.484   0.593   0.168
  196   HD23  LEU  25          2HD2      LEU  25   2.265   0.833   1.730
  197    H    ARG  26           H        ARG  26   7.319   1.449   2.111
  198    HA   ARG  26           HA       ARG  26   8.587  -0.676   3.417
  199    HB2  ARG  26           2HB      ARG  26   9.489   2.172   2.958
  200    HB3  ARG  26           3HB      ARG  26  10.541   0.926   3.622
  201    HG2  ARG  26           2HG      ARG  26  10.320  -0.384   1.587
  202    HG3  ARG  26           3HG      ARG  26   9.201   0.808   0.919
  203    HD2  ARG  26           2HD      ARG  26  11.519   1.051   0.058
  204    HD3  ARG  26           3HD      ARG  26  10.929   2.490   0.892
  205    HE   ARG  26           HE       ARG  26  12.349   0.806   2.677
  206   HH11  ARG  26          1HH1      ARG  26  12.855   3.042   0.102
  207   HH12  ARG  26          2HH1      ARG  26  14.421   3.496   0.672
  208   HH21  ARG  26          1HH2      ARG  26  14.339   1.419   3.404
  209   HH22  ARG  26          2HH2      ARG  26  15.248   2.599   2.518
  210    H    SER  27           H        SER  27   7.374   2.376   4.721
  211    HA   SER  27           HA       SER  27   8.531   2.223   7.285
  212    HB2  SER  27           2HB      SER  27   7.447   4.259   6.323
  213    HB3  SER  27           3HB      SER  27   5.875   3.499   6.570
  214    HG   SER  27           HG       SER  27   6.105   4.595   8.400
  215    H    TYR  28           H        TYR  28   5.444   0.956   6.059
  216    HA   TYR  28           HA       TYR  28   4.749  -0.205   8.636
  217    HB2  TYR  28           2HB      TYR  28   3.409  -0.376   5.925
  218    HB3  TYR  28           3HB      TYR  28   2.778  -1.126   7.386
  219    HD1  TYR  28           HD2      TYR  28   1.926   0.287   9.239
  220    HD2  TYR  28           HD1      TYR  28   3.161   1.983   5.533
  221    HE1  TYR  28           HE2      TYR  28   0.720   2.359   9.786
  222    HE2  TYR  28           HE1      TYR  28   1.959   4.054   6.075
  223    HH   TYR  28           HH       TYR  28   0.666   4.673   9.198
  224    H    ASN  29           H        ASN  29   6.971  -1.112   6.455
  225    HA   ASN  29           HA       ASN  29   8.041  -3.025   5.873
  226    HB2  ASN  29           2HB      ASN  29   7.731  -3.636   8.292
  227    HB3  ASN  29           3HB      ASN  29   6.251  -4.474   7.844
  228   HD21  ASN  29          1HD2      ASN  29   8.491  -5.650   9.092
  229   HD22  ASN  29          2HD2      ASN  29   9.134  -6.840   8.015
  230    H    LEU  30           H        LEU  30   6.582  -2.390   3.948
  231    HA   LEU  30           HA       LEU  30   5.183  -4.845   3.093
  232    HB2  LEU  30           2HB      LEU  30   4.431  -1.975   2.519
  233    HB3  LEU  30           3HB      LEU  30   3.776  -3.333   1.621
  234    HG   LEU  30           HG       LEU  30   3.454  -2.962   4.608
  235   HD11  LEU  30          1HD1      LEU  30   1.152  -2.318   4.123
  236   HD12  LEU  30          2HD1      LEU  30   1.480  -2.402   2.393
  237   HD13  LEU  30          3HD1      LEU  30   2.290  -1.190   3.385
  238   HD21  LEU  30          3HD2      LEU  30   3.339  -5.289   3.901
  239   HD22  LEU  30          1HD2      LEU  30   2.152  -4.874   2.663
  240   HD23  LEU  30          2HD2      LEU  30   1.741  -4.711   4.371
  241    H    GLY  31           H        GLY  31   7.943  -3.234   2.682
  242    HA2  GLY  31           2HA      GLY  31   8.173  -2.853  -0.117
  243    HA3  GLY  31           3HA      GLY  31   9.510  -3.087   0.997
  244    H    CYS  32           H        CYS  32   8.243  -5.716   1.814
  245    HA   CYS  32           HA       CYS  32   9.721  -7.381   0.038
  246    HB2  CYS  32           2HB      CYS  32   7.745  -8.149   2.199
  247    HB3  CYS  32           3HB      CYS  32   8.895  -9.236   1.426
  248    HG   CYS  32           HG       CYS  32   9.632  -8.434   4.105
  249    H    ILE  33           H        ILE  33   6.725  -6.011  -0.434
  250    HA   ILE  33           HA       ILE  33   5.092  -8.022  -1.441
  251    HB   ILE  33           HB       ILE  33   4.133  -6.265  -2.975
  252   HG12  ILE  33          2HG1      ILE  33   6.229  -4.525  -1.639
  253   HG13  ILE  33          3HG1      ILE  33   6.181  -4.958  -3.343
  254   HG21  ILE  33          1HG2      ILE  33   4.420  -5.577  -0.051
  255   HG22  ILE  33          2HG2      ILE  33   3.212  -6.641  -0.772
  256   HG23  ILE  33          3HG2      ILE  33   3.197  -4.917  -1.137
  257   HD11  ILE  33          3HD1      ILE  33   5.392  -2.694  -2.980
  258   HD12  ILE  33          1HD1      ILE  33   4.140  -3.287  -1.889
  259   HD13  ILE  33          2HD1      ILE  33   4.096  -3.716  -3.600
  260    H    GLY  34           H        GLY  34   7.851  -6.457  -2.982
  261    HA2  GLY  34           2HA      GLY  34   7.478  -7.510  -5.589
  262    HA3  GLY  34           3HA      GLY  34   9.002  -6.960  -4.911
  263    H    CYS  35           H        CYS  35   9.012  -8.822  -2.702
  264    HA   CYS  35           HA       CYS  35  10.207 -11.076  -4.025
  265    HB2  CYS  35           2HB      CYS  35   9.675 -10.615  -1.077
  266    HB3  CYS  35           3HB      CYS  35  10.721 -11.862  -1.748
  267    HG   CYS  35           HG       CYS  35  12.851 -10.442  -1.838
  268    H    MET  36           H        MET  36   7.385 -10.675  -1.877
  269    HA   MET  36           HA       MET  36   6.561 -13.413  -2.126
  270    HB2  MET  36           2HB      MET  36   4.567 -12.713  -0.874
  271    HB3  MET  36           3HB      MET  36   6.038 -12.122  -0.118
  272    HG2  MET  36           2HG      MET  36   5.650  -9.920  -1.198
  273    HG3  MET  36           3HG      MET  36   4.113 -10.532  -1.803
  274    HE1  MET  36           3HE      MET  36   2.162 -11.178   1.551
  275    HE2  MET  36           1HE      MET  36   3.201 -12.342   0.729
  276    HE3  MET  36           2HE      MET  36   2.121 -11.310  -0.207
  277    H    GLY  37           H        GLY  37   6.335 -10.835  -4.244
  278    HA2  GLY  37           2HA      GLY  37   5.332 -10.666  -6.307
  279    HA3  GLY  37           3HA      GLY  37   4.700 -12.286  -6.076
  280    H    ALA  38           H        ALA  38   4.052  -9.588  -3.909
  281    HA   ALA  38           HA       ALA  38   1.194  -9.977  -4.260
  282    HB1  ALA  38           3HB      ALA  38   2.166  -9.718  -2.021
  283    HB2  ALA  38           1HB      ALA  38   0.957  -8.479  -2.364
  284    HB3  ALA  38           2HB      ALA  38   2.673  -8.080  -2.437
  285    H    GLN  39           H        GLN  39   2.915  -8.617  -6.386
  286    HA   GLN  39           HA       GLN  39   2.346  -5.854  -6.461
  287    HB2  GLN  39           2HB      GLN  39   2.950  -7.758  -8.736
  288    HB3  GLN  39           3HB      GLN  39   2.959  -6.004  -8.866
  289    HG2  GLN  39           2HG      GLN  39   4.773  -7.652  -7.105
  290    HG3  GLN  39           3HG      GLN  39   5.215  -6.911  -8.643
  291   HE21  GLN  39          1HE2      GLN  39   4.505  -6.338  -5.293
  292   HE22  GLN  39          2HE2      GLN  39   5.076  -4.712  -5.247
  293    H    ASN  40           H        ASN  40   0.510  -8.640  -7.616
  294    HA   ASN  40           HA       ASN  40  -1.482  -6.906  -8.890
  295    HB2  ASN  40           2HB      ASN  40  -1.515  -9.927  -8.714
  296    HB3  ASN  40           3HB      ASN  40  -2.431  -8.908  -9.817
  297   HD21  ASN  40          1HD2      ASN  40   0.637 -10.327  -9.116
  298   HD22  ASN  40          2HD2      ASN  40   1.379  -9.969 -10.634
  299    H    GLU  41           H        GLU  41  -0.948  -7.669  -5.815
  300    HA   GLU  41           HA       GLU  41  -3.677  -8.511  -5.144
  301    HB2  GLU  41           2HB      GLU  41  -1.791  -9.807  -4.208
  302    HB3  GLU  41           3HB      GLU  41  -1.219  -8.363  -3.382
  303    HG2  GLU  41           2HG      GLU  41  -2.992  -8.368  -1.874
  304    HG3  GLU  41           3HG      GLU  41  -3.994  -9.389  -2.904
  305    H    SER  42           H        SER  42  -4.944  -7.408  -3.614
  306    HA   SER  42           HA       SER  42  -4.807  -4.561  -3.830
  307    HB2  SER  42           2HB      SER  42  -6.869  -4.551  -2.520
  308    HB3  SER  42           3HB      SER  42  -6.949  -5.798  -3.763
  309    HG   SER  42           HG       SER  42  -7.671  -6.585  -1.756
  310    H    LEU  43           H        LEU  43  -4.751  -3.031  -2.093
  311    HA   LEU  43           HA       LEU  43  -2.560  -3.236  -0.430
  312    HB2  LEU  43           2HB      LEU  43  -4.994  -1.473  -0.162
  313    HB3  LEU  43           3HB      LEU  43  -3.534  -1.265   0.788
  314    HG   LEU  43           HG       LEU  43  -3.702  -1.049  -2.226
  315   HD11  LEU  43          1HD1      LEU  43  -3.359   1.106  -0.142
  316   HD12  LEU  43          2HD1      LEU  43  -4.821   0.803  -1.080
  317   HD13  LEU  43          3HD1      LEU  43  -3.348   1.332  -1.892
  318   HD21  LEU  43          3HD2      LEU  43  -1.402  -0.179  -2.054
  319   HD22  LEU  43          1HD2      LEU  43  -1.526  -1.859  -1.529
  320   HD23  LEU  43          2HD2      LEU  43  -1.398  -0.568  -0.333
  321    H    GLU  44           H        GLU  44  -5.976  -3.807   0.493
  322    HA   GLU  44           HA       GLU  44  -5.427  -4.082   3.258
  323    HB2  GLU  44           2HB      GLU  44  -7.683  -3.588   2.484
  324    HB3  GLU  44           3HB      GLU  44  -7.770  -5.147   1.671
  325    HG2  GLU  44           2HG      GLU  44  -7.707  -6.317   3.770
  326    HG3  GLU  44           3HG      GLU  44  -7.405  -4.820   4.648
  327    H    GLN  45           H        GLN  45  -5.758  -6.532   0.688
  328    HA   GLN  45           HA       GLN  45  -5.600  -8.800   2.331
  329    HB2  GLN  45           2HB      GLN  45  -4.751  -8.403  -0.544
  330    HB3  GLN  45           3HB      GLN  45  -4.801  -9.973   0.251
  331    HG2  GLN  45           2HG      GLN  45  -7.200  -9.727   0.617
  332    HG3  GLN  45           3HG      GLN  45  -7.162  -8.134  -0.136
  333   HE21  GLN  45          1HE2      GLN  45  -8.639  -8.766  -1.717
  334   HE22  GLN  45          2HE2      GLN  45  -8.219  -9.838  -3.003
  335    H    GLY  46           H        GLY  46  -2.957  -7.176   0.522
  336    HA2  GLY  46           2HA      GLY  46  -0.854  -8.725   1.598
  337    HA3  GLY  46           3HA      GLY  46  -0.681  -7.128   0.889
  338    H    ALA  47           H        ALA  47  -2.329  -5.712   2.765
  339    HA   ALA  47           HA       ALA  47  -0.489  -5.106   4.789
  340    HB1  ALA  47           3HB      ALA  47  -2.210  -3.539   4.050
  341    HB2  ALA  47           1HB      ALA  47  -2.270  -3.769   5.798
  342    HB3  ALA  47           2HB      ALA  47  -3.461  -4.559   4.762
  343    H    ASN  48           H        ASN  48  -3.612  -6.830   5.134
  344    HA   ASN  48           HA       ASN  48  -3.209  -7.607   7.813
  345    HB2  ASN  48           2HB      ASN  48  -4.991  -8.715   5.645
  346    HB3  ASN  48           3HB      ASN  48  -4.973  -9.385   7.273
  347   HD21  ASN  48          1HD2      ASN  48  -5.813  -6.635   5.324
  348   HD22  ASN  48          2HD2      ASN  48  -6.761  -5.829   6.520
  349    H    ALA  49           H        ALA  49  -2.214  -9.124   4.790
  350    HA   ALA  49           HA       ALA  49  -1.344 -11.592   5.843
  351    HB1  ALA  49           3HB      ALA  49   0.030 -11.775   3.837
  352    HB2  ALA  49           1HB      ALA  49  -0.189 -10.055   3.512
  353    HB3  ALA  49           2HB      ALA  49  -1.570 -11.149   3.436
  354    H    HIS  50           H        HIS  50   0.070  -8.405   5.948
  355    HA   HIS  50           HA       HIS  50   2.529  -9.443   7.201
  356    HB2  HIS  50           2HB      HIS  50   1.797  -6.732   6.080
  357    HB3  HIS  50           3HB      HIS  50   3.252  -7.000   7.031
  358    HD1  HIS  50           HD1      HIS  50   4.993  -6.698   5.283
  359    HD2  HIS  50           HD2      HIS  50   2.047  -9.374   4.103
  360    HE1  HIS  50           HE1      HIS  50   5.811  -7.686   3.133
  361    HE2  HIS  50           HE2      HIS  50   4.143  -9.484   2.590
  362    H    GLY  51           H        GLY  51  -0.377  -8.947   8.334
  363    HA2  GLY  51           2HA      GLY  51  -1.267  -8.429  10.387
  364    HA3  GLY  51           3HA      GLY  51   0.376  -8.426  11.003
  365    H    LEU  52           H        LEU  52  -1.448  -6.334   8.748
  366    HA   LEU  52           HA       LEU  52  -0.696  -4.006  10.409
  367    HB2  LEU  52           2HB      LEU  52  -0.833  -4.101   7.390
  368    HB3  LEU  52           3HB      LEU  52  -0.425  -2.698   8.361
  369    HG   LEU  52           HG       LEU  52   1.219  -5.233   8.200
  370   HD11  LEU  52          1HD1      LEU  52   2.802  -3.881   6.921
  371   HD12  LEU  52          2HD1      LEU  52   1.682  -2.520   6.964
  372   HD13  LEU  52          3HD1      LEU  52   1.244  -3.994   6.099
  373   HD21  LEU  52          3HD2      LEU  52   1.787  -2.581   9.530
  374   HD22  LEU  52          1HD2      LEU  52   2.917  -3.928   9.394
  375   HD23  LEU  52          2HD2      LEU  52   1.446  -4.106  10.351
  376    H    ASN  53           H        ASN  53  -2.068  -2.094  10.080
  377    HA   ASN  53           HA       ASN  53  -4.882  -2.814   9.596
  378    HB2  ASN  53           2HB      ASN  53  -4.394  -1.807  11.778
  379    HB3  ASN  53           3HB      ASN  53  -3.670  -0.407  10.991
  380   HD21  ASN  53          1HD2      ASN  53  -5.110   1.022  11.924
  381   HD22  ASN  53          2HD2      ASN  53  -6.775   1.095  11.479
  382    H    VAL  54           H        VAL  54  -5.268  -2.588   7.439
  383    HA   VAL  54           HA       VAL  54  -3.954  -0.851   5.690
  384    HB   VAL  54           HB       VAL  54  -5.233  -2.833   4.957
  385   HG11  VAL  54          1HG1      VAL  54  -7.678  -1.137   5.483
  386   HG12  VAL  54          2HG1      VAL  54  -7.195  -2.569   6.390
  387   HG13  VAL  54          3HG1      VAL  54  -7.663  -2.716   4.696
  388   HG21  VAL  54          3HG2      VAL  54  -4.606  -1.133   3.320
  389   HG22  VAL  54          1HG2      VAL  54  -6.097  -0.248   3.642
  390   HG23  VAL  54          2HG2      VAL  54  -6.162  -1.848   2.900
  391    H    GLU  55           H        GLU  55  -6.789  -0.277   7.686
  392    HA   GLU  55           HA       GLU  55  -7.881   1.967   6.446
  393    HB2  GLU  55           2HB      GLU  55  -7.692   1.513   9.435
  394    HB3  GLU  55           3HB      GLU  55  -8.864   2.519   8.598
  395    HG2  GLU  55           2HG      GLU  55  -8.645  -0.484   8.454
  396    HG3  GLU  55           3HG      GLU  55  -9.890   0.445   9.285
  397    H    ASP  56           H        ASP  56  -5.303   1.804   8.883
  398    HA   ASP  56           HA       ASP  56  -4.867   4.614   9.024
  399    HB2  ASP  56           2HB      ASP  56  -4.233   3.032  10.834
  400    HB3  ASP  56           3HB      ASP  56  -2.987   2.359   9.786
  401    H    ILE  57           H        ILE  57  -3.371   1.985   7.187
  402    HA   ILE  57           HA       ILE  57  -1.278   3.421   5.993
  403    HB   ILE  57           HB       ILE  57  -2.856   1.117   4.812
  404   HG12  ILE  57          2HG1      ILE  57  -0.303   1.102   6.457
  405   HG13  ILE  57          3HG1      ILE  57  -1.892   0.603   7.030
  406   HG21  ILE  57          1HG2      ILE  57  -1.558   2.242   3.099
  407   HG22  ILE  57          2HG2      ILE  57  -0.815   0.690   3.481
  408   HG23  ILE  57          3HG2      ILE  57  -0.113   2.181   4.110
  409   HD11  ILE  57          3HD1      ILE  57  -1.902  -1.209   5.382
  410   HD12  ILE  57          1HD1      ILE  57  -0.531  -1.318   6.487
  411   HD13  ILE  57          2HD1      ILE  57  -0.296  -0.718   4.846
  412    H    LEU  58           H        LEU  58  -4.621   2.879   4.843
  413    HA   LEU  58           HA       LEU  58  -4.486   4.253   2.421
  414    HB2  LEU  58           2HB      LEU  58  -6.817   4.026   4.331
  415    HB3  LEU  58           3HB      LEU  58  -6.942   4.581   2.671
  416    HG   LEU  58           HG       LEU  58  -6.112   1.813   3.565
  417   HD11  LEU  58          1HD1      LEU  58  -8.207   1.094   2.556
  418   HD12  LEU  58          2HD1      LEU  58  -8.606   2.766   2.161
  419   HD13  LEU  58          3HD1      LEU  58  -8.498   2.260   3.848
  420   HD21  LEU  58          3HD2      LEU  58  -6.170   1.242   1.173
  421   HD22  LEU  58          1HD2      LEU  58  -4.922   2.434   1.539
  422   HD23  LEU  58          2HD2      LEU  58  -6.432   2.943   0.783
  423    H    ARG  59           H        ARG  59  -5.251   5.488   5.660
  424    HA   ARG  59           HA       ARG  59  -5.703   8.163   5.116
  425    HB2  ARG  59           2HB      ARG  59  -5.977   7.350   7.353
  426    HB3  ARG  59           3HB      ARG  59  -4.300   6.831   7.441
  427    HG2  ARG  59           2HG      ARG  59  -3.730   9.335   7.153
  428    HG3  ARG  59           3HG      ARG  59  -5.415   9.611   7.596
  429    HD2  ARG  59           2HD      ARG  59  -3.824   9.727   9.515
  430    HD3  ARG  59           3HD      ARG  59  -5.097   8.523   9.715
  431    HE   ARG  59           HE       ARG  59  -3.483   6.917   9.803
  432   HH11  ARG  59          1HH1      ARG  59  -2.092   9.693   8.281
  433   HH12  ARG  59          2HH1      ARG  59  -0.538   8.946   8.116
  434   HH21  ARG  59          1HH2      ARG  59  -1.497   5.996   9.583
  435   HH22  ARG  59          2HH2      ARG  59  -0.208   6.883   8.847
  436    H    ASP  60           H        ASP  60  -2.544   6.632   5.821
  437    HA   ASP  60           HA       ASP  60  -1.035   9.007   5.493
  438    HB2  ASP  60           2HB      ASP  60  -0.518   6.633   6.625
  439    HB3  ASP  60           3HB      ASP  60   0.268   6.350   5.076
  440    H    LEU  61           H        LEU  61  -1.990   6.462   3.255
  441    HA   LEU  61           HA       LEU  61  -0.301   7.189   1.094
  442    HB2  LEU  61           2HB      LEU  61  -2.955   5.749   1.109
  443    HB3  LEU  61           3HB      LEU  61  -1.939   5.921  -0.311
  444    HG   LEU  61           HG       LEU  61  -1.217   4.436   2.223
  445   HD11  LEU  61          1HD1      LEU  61  -2.868   3.267   0.873
  446   HD12  LEU  61          2HD1      LEU  61  -1.310   2.444   0.808
  447   HD13  LEU  61          3HD1      LEU  61  -1.843   3.433  -0.552
  448   HD21  LEU  61          3HD2      LEU  61   0.764   5.460   1.265
  449   HD22  LEU  61          1HD2      LEU  61   0.357   4.818  -0.327
  450   HD23  LEU  61          2HD2      LEU  61   0.791   3.720   0.982
  451    H    ASN  62           H        ASN  62  -3.746   7.985   1.709
  452    HA   ASN  62           HA       ASN  62  -3.953   9.737  -0.528
  453    HB2  ASN  62           2HB      ASN  62  -5.661   9.434   1.950
  454    HB3  ASN  62           3HB      ASN  62  -6.040  10.578   0.664
  455   HD21  ASN  62          1HD2      ASN  62  -5.900   7.232   1.558
  456   HD22  ASN  62          2HD2      ASN  62  -6.737   6.621   0.177
  457    H    ALA  63           H        ALA  63  -2.882  10.162   2.759
  458    HA   ALA  63           HA       ALA  63  -2.920  12.927   3.043
  459    HB1  ALA  63           3HB      ALA  63  -2.309  11.405   4.846
  460    HB2  ALA  63           1HB      ALA  63  -1.063  12.632   4.617
  461    HB3  ALA  63           2HB      ALA  63  -0.811  10.995   4.010
  462    H    LEU  64           H        LEU  64  -0.792  10.920   1.124
  463    HA   LEU  64           HA       LEU  64   1.259  12.773   0.568
  464    HB2  LEU  64           2HB      LEU  64   0.182  10.534  -1.153
  465    HB3  LEU  64           3HB      LEU  64   1.703  11.364  -1.419
  466    HG   LEU  64           HG       LEU  64   1.057   9.718   1.036
  467   HD11  LEU  64          1HD1      LEU  64   2.578   8.053   0.108
  468   HD12  LEU  64          2HD1      LEU  64   2.773   9.028  -1.350
  469   HD13  LEU  64          3HD1      LEU  64   1.204   8.318  -0.965
  470   HD21  LEU  64          3HD2      LEU  64   3.633  10.992   0.098
  471   HD22  LEU  64          1HD2      LEU  64   3.473   9.901   1.476
  472   HD23  LEU  64          2HD2      LEU  64   2.674  11.472   1.500
  473    H    ALA  65           H        ALA  65  -1.983  12.530  -0.659
  474    HA   ALA  65           HA       ALA  65  -1.426  14.476  -2.797
  475    HB1  ALA  65           3HB      ALA  65  -3.931  12.867  -2.293
  476    HB2  ALA  65           1HB      ALA  65  -2.648  12.434  -3.424
  477    HB3  ALA  65           2HB      ALA  65  -3.609  13.888  -3.695
  478    H    LEU  66           H        LEU  66  -3.079  14.141   0.260
  479    HA   LEU  66           HA       LEU  66  -4.656  16.549  -0.029
  480    HB2  LEU  66           2HB      LEU  66  -4.104  14.832   2.396
  481    HB3  LEU  66           3HB      LEU  66  -5.267  16.146   2.340
  482    HG   LEU  66           HG       LEU  66  -5.413  13.598   0.709
  483   HD11  LEU  66          1HD1      LEU  66  -7.070  14.506   3.066
  484   HD12  LEU  66          2HD1      LEU  66  -5.851  13.231   3.089
  485   HD13  LEU  66          3HD1      LEU  66  -7.313  13.034   2.124
  486   HD21  LEU  66          3HD2      LEU  66  -7.666  14.410   0.097
  487   HD22  LEU  66          1HD2      LEU  66  -6.380  15.452  -0.511
  488   HD23  LEU  66          2HD2      LEU  66  -7.316  15.939   0.902
  489    H    GLU  67           H        GLU  67  -1.460  15.838   0.981
  490    HA   GLU  67           HA       GLU  67   0.261  17.126   1.710
  491    HB2  GLU  67           2HB      GLU  67  -1.655  19.436   1.302
  492    HB3  GLU  67           3HB      GLU  67   0.055  19.608   1.665
  493    HG2  GLU  67           2HG      GLU  67   0.635  18.536  -0.437
  494    HG3  GLU  67           3HG      GLU  67  -1.073  18.284  -0.802
  495    H    HIS  68           H        HIS  68  -2.391  19.047   3.088
  496    HA   HIS  68           HA       HIS  68  -2.548  20.045   5.113
  497    HB2  HIS  68           2HB      HIS  68  -3.236  18.527   6.892
  498    HB3  HIS  68           3HB      HIS  68  -3.957  18.102   5.350
  499    HD1  HIS  68           HD1      HIS  68  -2.175  16.692   8.163
  500    HD2  HIS  68           HD2      HIS  68  -2.676  15.722   4.156
  501    HE1  HIS  68           HE1      HIS  68  -1.526  14.283   7.968
  502    HE2  HIS  68           HE2      HIS  68  -1.571  13.822   5.508
  503    H    HIS  69           H        HIS  69   0.383  19.269   4.387
  504    HA   HIS  69           HA       HIS  69   1.471  20.031   7.027
  505    HB2  HIS  69           2HB      HIS  69   2.705  18.604   4.673
  506    HB3  HIS  69           3HB      HIS  69   3.719  19.465   5.821
  507    HD1  HIS  69           HD1      HIS  69   4.428  18.205   7.822
  508    HD2  HIS  69           HD2      HIS  69   1.156  16.446   5.960
  509    HE1  HIS  69           HE1      HIS  69   4.074  16.024   9.005
  510    HE2  HIS  69           HE2      HIS  69   2.184  14.916   7.777
  511    H    HIS  70           H        HIS  70   2.280  20.495   3.604
  512    HA   HIS  70           HA       HIS  70   3.348  23.096   3.852
  513    HB2  HIS  70           2HB      HIS  70   3.887  21.616   1.981
  514    HB3  HIS  70           3HB      HIS  70   2.207  21.612   1.463
  515    HD1  HIS  70           HD1      HIS  70   1.884  23.011  -0.528
  516    HD2  HIS  70           HD2      HIS  70   4.861  24.537   1.935
  517    HE1  HIS  70           HE1      HIS  70   2.732  25.058  -1.695
  518    HE2  HIS  70           HE2      HIS  70   4.648  25.856  -0.280
  519    H    HIS  71           H        HIS  71   0.132  22.014   3.942
  520    HA   HIS  71           HA       HIS  71  -0.881  24.745   3.840
  521    HB2  HIS  71           2HB      HIS  71  -1.095  23.979   1.522
  522    HB3  HIS  71           3HB      HIS  71  -1.949  22.537   2.059
  523    HD1  HIS  71           HD1      HIS  71  -2.403  26.310   2.159
  524    HD2  HIS  71           HD2      HIS  71  -4.654  22.816   2.064
  525    HE1  HIS  71           HE1      HIS  71  -4.787  27.052   1.930
  526    HE2  HIS  71           HE2      HIS  71  -6.122  24.928   1.773
  527    H    HIS  72           H        HIS  72  -1.681  24.788   5.898
  528    HA   HIS  72           HA       HIS  72  -3.986  23.140   6.496
  529    HB2  HIS  72           2HB      HIS  72  -2.144  21.682   7.240
  530    HB3  HIS  72           3HB      HIS  72  -1.532  22.971   8.271
  531    HD1  HIS  72           HD1      HIS  72  -2.407  23.009  10.615
  532    HD2  HIS  72           HD2      HIS  72  -4.803  20.736   8.088
  533    HE1  HIS  72           HE1      HIS  72  -4.125  21.939  12.096
  534    HE2  HIS  72           HE2      HIS  72  -5.555  20.563  10.554
  535    H    HIS  73           H        HIS  73  -5.430  24.563   7.215
  536    HA   HIS  73           HA       HIS  73  -4.585  26.942   8.692
  537    HB2  HIS  73           2HB      HIS  73  -7.226  26.113   7.480
  538    HB3  HIS  73           3HB      HIS  73  -7.059  27.542   8.494
  539    HD1  HIS  73           HD1      HIS  73  -6.404  26.282   5.058
  540    HD2  HIS  73           HD2      HIS  73  -5.533  29.646   7.340
  541    HE1  HIS  73           HE1      HIS  73  -5.615  28.018   3.429
  542    HE2  HIS  73           HE2      HIS  73  -4.951  29.985   4.841
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1 -14.679  13.601  -0.309
    2    H2   MET   1           2H       MET   1 -16.234  14.107   0.101
    3    H3   MET   1           3H       MET   1 -15.984  13.240  -1.326
    4    HA   MET   1           HA       MET   1 -15.599  12.216   1.435
    5    HB2  MET   1           2HB      MET   1 -17.561  10.845   1.045
    6    HB3  MET   1           3HB      MET   1 -17.970  12.535   0.779
    7    HG2  MET   1           2HG      MET   1 -17.358  10.528  -1.389
    8    HG3  MET   1           3HG      MET   1 -18.971  11.042  -0.896
    9    HE1  MET   1           3HE      MET   1 -20.040  13.337  -1.427
   10    HE2  MET   1           1HE      MET   1 -19.152  14.720  -2.067
   11    HE3  MET   1           2HE      MET   1 -18.790  14.115  -0.453
   12    H    THR   2           H        THR   2 -14.246  12.087  -1.536
   13    HA   THR   2           HA       THR   2 -14.113   9.161  -1.769
   14    HB   THR   2           HB       THR   2 -13.162  11.282  -3.715
   15    HG1  THR   2           HG1      THR   2 -15.629  10.008  -3.311
   16   HG21  THR   2          3HG2      THR   2 -13.117   9.440  -5.351
   17   HG22  THR   2          1HG2      THR   2 -13.541   8.297  -4.077
   18   HG23  THR   2          2HG2      THR   2 -11.995   9.147  -4.022
   19    H    GLN   3           H        GLN   3 -12.262   7.998  -1.564
   20    HA   GLN   3           HA       GLN   3  -9.779   9.406  -0.839
   21    HB2  GLN   3           2HB      GLN   3 -10.537   6.485  -0.521
   22    HB3  GLN   3           3HB      GLN   3  -9.008   7.191  -0.022
   23    HG2  GLN   3           2HG      GLN   3 -10.182   8.600   1.601
   24    HG3  GLN   3           3HG      GLN   3 -11.719   7.897   1.101
   25   HE21  GLN   3          1HE2      GLN   3 -10.567   5.213   0.812
   26   HE22  GLN   3          2HE2      GLN   3 -10.349   4.624   2.415
   27    H    LYS   4           H        LYS   4  -8.011   9.348  -2.165
   28    HA   LYS   4           HA       LYS   4  -8.196   8.310  -4.815
   29    HB2  LYS   4           2HB      LYS   4  -5.826   9.343  -3.235
   30    HB3  LYS   4           3HB      LYS   4  -5.741   8.894  -4.933
   31    HG2  LYS   4           2HG      LYS   4  -7.483  11.070  -3.776
   32    HG3  LYS   4           3HG      LYS   4  -5.965  11.311  -4.643
   33    HD2  LYS   4           2HD      LYS   4  -8.461  10.038  -5.791
   34    HD3  LYS   4           3HD      LYS   4  -7.931  11.695  -6.084
   35    HE2  LYS   4           2HE      LYS   4  -5.895  10.867  -7.153
   36    HE3  LYS   4           3HE      LYS   4  -6.383   9.205  -6.820
   37    HZ1  LYS   4           3HZ      LYS   4  -8.305   9.513  -8.240
   38    HZ2  LYS   4           1HZ      LYS   4  -6.884   9.846  -9.095
   39    HZ3  LYS   4           2HZ      LYS   4  -7.858  11.115  -8.549
   40    H    PHE   5           H        PHE   5  -6.366   7.297  -1.947
   41    HA   PHE   5           HA       PHE   5  -5.772   4.715  -3.215
   42    HB2  PHE   5           2HB      PHE   5  -4.772   5.932  -0.624
   43    HB3  PHE   5           3HB      PHE   5  -4.291   4.354  -1.241
   44    HD1  PHE   5           HD1      PHE   5  -4.099   7.989  -1.808
   45    HD2  PHE   5           HD2      PHE   5  -2.679   4.155  -3.009
   46    HE1  PHE   5           HE1      PHE   5  -2.309   9.059  -3.114
   47    HE2  PHE   5           HE2      PHE   5  -0.889   5.223  -4.309
   48    HZ   PHE   5           HZ       PHE   5  -0.702   7.678  -4.366
   49    H    THR   6           H        THR   6  -7.038   3.034  -2.845
   50    HA   THR   6           HA       THR   6  -8.745   2.992  -0.425
   51    HB   THR   6           HB       THR   6 -10.164   3.520  -2.308
   52    HG1  THR   6           HG1      THR   6 -11.628   1.872  -2.050
   53   HG21  THR   6          3HG2      THR   6  -8.706   2.684  -4.105
   54   HG22  THR   6          1HG2      THR   6 -10.355   2.074  -4.263
   55   HG23  THR   6          2HG2      THR   6  -9.084   1.028  -3.631
   56    H    LYS   7           H        LYS   7  -9.381   0.876   0.340
   57    HA   LYS   7           HA       LYS   7  -7.306  -1.008   0.459
   58    HB2  LYS   7           2HB      LYS   7  -8.930  -2.482   1.566
   59    HB3  LYS   7           3HB      LYS   7  -9.032  -0.837   2.178
   60    HG2  LYS   7           2HG      LYS   7 -11.039  -0.425   0.921
   61    HG3  LYS   7           3HG      LYS   7 -10.890  -1.976   0.096
   62    HD2  LYS   7           2HD      LYS   7 -12.571  -2.112   1.846
   63    HD3  LYS   7           3HD      LYS   7 -11.194  -3.138   2.244
   64    HE2  LYS   7           2HE      LYS   7 -10.340  -1.332   3.729
   65    HE3  LYS   7           3HE      LYS   7 -11.801  -0.406   3.384
   66    HZ1  LYS   7           3HZ      LYS   7 -11.962  -1.633   5.469
   67    HZ2  LYS   7           1HZ      LYS   7 -11.728  -3.090   4.649
   68    HZ3  LYS   7           2HZ      LYS   7 -13.118  -2.169   4.361
   69    H    ASP   8           H        ASP   8  -9.740  -0.563  -1.911
   70    HA   ASP   8           HA       ASP   8  -9.956  -3.216  -2.919
   71    HB2  ASP   8           2HB      ASP   8 -11.725  -1.628  -3.300
   72    HB3  ASP   8           3HB      ASP   8 -10.628  -0.517  -4.108
   73    H    MET   9           H        MET   9  -7.840  -0.502  -3.745
   74    HA   MET   9           HA       MET   9  -6.959  -1.639  -6.233
   75    HB2  MET   9           2HB      MET   9  -5.453   0.257  -6.362
   76    HB3  MET   9           3HB      MET   9  -7.040   0.800  -5.835
   77    HG2  MET   9           2HG      MET   9  -6.122   0.660  -3.466
   78    HG3  MET   9           3HG      MET   9  -4.532   0.520  -4.212
   79    HE1  MET   9           3HE      MET   9  -3.547   2.409  -5.883
   80    HE2  MET   9           1HE      MET   9  -4.362   3.939  -6.198
   81    HE3  MET   9           2HE      MET   9  -5.043   2.434  -6.817
   82    H    THR  10           H        THR  10  -4.789  -2.302  -6.752
   83    HA   THR  10           HA       THR  10  -3.612  -3.961  -4.683
   84    HB   THR  10           HB       THR  10  -2.218  -4.916  -6.414
   85    HG1  THR  10           HG1      THR  10  -2.288  -4.067  -8.553
   86   HG21  THR  10          3HG2      THR  10  -5.019  -4.480  -7.478
   87   HG22  THR  10          1HG2      THR  10  -4.544  -5.713  -6.307
   88   HG23  THR  10          2HG2      THR  10  -3.917  -5.772  -7.955
   89    H    PHE  11           H        PHE  11  -1.269  -4.054  -4.334
   90    HA   PHE  11           HA       PHE  11  -0.111  -1.659  -3.548
   91    HB2  PHE  11           2HB      PHE  11   1.233  -4.263  -4.316
   92    HB3  PHE  11           3HB      PHE  11   2.066  -2.927  -3.528
   93    HD1  PHE  11           HD1      PHE  11   1.189  -2.160  -1.254
   94    HD2  PHE  11           HD2      PHE  11   0.094  -5.871  -3.044
   95    HE1  PHE  11           HE1      PHE  11   0.504  -3.019   0.944
   96    HE2  PHE  11           HE2      PHE  11  -0.595  -6.729  -0.844
   97    HZ   PHE  11           HZ       PHE  11  -0.390  -5.304   1.153
   98    H    ALA  12           H        ALA  12   0.261  -3.383  -6.632
   99    HA   ALA  12           HA       ALA  12   2.248  -1.765  -7.779
  100    HB1  ALA  12           3HB      ALA  12   1.541  -2.683  -9.912
  101    HB2  ALA  12           1HB      ALA  12   0.016  -3.219  -9.203
  102    HB3  ALA  12           2HB      ALA  12   1.535  -3.944  -8.681
  103    H    GLN  13           H        GLN  13  -1.305  -1.540  -8.035
  104    HA   GLN  13           HA       GLN  13  -1.466   0.723  -9.660
  105    HB2  GLN  13           2HB      GLN  13  -3.353  -0.097  -7.435
  106    HB3  GLN  13           3HB      GLN  13  -3.726   1.041  -8.724
  107    HG2  GLN  13           2HG      GLN  13  -3.519  -0.715 -10.382
  108    HG3  GLN  13           3HG      GLN  13  -3.039  -1.867  -9.137
  109   HE21  GLN  13          1HE2      GLN  13  -5.572   0.554  -8.781
  110   HE22  GLN  13          2HE2      GLN  13  -6.877  -0.577  -8.684
  111    H    ALA  14           H        ALA  14  -1.296   0.498  -6.118
  112    HA   ALA  14           HA       ALA  14  -1.465   3.225  -5.510
  113    HB1  ALA  14           3HB      ALA  14  -1.656   1.475  -3.822
  114    HB2  ALA  14           1HB      ALA  14  -0.408   2.641  -3.377
  115    HB3  ALA  14           2HB      ALA  14   0.047   1.068  -4.033
  116    H    LEU  15           H        LEU  15   1.468   1.228  -5.974
  117    HA   LEU  15           HA       LEU  15   3.397   3.216  -5.674
  118    HB2  LEU  15           2HB      LEU  15   3.456   0.798  -7.491
  119    HB3  LEU  15           3HB      LEU  15   4.858   1.760  -7.063
  120    HG   LEU  15           HG       LEU  15   3.187   0.152  -5.121
  121   HD11  LEU  15          1HD1      LEU  15   5.946  -0.375  -6.226
  122   HD12  LEU  15          2HD1      LEU  15   4.479  -1.271  -6.626
  123   HD13  LEU  15          3HD1      LEU  15   5.125  -1.326  -4.987
  124   HD21  LEU  15          3HD2      LEU  15   4.149   2.103  -4.044
  125   HD22  LEU  15          1HD2      LEU  15   5.738   1.715  -4.707
  126   HD23  LEU  15          2HD2      LEU  15   4.990   0.646  -3.520
  127    H    GLN  16           H        GLN  16   1.495   2.356  -8.528
  128    HA   GLN  16           HA       GLN  16   2.922   4.103 -10.306
  129    HB2  GLN  16           2HB      GLN  16   0.239   2.738 -10.583
  130    HB3  GLN  16           3HB      GLN  16   1.022   3.645 -11.870
  131    HG2  GLN  16           2HG      GLN  16   2.098   1.159 -10.544
  132    HG3  GLN  16           3HG      GLN  16   1.361   1.254 -12.143
  133   HE21  GLN  16          1HE2      GLN  16   4.183   1.953 -10.253
  134   HE22  GLN  16          2HE2      GLN  16   5.224   2.319 -11.578
  135    H    THR  17           H        THR  17   0.394   4.597  -8.017
  136    HA   THR  17           HA       THR  17  -0.691   6.951  -9.323
  137    HB   THR  17           HB       THR  17  -1.236   5.902  -6.530
  138    HG1  THR  17           HG1      THR  17  -1.970   4.418  -8.035
  139   HG21  THR  17          3HG2      THR  17  -1.812   8.266  -6.711
  140   HG22  THR  17          1HG2      THR  17  -3.284   7.296  -6.670
  141   HG23  THR  17          2HG2      THR  17  -2.707   7.958  -8.198
  142    H    HIS  18           H        HIS  18   1.522   6.281  -6.635
  143    HA   HIS  18           HA       HIS  18   2.557   9.000  -6.832
  144    HB2  HIS  18           2HB      HIS  18   1.069   7.999  -4.444
  145    HB3  HIS  18           3HB      HIS  18   2.520   8.950  -4.144
  146    HD1  HIS  18           HD1      HIS  18  -0.816   9.244  -5.920
  147    HD2  HIS  18           HD2      HIS  18   2.191  11.646  -4.374
  148    HE1  HIS  18           HE1      HIS  18  -1.709  11.581  -6.020
  149    HE2  HIS  18           HE2      HIS  18   0.221  13.022  -5.318
  150    HA   PRO  19           HA       PRO  19   6.322   6.568  -6.457
  151    HB2  PRO  19           2HB      PRO  19   7.514   9.235  -5.866
  152    HB3  PRO  19           3HB      PRO  19   7.980   8.039  -7.081
  153    HG2  PRO  19           2HG      PRO  19   6.700  10.267  -7.793
  154    HG3  PRO  19           3HG      PRO  19   6.324   8.716  -8.571
  155    HD2  PRO  19           2HD      PRO  19   4.800  10.196  -6.456
  156    HD3  PRO  19           3HD      PRO  19   4.192   9.301  -7.864
  157    H    GLY  20           H        GLY  20   5.354   8.987  -4.066
  158    HA2  GLY  20           2HA      GLY  20   7.158   8.307  -2.010
  159    HA3  GLY  20           3HA      GLY  20   5.603   9.093  -1.786
  160    H    VAL  21           H        VAL  21   4.311   6.653  -3.120
  161    HA   VAL  21           HA       VAL  21   3.446   5.357  -0.810
  162    HB   VAL  21           HB       VAL  21   3.418   4.340  -3.664
  163   HG11  VAL  21          1HG1      VAL  21   3.131   2.479  -2.109
  164   HG12  VAL  21          2HG1      VAL  21   1.623   2.829  -2.950
  165   HG13  VAL  21          3HG1      VAL  21   1.840   3.352  -1.280
  166   HG21  VAL  21          3HG2      VAL  21   1.293   5.758  -2.043
  167   HG22  VAL  21          1HG2      VAL  21   1.096   5.138  -3.683
  168   HG23  VAL  21          2HG2      VAL  21   2.229   6.453  -3.367
  169    H    ALA  22           H        ALA  22   6.074   4.487  -3.024
  170    HA   ALA  22           HA       ALA  22   6.702   1.945  -2.101
  171    HB1  ALA  22           3HB      ALA  22   8.627   4.082  -3.034
  172    HB2  ALA  22           1HB      ALA  22   7.746   2.955  -4.066
  173    HB3  ALA  22           2HB      ALA  22   8.968   2.353  -2.944
  174    H    GLY  23           H        GLY  23   7.880   5.077  -0.864
  175    HA2  GLY  23           2HA      GLY  23   9.469   4.008   1.235
  176    HA3  GLY  23           3HA      GLY  23   8.872   5.658   1.135
  177    H    VAL  24           H        VAL  24   6.128   5.229   1.174
  178    HA   VAL  24           HA       VAL  24   5.545   5.031   3.903
  179    HB   VAL  24           HB       VAL  24   3.637   4.564   1.593
  180   HG11  VAL  24          1HG1      VAL  24   2.706   3.829   3.727
  181   HG12  VAL  24          2HG1      VAL  24   1.888   5.285   3.162
  182   HG13  VAL  24          3HG1      VAL  24   3.088   5.394   4.451
  183   HG21  VAL  24          3HG2      VAL  24   4.815   6.698   1.371
  184   HG22  VAL  24          1HG2      VAL  24   4.354   7.137   3.016
  185   HG23  VAL  24          2HG2      VAL  24   3.117   6.957   1.772
  186    H    LEU  25           H        LEU  25   4.922   2.609   1.337
  187    HA   LEU  25           HA       LEU  25   3.892   0.601   2.988
  188    HB2  LEU  25           2HB      LEU  25   5.433   0.339   0.402
  189    HB3  LEU  25           3HB      LEU  25   4.540  -0.967   1.163
  190    HG   LEU  25           HG       LEU  25   3.354   1.598   0.082
  191   HD11  LEU  25          1HD1      LEU  25   3.138  -1.242  -0.915
  192   HD12  LEU  25          2HD1      LEU  25   4.056   0.060  -1.673
  193   HD13  LEU  25          3HD1      LEU  25   2.299   0.161  -1.581
  194   HD21  LEU  25          3HD2      LEU  25   1.176   0.565   0.573
  195   HD22  LEU  25          1HD2      LEU  25   2.118   0.858   2.035
  196   HD23  LEU  25          2HD2      LEU  25   2.001  -0.773   1.374
  197    H    ARG  26           H        ARG  26   7.269   1.223   2.030
  198    HA   ARG  26           HA       ARG  26   8.458  -0.932   3.391
  199    HB2  ARG  26           2HB      ARG  26   9.512   1.827   2.726
  200    HB3  ARG  26           3HB      ARG  26  10.512   0.565   3.437
  201    HG2  ARG  26           2HG      ARG  26  10.287  -0.822   1.521
  202    HG3  ARG  26           3HG      ARG  26   9.014   0.199   0.849
  203    HD2  ARG  26           2HD      ARG  26  11.176   0.533  -0.279
  204    HD3  ARG  26           3HD      ARG  26  10.591   2.002   0.501
  205    HE   ARG  26           HE       ARG  26  12.207   1.054   2.386
  206   HH11  ARG  26          1HH1      ARG  26  12.712   1.207  -1.015
  207   HH12  ARG  26          2HH1      ARG  26  14.406   1.518  -0.859
  208   HH21  ARG  26          1HH2      ARG  26  14.366   1.463   2.577
  209   HH22  ARG  26          2HH2      ARG  26  15.332   1.685   1.155
  210    H    SER  27           H        SER  27   7.523   2.283   4.541
  211    HA   SER  27           HA       SER  27   8.555   2.069   7.172
  212    HB2  SER  27           2HB      SER  27   7.861   4.221   6.214
  213    HB3  SER  27           3HB      SER  27   6.187   3.673   6.154
  214    HG   SER  27           HG       SER  27   6.749   5.010   8.005
  215    H    TYR  28           H        TYR  28   5.601   0.913   5.692
  216    HA   TYR  28           HA       TYR  28   4.503   0.020   8.252
  217    HB2  TYR  28           2HB      TYR  28   3.429   0.180   5.450
  218    HB3  TYR  28           3HB      TYR  28   2.635  -0.845   6.642
  219    HD1  TYR  28           HD2      TYR  28   3.566   2.666   5.859
  220    HD2  TYR  28           HD1      TYR  28   1.264   0.083   8.339
  221    HE1  TYR  28           HE2      TYR  28   2.326   4.606   6.724
  222    HE2  TYR  28           HE1      TYR  28   0.020   2.015   9.207
  223    HH   TYR  28           HH       TYR  28   0.022   4.278   9.370
  224    H    ASN  29           H        ASN  29   6.894  -1.222   6.585
  225    HA   ASN  29           HA       ASN  29   7.858  -3.287   6.529
  226    HB2  ASN  29           2HB      ASN  29   6.925  -3.463   8.833
  227    HB3  ASN  29           3HB      ASN  29   5.469  -4.191   8.165
  228   HD21  ASN  29          1HD2      ASN  29   5.792  -6.071   9.369
  229   HD22  ASN  29          2HD2      ASN  29   7.020  -7.215   8.966
  230    H    LEU  30           H        LEU  30   5.748  -2.412   4.577
  231    HA   LEU  30           HA       LEU  30   4.999  -5.030   3.439
  232    HB2  LEU  30           2HB      LEU  30   4.009  -2.246   2.785
  233    HB3  LEU  30           3HB      LEU  30   3.483  -3.710   1.974
  234    HG   LEU  30           HG       LEU  30   3.071  -3.142   4.918
  235   HD11  LEU  30          1HD1      LEU  30   0.726  -2.781   4.346
  236   HD12  LEU  30          2HD1      LEU  30   1.100  -2.986   2.635
  237   HD13  LEU  30          3HD1      LEU  30   1.761  -1.614   3.524
  238   HD21  LEU  30          3HD2      LEU  30   3.207  -5.521   4.423
  239   HD22  LEU  30          1HD2      LEU  30   2.013  -5.341   3.137
  240   HD23  LEU  30          2HD2      LEU  30   1.551  -5.067   4.818
  241    H    GLY  31           H        GLY  31   7.670  -3.438   3.313
  242    HA2  GLY  31           2HA      GLY  31   7.987  -2.484   0.656
  243    HA3  GLY  31           3HA      GLY  31   9.282  -2.854   1.778
  244    H    CYS  32           H        CYS  32   7.994  -5.711   1.853
  245    HA   CYS  32           HA       CYS  32   9.841  -6.845  -0.008
  246    HB2  CYS  32           2HB      CYS  32   7.647  -8.180   1.591
  247    HB3  CYS  32           3HB      CYS  32   8.942  -9.016   0.743
  248    HG   CYS  32           HG       CYS  32  10.918  -7.579   2.368
  249    H    ILE  33           H        ILE  33   6.778  -5.602  -0.550
  250    HA   ILE  33           HA       ILE  33   5.395  -7.482  -2.024
  251    HB   ILE  33           HB       ILE  33   4.319  -5.568  -3.232
  252   HG12  ILE  33          2HG1      ILE  33   6.205  -3.887  -1.553
  253   HG13  ILE  33          3HG1      ILE  33   6.313  -4.091  -3.299
  254   HG21  ILE  33          1HG2      ILE  33   3.276  -4.611  -1.215
  255   HG22  ILE  33          2HG2      ILE  33   4.543  -5.347  -0.232
  256   HG23  ILE  33          3HG2      ILE  33   3.421  -6.367  -1.130
  257   HD11  ILE  33          3HD1      ILE  33   5.289  -1.974  -2.714
  258   HD12  ILE  33          1HD1      ILE  33   4.030  -2.813  -1.810
  259   HD13  ILE  33          2HD1      ILE  33   4.143  -3.011  -3.560
  260    H    GLY  34           H        GLY  34   7.920  -5.283  -3.260
  261    HA2  GLY  34           2HA      GLY  34   7.578  -5.976  -5.990
  262    HA3  GLY  34           3HA      GLY  34   9.000  -5.222  -5.290
  263    H    CYS  35           H        CYS  35   9.758  -7.253  -3.499
  264    HA   CYS  35           HA       CYS  35  11.215  -8.942  -5.276
  265    HB2  CYS  35           2HB      CYS  35  12.184  -8.162  -3.180
  266    HB3  CYS  35           3HB      CYS  35  10.960  -9.034  -2.264
  267    HG   CYS  35           HG       CYS  35  12.770 -10.939  -4.358
  268    H    MET  36           H        MET  36   8.452  -9.493  -3.130
  269    HA   MET  36           HA       MET  36   8.448 -12.351  -3.663
  270    HB2  MET  36           2HB      MET  36   6.587 -12.463  -2.114
  271    HB3  MET  36           3HB      MET  36   7.869 -11.471  -1.429
  272    HG2  MET  36           2HG      MET  36   6.602  -9.455  -2.227
  273    HG3  MET  36           3HG      MET  36   5.274 -10.541  -2.634
  274    HE1  MET  36           3HE      MET  36   4.464 -12.036   0.950
  275    HE2  MET  36           1HE      MET  36   5.672 -12.671  -0.167
  276    HE3  MET  36           2HE      MET  36   4.105 -12.140  -0.775
  277    H    GLY  37           H        GLY  37   7.253  -9.665  -5.287
  278    HA2  GLY  37           2HA      GLY  37   6.013  -9.594  -7.246
  279    HA3  GLY  37           3HA      GLY  37   5.705 -11.314  -7.079
  280    H    ALA  38           H        ALA  38   4.941  -9.179  -4.442
  281    HA   ALA  38           HA       ALA  38   2.175  -9.974  -4.518
  282    HB1  ALA  38           3HB      ALA  38   3.390  -9.751  -2.408
  283    HB2  ALA  38           1HB      ALA  38   1.962  -8.719  -2.445
  284    HB3  ALA  38           2HB      ALA  38   3.563  -8.019  -2.687
  285    H    GLN  39           H        GLN  39   3.440  -8.013  -6.583
  286    HA   GLN  39           HA       GLN  39   2.202  -5.507  -6.385
  287    HB2  GLN  39           2HB      GLN  39   2.928  -7.126  -8.840
  288    HB3  GLN  39           3HB      GLN  39   2.488  -5.427  -8.870
  289    HG2  GLN  39           2HG      GLN  39   4.880  -6.616  -7.474
  290    HG3  GLN  39           3HG      GLN  39   4.896  -5.714  -8.987
  291   HE21  GLN  39          1HE2      GLN  39   4.602  -5.511  -5.543
  292   HE22  GLN  39          2HE2      GLN  39   4.732  -3.795  -5.432
  293    H    ASN  40           H        ASN  40   0.899  -8.610  -7.205
  294    HA   ASN  40           HA       ASN  40  -1.461  -7.556  -8.542
  295    HB2  ASN  40           2HB      ASN  40  -0.993 -10.438  -7.770
  296    HB3  ASN  40           3HB      ASN  40  -1.973  -9.804  -9.090
  297   HD21  ASN  40          1HD2      ASN  40   1.198 -10.672  -8.046
  298   HD22  ASN  40          2HD2      ASN  40   1.980 -10.468  -9.571
  299    H    GLU  41           H        GLU  41  -0.636  -7.776  -5.372
  300    HA   GLU  41           HA       GLU  41  -3.182  -8.845  -4.398
  301    HB2  GLU  41           2HB      GLU  41  -1.123  -9.710  -3.400
  302    HB3  GLU  41           3HB      GLU  41  -0.650  -8.088  -2.918
  303    HG2  GLU  41           2HG      GLU  41  -2.399  -7.959  -1.318
  304    HG3  GLU  41           3HG      GLU  41  -3.165  -9.421  -1.943
  305    H    SER  42           H        SER  42  -4.744  -7.637  -3.433
  306    HA   SER  42           HA       SER  42  -4.712  -4.797  -3.672
  307    HB2  SER  42           2HB      SER  42  -6.653  -6.623  -2.236
  308    HB3  SER  42           3HB      SER  42  -6.897  -4.890  -2.448
  309    HG   SER  42           HG       SER  42  -7.463  -5.214  -4.450
  310    H    LEU  43           H        LEU  43  -4.858  -3.211  -2.006
  311    HA   LEU  43           HA       LEU  43  -2.827  -3.319  -0.139
  312    HB2  LEU  43           2HB      LEU  43  -5.295  -1.578  -0.103
  313    HB3  LEU  43           3HB      LEU  43  -3.867  -1.298   0.877
  314    HG   LEU  43           HG       LEU  43  -4.002  -1.198  -2.145
  315   HD11  LEU  43          1HD1      LEU  43  -3.590   0.992  -0.109
  316   HD12  LEU  43          2HD1      LEU  43  -5.052   0.718  -1.057
  317   HD13  LEU  43          3HD1      LEU  43  -3.554   1.182  -1.862
  318   HD21  LEU  43          3HD2      LEU  43  -1.677  -0.415  -2.038
  319   HD22  LEU  43          1HD2      LEU  43  -1.841  -2.058  -1.420
  320   HD23  LEU  43          2HD2      LEU  43  -1.661  -0.709  -0.299
  321    H    GLU  44           H        GLU  44  -6.333  -3.733   0.555
  322    HA   GLU  44           HA       GLU  44  -5.990  -4.112   3.329
  323    HB2  GLU  44           2HB      GLU  44  -8.167  -3.559   2.405
  324    HB3  GLU  44           3HB      GLU  44  -8.222  -5.089   1.536
  325    HG2  GLU  44           2HG      GLU  44  -8.371  -6.324   3.586
  326    HG3  GLU  44           3HG      GLU  44  -8.076  -4.874   4.542
  327    H    GLN  45           H        GLN  45  -6.095  -6.453   0.668
  328    HA   GLN  45           HA       GLN  45  -6.065  -8.824   2.139
  329    HB2  GLN  45           2HB      GLN  45  -4.713  -8.246  -0.513
  330    HB3  GLN  45           3HB      GLN  45  -5.008  -9.851   0.139
  331    HG2  GLN  45           2HG      GLN  45  -7.422  -9.450   0.033
  332    HG3  GLN  45           3HG      GLN  45  -7.124  -7.842  -0.625
  333   HE21  GLN  45          1HE2      GLN  45  -8.221  -8.284  -2.540
  334   HE22  GLN  45          2HE2      GLN  45  -7.577  -9.339  -3.748
  335    H    GLY  46           H        GLY  46  -3.263  -7.054   0.798
  336    HA2  GLY  46           2HA      GLY  46  -1.282  -8.622   2.062
  337    HA3  GLY  46           3HA      GLY  46  -1.054  -7.004   1.420
  338    H    ALA  47           H        ALA  47  -2.853  -5.609   3.100
  339    HA   ALA  47           HA       ALA  47  -1.268  -4.991   5.299
  340    HB1  ALA  47           3HB      ALA  47  -4.249  -4.592   5.026
  341    HB2  ALA  47           1HB      ALA  47  -3.000  -3.502   4.424
  342    HB3  ALA  47           2HB      ALA  47  -3.191  -3.751   6.160
  343    H    ASN  48           H        ASN  48  -4.373  -6.781   5.405
  344    HA   ASN  48           HA       ASN  48  -4.113  -7.565   8.107
  345    HB2  ASN  48           2HB      ASN  48  -5.790  -8.685   5.852
  346    HB3  ASN  48           3HB      ASN  48  -5.889  -9.280   7.508
  347   HD21  ASN  48          1HD2      ASN  48  -6.554  -6.608   5.389
  348   HD22  ASN  48          2HD2      ASN  48  -7.571  -5.742   6.486
  349    H    ALA  49           H        ALA  49  -3.086  -9.123   5.104
  350    HA   ALA  49           HA       ALA  49  -2.336 -11.621   6.204
  351    HB1  ALA  49           3HB      ALA  49  -2.645 -11.260   3.806
  352    HB2  ALA  49           1HB      ALA  49  -1.047 -11.923   4.148
  353    HB3  ALA  49           2HB      ALA  49  -1.230 -10.209   3.776
  354    H    HIS  50           H        HIS  50  -0.873  -8.518   6.455
  355    HA   HIS  50           HA       HIS  50   1.614  -9.721   7.514
  356    HB2  HIS  50           2HB      HIS  50   1.104  -6.969   6.365
  357    HB3  HIS  50           3HB      HIS  50   2.581  -7.401   7.216
  358    HD1  HIS  50           HD1      HIS  50   4.396  -7.857   5.621
  359    HD2  HIS  50           HD2      HIS  50   0.724  -9.121   4.143
  360    HE1  HIS  50           HE1      HIS  50   4.872  -8.796   3.342
  361    HE2  HIS  50           HE2      HIS  50   2.611  -9.359   2.397
  362    H    GLY  51           H        GLY  51  -1.204  -8.906   8.713
  363    HA2  GLY  51           2HA      GLY  51  -1.897  -8.451  10.871
  364    HA3  GLY  51           3HA      GLY  51  -0.211  -8.340  11.341
  365    H    LEU  52           H        LEU  52  -1.966  -6.387   8.946
  366    HA   LEU  52           HA       LEU  52  -1.491  -3.987  10.613
  367    HB2  LEU  52           2HB      LEU  52  -1.227  -4.161   7.601
  368    HB3  LEU  52           3HB      LEU  52  -0.967  -2.731   8.584
  369    HG   LEU  52           HG       LEU  52   0.728  -5.231   8.739
  370   HD11  LEU  52          1HD1      LEU  52   2.415  -3.949   7.527
  371   HD12  LEU  52          2HD1      LEU  52   1.279  -2.612   7.344
  372   HD13  LEU  52          3HD1      LEU  52   0.954  -4.158   6.560
  373   HD21  LEU  52          3HD2      LEU  52   2.274  -3.783   9.983
  374   HD22  LEU  52          1HD2      LEU  52   0.719  -3.937  10.802
  375   HD23  LEU  52          2HD2      LEU  52   1.100  -2.467   9.904
  376    H    ASN  53           H        ASN  53  -3.065  -2.327  10.467
  377    HA   ASN  53           HA       ASN  53  -5.625  -3.064   9.272
  378    HB2  ASN  53           2HB      ASN  53  -5.534  -2.029  11.543
  379    HB3  ASN  53           3HB      ASN  53  -4.893  -0.558  10.817
  380   HD21  ASN  53          1HD2      ASN  53  -7.336  -0.867  12.317
  381   HD22  ASN  53          2HD2      ASN  53  -8.630  -0.423  11.265
  382    H    VAL  54           H        VAL  54  -6.038  -2.568   7.209
  383    HA   VAL  54           HA       VAL  54  -4.359  -1.092   5.548
  384    HB   VAL  54           HB       VAL  54  -5.976  -2.758   4.716
  385   HG11  VAL  54          1HG1      VAL  54  -7.903  -2.150   6.103
  386   HG12  VAL  54          2HG1      VAL  54  -8.329  -2.179   4.392
  387   HG13  VAL  54          3HG1      VAL  54  -8.074  -0.638   5.213
  388   HG21  VAL  54          3HG2      VAL  54  -6.629  -1.566   2.667
  389   HG22  VAL  54          1HG2      VAL  54  -4.977  -1.179   3.142
  390   HG23  VAL  54          2HG2      VAL  54  -6.277  -0.026   3.450
  391    H    GLU  55           H        GLU  55  -7.147  -0.023   7.410
  392    HA   GLU  55           HA       GLU  55  -7.609   2.447   6.148
  393    HB2  GLU  55           2HB      GLU  55  -8.136   1.504   8.968
  394    HB3  GLU  55           3HB      GLU  55  -8.682   3.063   8.364
  395    HG2  GLU  55           2HG      GLU  55 -10.044   1.985   6.684
  396    HG3  GLU  55           3HG      GLU  55  -9.427   0.403   7.155
  397    H    ASP  56           H        ASP  56  -5.415   1.579   8.794
  398    HA   ASP  56           HA       ASP  56  -4.567   4.223   9.400
  399    HB2  ASP  56           2HB      ASP  56  -4.262   2.194  10.869
  400    HB3  ASP  56           3HB      ASP  56  -2.992   1.658   9.773
  401    H    ILE  57           H        ILE  57  -3.453   1.763   7.139
  402    HA   ILE  57           HA       ILE  57  -1.117   3.106   6.223
  403    HB   ILE  57           HB       ILE  57  -2.790   1.097   4.692
  404   HG12  ILE  57          2HG1      ILE  57  -0.531   0.579   6.655
  405   HG13  ILE  57          3HG1      ILE  57  -2.234   0.247   6.949
  406   HG21  ILE  57          1HG2      ILE  57  -0.685   0.544   3.570
  407   HG22  ILE  57          2HG2      ILE  57   0.146   1.787   4.507
  408   HG23  ILE  57          3HG2      ILE  57  -1.101   2.243   3.347
  409   HD11  ILE  57          3HD1      ILE  57  -2.219  -1.390   5.131
  410   HD12  ILE  57          1HD1      ILE  57  -1.038  -1.779   6.381
  411   HD13  ILE  57          2HD1      ILE  57  -0.507  -1.064   4.859
  412    H    LEU  58           H        LEU  58  -4.444   2.919   4.961
  413    HA   LEU  58           HA       LEU  58  -4.108   4.368   2.604
  414    HB2  LEU  58           2HB      LEU  58  -6.535   4.214   4.397
  415    HB3  LEU  58           3HB      LEU  58  -6.547   4.879   2.774
  416    HG   LEU  58           HG       LEU  58  -5.976   2.006   3.526
  417   HD11  LEU  58          1HD1      LEU  58  -8.051   1.533   2.305
  418   HD12  LEU  58          2HD1      LEU  58  -8.308   3.264   2.081
  419   HD13  LEU  58          3HD1      LEU  58  -8.326   2.572   3.704
  420   HD21  LEU  58          3HD2      LEU  58  -6.027   3.301   0.798
  421   HD22  LEU  58          1HD2      LEU  58  -5.903   1.570   1.114
  422   HD23  LEU  58          2HD2      LEU  58  -4.608   2.653   1.622
  423    H    ARG  59           H        ARG  59  -4.553   5.529   5.899
  424    HA   ARG  59           HA       ARG  59  -5.089   8.219   5.447
  425    HB2  ARG  59           2HB      ARG  59  -5.105   7.233   7.679
  426    HB3  ARG  59           3HB      ARG  59  -3.368   6.968   7.603
  427    HG2  ARG  59           2HG      ARG  59  -3.068   9.452   7.451
  428    HG3  ARG  59           3HG      ARG  59  -4.803   9.622   7.723
  429    HD2  ARG  59           2HD      ARG  59  -3.547   9.912   9.801
  430    HD3  ARG  59           3HD      ARG  59  -4.588   8.489   9.879
  431    HE   ARG  59           HE       ARG  59  -1.672   8.385   9.411
  432   HH11  ARG  59          1HH1      ARG  59  -4.562   7.050  10.750
  433   HH12  ARG  59          2HH1      ARG  59  -3.735   5.684  11.418
  434   HH21  ARG  59          1HH2      ARG  59  -0.644   6.648  10.280
  435   HH22  ARG  59          2HH2      ARG  59  -1.549   5.453  11.148
  436    H    ASP  60           H        ASP  60  -1.874   6.715   5.871
  437    HA   ASP  60           HA       ASP  60  -0.421   9.087   5.334
  438    HB2  ASP  60           2HB      ASP  60   0.282   6.818   6.487
  439    HB3  ASP  60           3HB      ASP  60   0.763   6.368   4.855
  440    H    LEU  61           H        LEU  61  -1.443   6.383   3.295
  441    HA   LEU  61           HA       LEU  61  -0.036   7.059   0.958
  442    HB2  LEU  61           2HB      LEU  61  -2.697   5.650   1.240
  443    HB3  LEU  61           3HB      LEU  61  -1.747   5.705  -0.233
  444    HG   LEU  61           HG       LEU  61  -0.903   4.390   2.358
  445   HD11  LEU  61          1HD1      LEU  61  -1.750   3.185  -0.278
  446   HD12  LEU  61          2HD1      LEU  61  -2.671   3.157   1.225
  447   HD13  LEU  61          3HD1      LEU  61  -1.138   2.293   1.117
  448   HD21  LEU  61          3HD2      LEU  61   1.008   5.309   1.148
  449   HD22  LEU  61          1HD2      LEU  61   0.489   4.479  -0.320
  450   HD23  LEU  61          2HD2      LEU  61   1.006   3.547   1.086
  451    H    ASN  62           H        ASN  62  -3.416   7.876   1.843
  452    HA   ASN  62           HA       ASN  62  -3.858   9.515  -0.432
  453    HB2  ASN  62           2HB      ASN  62  -5.276   9.282   2.217
  454    HB3  ASN  62           3HB      ASN  62  -5.759  10.481   1.020
  455   HD21  ASN  62          1HD2      ASN  62  -5.724   7.121   1.835
  456   HD22  ASN  62          2HD2      ASN  62  -6.736   6.589   0.541
  457    H    ALA  63           H        ALA  63  -2.458  10.153   2.720
  458    HA   ALA  63           HA       ALA  63  -2.482  12.950   2.710
  459    HB1  ALA  63           3HB      ALA  63  -0.341  11.130   3.814
  460    HB2  ALA  63           1HB      ALA  63  -1.814  11.621   4.650
  461    HB3  ALA  63           2HB      ALA  63  -0.588  12.823   4.247
  462    H    LEU  64           H        LEU  64  -0.461  10.708   0.922
  463    HA   LEU  64           HA       LEU  64   1.539  12.494   0.035
  464    HB2  LEU  64           2HB      LEU  64   0.358  10.092  -1.377
  465    HB3  LEU  64           3HB      LEU  64   1.858  10.887  -1.824
  466    HG   LEU  64           HG       LEU  64   1.372   9.491   0.820
  467   HD11  LEU  64          1HD1      LEU  64   2.863   7.752  -0.053
  468   HD12  LEU  64          2HD1      LEU  64   2.896   8.566  -1.618
  469   HD13  LEU  64          3HD1      LEU  64   1.386   7.890  -1.006
  470   HD21  LEU  64          3HD2      LEU  64   3.902  10.616  -0.392
  471   HD22  LEU  64          1HD2      LEU  64   3.794   9.706   1.116
  472   HD23  LEU  64          2HD2      LEU  64   3.020  11.285   0.981
  473    H    ALA  65           H        ALA  65  -1.752  11.981  -1.027
  474    HA   ALA  65           HA       ALA  65  -1.408  13.613  -3.426
  475    HB1  ALA  65           3HB      ALA  65  -3.717  13.017  -3.925
  476    HB2  ALA  65           1HB      ALA  65  -3.878  12.254  -2.342
  477    HB3  ALA  65           2HB      ALA  65  -2.772  11.578  -3.539
  478    H    LEU  66           H        LEU  66  -3.128  13.749  -0.327
  479    HA   LEU  66           HA       LEU  66  -4.374  16.286  -0.868
  480    HB2  LEU  66           2HB      LEU  66  -4.029  14.824   1.759
  481    HB3  LEU  66           3HB      LEU  66  -5.112  16.174   1.468
  482    HG   LEU  66           HG       LEU  66  -5.337  13.453   0.165
  483   HD11  LEU  66          1HD1      LEU  66  -7.319  13.171   1.575
  484   HD12  LEU  66          2HD1      LEU  66  -6.971  14.708   2.370
  485   HD13  LEU  66          3HD1      LEU  66  -5.852  13.353   2.539
  486   HD21  LEU  66          3HD2      LEU  66  -7.170  15.854   0.049
  487   HD22  LEU  66          1HD2      LEU  66  -7.511  14.263  -0.633
  488   HD23  LEU  66          2HD2      LEU  66  -6.184  15.229  -1.274
  489    H    GLU  67           H        GLU  67  -1.624  15.215   1.101
  490    HA   GLU  67           HA       GLU  67   0.112  16.273   2.077
  491    HB2  GLU  67           2HB      GLU  67  -0.517  18.408   0.028
  492    HB3  GLU  67           3HB      GLU  67   0.932  18.384   1.027
  493    HG2  GLU  67           2HG      GLU  67   1.622  16.280   0.022
  494    HG3  GLU  67           3HG      GLU  67   0.144  16.233  -0.940
  495    H    HIS  68           H        HIS  68  -1.523  19.341   1.410
  496    HA   HIS  68           HA       HIS  68  -1.845  21.129   2.794
  497    HB2  HIS  68           2HB      HIS  68  -3.745  20.882   4.243
  498    HB3  HIS  68           3HB      HIS  68  -4.001  19.887   2.816
  499    HD1  HIS  68           HD1      HIS  68  -3.123  19.587   6.478
  500    HD2  HIS  68           HD2      HIS  68  -4.449  17.221   3.327
  501    HE1  HIS  68           HE1      HIS  68  -3.718  17.375   7.501
  502    HE2  HIS  68           HE2      HIS  68  -4.354  15.918   5.560
  503    H    HIS  69           H        HIS  69   0.511  19.475   3.608
  504    HA   HIS  69           HA       HIS  69   0.602  20.115   6.492
  505    HB2  HIS  69           2HB      HIS  69   1.019  17.704   5.639
  506    HB3  HIS  69           3HB      HIS  69   2.556  18.318   5.041
  507    HD1  HIS  69           HD1      HIS  69   0.792  17.283   8.138
  508    HD2  HIS  69           HD2      HIS  69   4.422  19.013   7.082
  509    HE1  HIS  69           HE1      HIS  69   2.221  17.150  10.191
  510    HE2  HIS  69           HE2      HIS  69   4.337  18.351   9.582
  511    H    HIS  70           H        HIS  70   1.520  22.055   6.820
  512    HA   HIS  70           HA       HIS  70   3.437  23.066   4.807
  513    HB2  HIS  70           2HB      HIS  70   2.609  25.343   5.681
  514    HB3  HIS  70           3HB      HIS  70   1.504  24.391   4.692
  515    HD1  HIS  70           HD1      HIS  70  -0.676  23.669   5.736
  516    HD2  HIS  70           HD2      HIS  70   1.939  25.354   8.494
  517    HE1  HIS  70           HE1      HIS  70  -1.991  23.899   7.859
  518    HE2  HIS  70           HE2      HIS  70  -0.349  24.768   9.547
  519    H    HIS  71           H        HIS  71   4.766  25.005   5.725
  520    HA   HIS  71           HA       HIS  71   5.947  24.197   8.314
  521    HB2  HIS  71           2HB      HIS  71   7.499  23.579   6.595
  522    HB3  HIS  71           3HB      HIS  71   7.312  25.126   5.778
  523    HD1  HIS  71           HD1      HIS  71   8.862  26.989   6.473
  524    HD2  HIS  71           HD2      HIS  71   9.006  23.752   9.071
  525    HE1  HIS  71           HE1      HIS  71  10.780  27.454   8.018
  526    HE2  HIS  71           HE2      HIS  71  10.689  25.602   9.713
  527    H    HIS  72           H        HIS  72   5.505  25.713   9.798
  528    HA   HIS  72           HA       HIS  72   5.392  28.539   9.099
  529    HB2  HIS  72           2HB      HIS  72   4.851  28.902  11.467
  530    HB3  HIS  72           3HB      HIS  72   3.809  27.670  10.763
  531    HD1  HIS  72           HD1      HIS  72   6.709  28.061  13.148
  532    HD2  HIS  72           HD2      HIS  72   3.956  25.179  11.964
  533    HE1  HIS  72           HE1      HIS  72   6.963  26.177  14.780
  534    HE2  HIS  72           HE2      HIS  72   5.126  24.566  14.183
  535    H    HIS  73           H        HIS  73   6.644  30.047  10.742
  536    HA   HIS  73           HA       HIS  73   9.393  29.699  10.257
  537    HB2  HIS  73           2HB      HIS  73   9.773  31.683  11.562
  538    HB3  HIS  73           3HB      HIS  73   8.291  31.908  10.645
  539    HD1  HIS  73           HD1      HIS  73   6.100  32.157  11.990
  540    HD2  HIS  73           HD2      HIS  73   9.467  31.571  14.351
  541    HE1  HIS  73           HE1      HIS  73   5.389  32.724  14.326
  542    HE2  HIS  73           HE2      HIS  73   7.383  32.177  15.751
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1 -16.962   9.462   1.503
    2    H2   MET   1           2H       MET   1 -17.421  10.989   2.055
    3    H3   MET   1           3H       MET   1 -15.818  10.479   2.220
    4    HA   MET   1           HA       MET   1 -17.229  10.980  -0.337
    5    HB2  MET   1           2HB      MET   1 -16.691  13.030   0.960
    6    HB3  MET   1           3HB      MET   1 -15.003  12.542   1.008
    7    HG2  MET   1           2HG      MET   1 -15.475  14.269  -0.690
    8    HG3  MET   1           3HG      MET   1 -14.803  12.788  -1.371
    9    HE1  MET   1           3HE      MET   1 -18.514  13.340  -0.135
   10    HE2  MET   1           1HE      MET   1 -19.279  13.903  -1.621
   11    HE3  MET   1           2HE      MET   1 -18.070  14.904  -0.819
   12    H    THR   2           H        THR   2 -15.719  10.999  -2.205
   13    HA   THR   2           HA       THR   2 -14.354   8.591  -2.482
   14    HB   THR   2           HB       THR   2 -13.851  11.094  -4.118
   15    HG1  THR   2           HG1      THR   2 -15.497  10.124  -5.503
   16   HG21  THR   2          3HG2      THR   2 -12.203   9.340  -4.537
   17   HG22  THR   2          1HG2      THR   2 -13.292   9.496  -5.920
   18   HG23  THR   2          2HG2      THR   2 -13.495   8.162  -4.782
   19    H    GLN   3           H        GLN   3 -12.539   7.951  -1.461
   20    HA   GLN   3           HA       GLN   3 -10.285   9.833  -1.213
   21    HB2  GLN   3           2HB      GLN   3 -10.745   7.118   0.053
   22    HB3  GLN   3           3HB      GLN   3  -9.243   8.021   0.195
   23    HG2  GLN   3           2HG      GLN   3 -10.541   9.882   1.238
   24    HG3  GLN   3           3HG      GLN   3 -11.954   8.830   1.232
   25   HE21  GLN   3          1HE2      GLN   3 -10.373   6.439   1.841
   26   HE22  GLN   3          2HE2      GLN   3  -9.955   6.564   3.509
   27    H    LYS   4           H        LYS   4  -8.552   9.662  -2.527
   28    HA   LYS   4           HA       LYS   4  -8.772   8.132  -4.884
   29    HB2  LYS   4           2HB      LYS   4  -6.388   9.639  -3.789
   30    HB3  LYS   4           3HB      LYS   4  -6.499   8.983  -5.419
   31    HG2  LYS   4           2HG      LYS   4  -8.521  10.414  -5.774
   32    HG3  LYS   4           3HG      LYS   4  -8.199  11.162  -4.210
   33    HD2  LYS   4           2HD      LYS   4  -7.300  12.544  -5.988
   34    HD3  LYS   4           3HD      LYS   4  -5.976  11.865  -5.036
   35    HE2  LYS   4           2HE      LYS   4  -5.613  10.152  -6.736
   36    HE3  LYS   4           3HE      LYS   4  -6.969  10.777  -7.676
   37    HZ1  LYS   4           3HZ      LYS   4  -4.548  12.350  -7.009
   38    HZ2  LYS   4           1HZ      LYS   4  -5.798  12.805  -8.051
   39    HZ3  LYS   4           2HZ      LYS   4  -4.772  11.526  -8.468
   40    H    PHE   5           H        PHE   5  -7.064   7.502  -1.889
   41    HA   PHE   5           HA       PHE   5  -6.024   4.983  -3.028
   42    HB2  PHE   5           2HB      PHE   5  -5.284   6.437  -0.473
   43    HB3  PHE   5           3HB      PHE   5  -4.627   4.878  -0.954
   44    HD1  PHE   5           HD1      PHE   5  -4.760   8.466  -1.822
   45    HD2  PHE   5           HD2      PHE   5  -2.862   4.718  -2.534
   46    HE1  PHE   5           HE1      PHE   5  -2.976   9.609  -3.069
   47    HE2  PHE   5           HE2      PHE   5  -1.073   5.859  -3.777
   48    HZ   PHE   5           HZ       PHE   5  -1.129   8.309  -4.044
   49    H    THR   6           H        THR   6  -7.316   3.283  -2.736
   50    HA   THR   6           HA       THR   6  -8.825   3.034  -0.202
   51    HB   THR   6           HB       THR   6 -10.451   3.578  -1.891
   52    HG1  THR   6           HG1      THR   6 -11.738   1.686  -1.761
   53   HG21  THR   6          3HG2      THR   6  -9.141   2.975  -3.887
   54   HG22  THR   6          1HG2      THR   6 -10.747   2.245  -3.929
   55   HG23  THR   6          2HG2      THR   6  -9.344   1.265  -3.504
   56    H    LYS   7           H        LYS   7  -9.496   0.779   0.289
   57    HA   LYS   7           HA       LYS   7  -7.276  -0.967   0.298
   58    HB2  LYS   7           2HB      LYS   7  -8.821  -2.604   1.312
   59    HB3  LYS   7           3HB      LYS   7  -8.948  -1.017   2.064
   60    HG2  LYS   7           2HG      LYS   7 -10.991  -0.563   0.825
   61    HG3  LYS   7           3HG      LYS   7 -10.844  -2.106  -0.021
   62    HD2  LYS   7           2HD      LYS   7 -12.467  -2.277   1.786
   63    HD3  LYS   7           3HD      LYS   7 -11.067  -3.298   2.115
   64    HE2  LYS   7           2HE      LYS   7 -10.170  -1.544   3.606
   65    HE3  LYS   7           3HE      LYS   7 -11.610  -0.571   3.308
   66    HZ1  LYS   7           3HZ      LYS   7 -12.955  -2.313   4.287
   67    HZ2  LYS   7           1HZ      LYS   7 -11.767  -1.811   5.381
   68    HZ3  LYS   7           2HZ      LYS   7 -11.584  -3.269   4.545
   69    H    ASP   8           H        ASP   8  -9.756  -0.480  -2.010
   70    HA   ASP   8           HA       ASP   8  -9.901  -3.038  -3.205
   71    HB2  ASP   8           2HB      ASP   8 -11.634  -1.371  -3.530
   72    HB3  ASP   8           3HB      ASP   8 -10.490  -0.281  -4.307
   73    H    MET   9           H        MET   9  -7.895  -0.186  -3.967
   74    HA   MET   9           HA       MET   9  -6.833  -1.266  -6.382
   75    HB2  MET   9           2HB      MET   9  -5.296   0.636  -6.351
   76    HB3  MET   9           3HB      MET   9  -6.935   1.153  -5.986
   77    HG2  MET   9           2HG      MET   9  -6.317   1.106  -3.564
   78    HG3  MET   9           3HG      MET   9  -4.651   0.819  -4.060
   79    HE1  MET   9           3HE      MET   9  -3.884   4.116  -6.082
   80    HE2  MET   9           1HE      MET   9  -4.585   2.650  -6.767
   81    HE3  MET   9           2HE      MET   9  -3.273   2.536  -5.593
   82    H    THR  10           H        THR  10  -4.648  -1.909  -6.814
   83    HA   THR  10           HA       THR  10  -3.540  -3.560  -4.676
   84    HB   THR  10           HB       THR  10  -2.212  -4.648  -6.383
   85    HG1  THR  10           HG1      THR  10  -2.602  -3.849  -8.643
   86   HG21  THR  10          3HG2      THR  10  -5.039  -4.161  -7.354
   87   HG22  THR  10          1HG2      THR  10  -4.530  -5.393  -6.197
   88   HG23  THR  10          2HG2      THR  10  -3.992  -5.485  -7.875
   89    H    PHE  11           H        PHE  11  -1.134  -3.742  -4.500
   90    HA   PHE  11           HA       PHE  11   0.085  -1.322  -3.813
   91    HB2  PHE  11           2HB      PHE  11   1.326  -4.004  -4.469
   92    HB3  PHE  11           3HB      PHE  11   2.227  -2.652  -3.798
   93    HD1  PHE  11           HD1      PHE  11   1.877  -1.930  -1.498
   94    HD2  PHE  11           HD2      PHE  11  -0.244  -5.257  -3.104
   95    HE1  PHE  11           HE1      PHE  11   1.245  -2.621   0.776
   96    HE2  PHE  11           HE2      PHE  11  -0.880  -5.949  -0.830
   97    HZ   PHE  11           HZ       PHE  11  -0.134  -4.633   1.114
   98    H    ALA  12           H        ALA  12   0.381  -3.226  -6.811
   99    HA   ALA  12           HA       ALA  12   2.333  -1.674  -8.090
  100    HB1  ALA  12           3HB      ALA  12   1.592  -3.874  -8.909
  101    HB2  ALA  12           1HB      ALA  12   1.545  -2.646 -10.176
  102    HB3  ALA  12           2HB      ALA  12   0.051  -3.166  -9.394
  103    H    GLN  13           H        GLN  13  -1.209  -1.348  -8.093
  104    HA   GLN  13           HA       GLN  13  -1.368   0.875  -9.831
  105    HB2  GLN  13           2HB      GLN  13  -3.235   0.063  -7.586
  106    HB3  GLN  13           3HB      GLN  13  -3.623   1.214  -8.859
  107    HG2  GLN  13           2HG      GLN  13  -3.446  -0.538 -10.534
  108    HG3  GLN  13           3HG      GLN  13  -2.960  -1.696  -9.297
  109   HE21  GLN  13          1HE2      GLN  13  -5.456   0.728  -8.832
  110   HE22  GLN  13          2HE2      GLN  13  -6.775  -0.385  -8.760
  111    H    ALA  14           H        ALA  14  -1.071   0.666  -6.295
  112    HA   ALA  14           HA       ALA  14  -1.337   3.395  -5.688
  113    HB1  ALA  14           3HB      ALA  14  -1.421   1.619  -4.001
  114    HB2  ALA  14           1HB      ALA  14  -0.251   2.866  -3.571
  115    HB3  ALA  14           2HB      ALA  14   0.304   1.324  -4.224
  116    H    LEU  15           H        LEU  15   1.605   1.498  -6.373
  117    HA   LEU  15           HA       LEU  15   3.470   3.578  -6.091
  118    HB2  LEU  15           2HB      LEU  15   3.581   1.147  -7.885
  119    HB3  LEU  15           3HB      LEU  15   4.951   2.179  -7.515
  120    HG   LEU  15           HG       LEU  15   3.423   0.472  -5.540
  121   HD11  LEU  15          1HD1      LEU  15   4.852  -0.837  -7.010
  122   HD12  LEU  15          2HD1      LEU  15   5.510  -0.799  -5.373
  123   HD13  LEU  15          3HD1      LEU  15   6.225   0.207  -6.634
  124   HD21  LEU  15          3HD2      LEU  15   4.178   2.515  -4.468
  125   HD22  LEU  15          1HD2      LEU  15   5.807   2.277  -5.101
  126   HD23  LEU  15          2HD2      LEU  15   5.145   1.149  -3.919
  127    H    GLN  16           H        GLN  16   1.372   2.738  -8.780
  128    HA   GLN  16           HA       GLN  16   2.622   4.571 -10.627
  129    HB2  GLN  16           2HB      GLN  16  -0.084   3.217 -10.750
  130    HB3  GLN  16           3HB      GLN  16   0.661   4.113 -12.068
  131    HG2  GLN  16           2HG      GLN  16   1.683   1.566 -10.821
  132    HG3  GLN  16           3HG      GLN  16   0.935   1.740 -12.407
  133   HE21  GLN  16          1HE2      GLN  16   3.800   2.305 -10.518
  134   HE22  GLN  16          2HE2      GLN  16   4.847   2.662 -11.841
  135    H    THR  17           H        THR  17  -0.032   4.716  -8.326
  136    HA   THR  17           HA       THR  17  -1.180   7.156  -9.182
  137    HB   THR  17           HB       THR  17  -1.108   6.095  -6.343
  138    HG1  THR  17           HG1      THR  17  -3.373   5.691  -7.888
  139   HG21  THR  17          3HG2      THR  17  -1.871   8.422  -6.517
  140   HG22  THR  17          1HG2      THR  17  -3.201   7.352  -6.075
  141   HG23  THR  17          2HG2      THR  17  -3.059   7.947  -7.729
  142    H    HIS  18           H        HIS  18   1.176   6.502  -6.572
  143    HA   HIS  18           HA       HIS  18   2.416   9.109  -7.043
  144    HB2  HIS  18           2HB      HIS  18   0.967   8.356  -4.556
  145    HB3  HIS  18           3HB      HIS  18   2.504   9.178  -4.343
  146    HD1  HIS  18           HD1      HIS  18   0.995  10.485  -7.341
  147    HD2  HIS  18           HD2      HIS  18   0.542  11.132  -3.267
  148    HE1  HIS  18           HE1      HIS  18  -0.102  12.728  -7.135
  149    HE2  HIS  18           HE2      HIS  18  -0.120  13.200  -4.665
  150    HA   PRO  19           HA       PRO  19   6.034   6.427  -6.707
  151    HB2  PRO  19           2HB      PRO  19   7.350   9.089  -6.374
  152    HB3  PRO  19           3HB      PRO  19   7.764   7.759  -7.461
  153    HG2  PRO  19           2HG      PRO  19   6.549   9.924  -8.407
  154    HG3  PRO  19           3HG      PRO  19   6.086   8.311  -8.985
  155    HD2  PRO  19           2HD      PRO  19   4.683  10.103  -7.034
  156    HD3  PRO  19           3HD      PRO  19   3.997   9.062  -8.298
  157    H    GLY  20           H        GLY  20   5.252   9.041  -4.464
  158    HA2  GLY  20           2HA      GLY  20   7.105   8.450  -2.425
  159    HA3  GLY  20           3HA      GLY  20   5.587   9.301  -2.207
  160    H    VAL  21           H        VAL  21   4.241   6.756  -3.348
  161    HA   VAL  21           HA       VAL  21   3.434   5.631  -0.913
  162    HB   VAL  21           HB       VAL  21   3.285   4.451  -3.698
  163   HG11  VAL  21          1HG1      VAL  21   3.098   2.662  -2.054
  164   HG12  VAL  21          2HG1      VAL  21   1.534   2.967  -2.807
  165   HG13  VAL  21          3HG1      VAL  21   1.860   3.568  -1.182
  166   HG21  VAL  21          3HG2      VAL  21   1.211   5.909  -2.049
  167   HG22  VAL  21          1HG2      VAL  21   0.968   5.233  -3.660
  168   HG23  VAL  21          2HG2      VAL  21   2.088   6.575  -3.426
  169    H    ALA  22           H        ALA  22   6.014   4.659  -3.128
  170    HA   ALA  22           HA       ALA  22   6.668   2.154  -2.141
  171    HB1  ALA  22           3HB      ALA  22   8.589   4.282  -3.093
  172    HB2  ALA  22           1HB      ALA  22   7.711   3.150  -4.122
  173    HB3  ALA  22           2HB      ALA  22   8.924   2.553  -2.991
  174    H    GLY  23           H        GLY  23   7.939   5.303  -1.011
  175    HA2  GLY  23           2HA      GLY  23   9.467   4.328   1.133
  176    HA3  GLY  23           3HA      GLY  23   8.810   5.949   1.013
  177    H    VAL  24           H        VAL  24   6.040   5.235   1.009
  178    HA   VAL  24           HA       VAL  24   5.514   5.029   3.778
  179    HB   VAL  24           HB       VAL  24   3.597   4.520   1.488
  180   HG11  VAL  24          1HG1      VAL  24   2.738   3.693   3.620
  181   HG12  VAL  24          2HG1      VAL  24   1.843   5.121   3.100
  182   HG13  VAL  24          3HG1      VAL  24   3.059   5.255   4.371
  183   HG21  VAL  24          3HG2      VAL  24   4.653   6.705   1.282
  184   HG22  VAL  24          1HG2      VAL  24   4.233   7.086   2.952
  185   HG23  VAL  24          2HG2      VAL  24   2.962   6.880   1.748
  186    H    LEU  25           H        LEU  25   5.166   2.650   1.149
  187    HA   LEU  25           HA       LEU  25   4.239   0.496   2.676
  188    HB2  LEU  25           2HB      LEU  25   6.013   0.419   0.227
  189    HB3  LEU  25           3HB      LEU  25   5.091  -0.933   0.861
  190    HG   LEU  25           HG       LEU  25   3.924   1.621  -0.272
  191   HD11  LEU  25          1HD1      LEU  25   3.146   0.214  -2.110
  192   HD12  LEU  25          2HD1      LEU  25   3.970  -1.177  -1.405
  193   HD13  LEU  25          3HD1      LEU  25   4.905   0.198  -1.993
  194   HD21  LEU  25          3HD2      LEU  25   2.516   0.726   1.503
  195   HD22  LEU  25          1HD2      LEU  25   2.546  -0.869   0.749
  196   HD23  LEU  25          2HD2      LEU  25   1.759   0.480  -0.069
  197    H    ARG  26           H        ARG  26   7.597   1.340   1.783
  198    HA   ARG  26           HA       ARG  26   8.922  -0.633   3.262
  199    HB2  ARG  26           2HB      ARG  26   9.779   2.218   2.702
  200    HB3  ARG  26           3HB      ARG  26  10.847   0.933   3.259
  201    HG2  ARG  26           2HG      ARG  26  10.496  -0.306   1.208
  202    HG3  ARG  26           3HG      ARG  26   9.314   0.883   0.659
  203    HD2  ARG  26           2HD      ARG  26  11.506   1.201  -0.408
  204    HD3  ARG  26           3HD      ARG  26  11.031   2.596   0.560
  205    HE   ARG  26           HE       ARG  26  12.679   2.042   2.143
  206   HH11  ARG  26          1HH1      ARG  26  12.707  -0.098  -0.573
  207   HH12  ARG  26          2HH1      ARG  26  14.278  -0.716  -0.193
  208   HH21  ARG  26          1HH2      ARG  26  14.690   1.245   2.592
  209   HH22  ARG  26          2HH2      ARG  26  15.389   0.043   1.564
  210    H    SER  27           H        SER  27   7.846   2.597   4.253
  211    HA   SER  27           HA       SER  27   8.823   2.606   6.880
  212    HB2  SER  27           2HB      SER  27   7.981   4.629   5.789
  213    HB3  SER  27           3HB      SER  27   6.352   3.960   5.753
  214    HG   SER  27           HG       SER  27   6.379   5.235   7.516
  215    H    TYR  28           H        TYR  28   5.835   1.269   5.552
  216    HA   TYR  28           HA       TYR  28   4.886   0.459   8.188
  217    HB2  TYR  28           2HB      TYR  28   3.718   0.464   5.430
  218    HB3  TYR  28           3HB      TYR  28   3.021  -0.590   6.655
  219    HD1  TYR  28           HD2      TYR  28   4.007   2.995   6.147
  220    HD2  TYR  28           HD1      TYR  28   1.362   0.240   8.044
  221    HE1  TYR  28           HE2      TYR  28   2.682   4.874   7.026
  222    HE2  TYR  28           HE1      TYR  28   0.041   2.113   8.925
  223    HH   TYR  28           HH       TYR  28   0.050   4.349   9.308
  224    H    ASN  29           H        ASN  29   7.241  -0.779   6.449
  225    HA   ASN  29           HA       ASN  29   8.294  -2.793   6.387
  226    HB2  ASN  29           2HB      ASN  29   7.518  -2.903   8.782
  227    HB3  ASN  29           3HB      ASN  29   6.111  -3.807   8.232
  228   HD21  ASN  29          1HD2      ASN  29   6.675  -5.603   9.448
  229   HD22  ASN  29          2HD2      ASN  29   7.993  -6.637   9.018
  230    H    LEU  30           H        LEU  30   5.862  -2.106   4.675
  231    HA   LEU  30           HA       LEU  30   5.001  -4.733   3.750
  232    HB2  LEU  30           2HB      LEU  30   4.359  -1.939   2.792
  233    HB3  LEU  30           3HB      LEU  30   3.691  -3.396   2.082
  234    HG   LEU  30           HG       LEU  30   3.269  -2.539   4.952
  235   HD11  LEU  30          1HD1      LEU  30   1.418  -2.339   2.573
  236   HD12  LEU  30          2HD1      LEU  30   2.191  -0.992   3.409
  237   HD13  LEU  30          3HD1      LEU  30   0.994  -1.978   4.246
  238   HD21  LEU  30          3HD2      LEU  30   3.132  -4.950   4.675
  239   HD22  LEU  30          1HD2      LEU  30   2.023  -4.757   3.315
  240   HD23  LEU  30          2HD2      LEU  30   1.524  -4.280   4.938
  241    H    GLY  31           H        GLY  31   7.735  -2.947   3.291
  242    HA2  GLY  31           2HA      GLY  31   8.165  -2.789   0.544
  243    HA3  GLY  31           3HA      GLY  31   9.435  -2.995   1.738
  244    H    CYS  32           H        CYS  32   8.145  -5.622   2.551
  245    HA   CYS  32           HA       CYS  32   9.664  -7.364   0.927
  246    HB2  CYS  32           2HB      CYS  32   7.389  -8.027   2.810
  247    HB3  CYS  32           3HB      CYS  32   8.541  -9.184   2.155
  248    HG   CYS  32           HG       CYS  32   9.370  -8.854   4.718
  249    H    ILE  33           H        ILE  33   6.824  -5.855   0.071
  250    HA   ILE  33           HA       ILE  33   5.279  -7.815  -1.178
  251    HB   ILE  33           HB       ILE  33   4.526  -6.001  -2.747
  252   HG12  ILE  33          2HG1      ILE  33   6.469  -4.307  -1.143
  253   HG13  ILE  33          3HG1      ILE  33   6.639  -4.734  -2.843
  254   HG21  ILE  33          1HG2      ILE  33   3.404  -4.677  -1.004
  255   HG22  ILE  33          2HG2      ILE  33   4.491  -5.364   0.203
  256   HG23  ILE  33          3HG2      ILE  33   3.364  -6.407  -0.662
  257   HD11  ILE  33          3HD1      ILE  33   5.832  -2.476  -2.607
  258   HD12  ILE  33          1HD1      ILE  33   4.466  -3.033  -1.644
  259   HD13  ILE  33          2HD1      ILE  33   4.588  -3.487  -3.343
  260    H    GLY  34           H        GLY  34   8.367  -6.570  -2.131
  261    HA2  GLY  34           2HA      GLY  34   8.262  -7.125  -4.909
  262    HA3  GLY  34           3HA      GLY  34   9.720  -6.983  -3.944
  263    H    CYS  35           H        CYS  35   9.622  -9.065  -2.238
  264    HA   CYS  35           HA       CYS  35  10.346 -11.247  -3.942
  265    HB2  CYS  35           2HB      CYS  35  11.561 -10.795  -1.868
  266    HB3  CYS  35           3HB      CYS  35  10.111 -11.127  -0.926
  267    HG   CYS  35           HG       CYS  35  12.402 -13.214  -2.049
  268    H    MET  36           H        MET  36   7.642 -10.689  -1.696
  269    HA   MET  36           HA       MET  36   6.466 -13.274  -2.136
  270    HB2  MET  36           2HB      MET  36   4.574 -12.441  -0.848
  271    HB3  MET  36           3HB      MET  36   6.081 -12.003  -0.055
  272    HG2  MET  36           2HG      MET  36   5.893  -9.740  -0.984
  273    HG3  MET  36           3HG      MET  36   4.367 -10.186  -1.740
  274    HE1  MET  36           3HE      MET  36   3.012 -12.011   0.493
  275    HE2  MET  36           1HE      MET  36   2.147 -10.746  -0.381
  276    HE3  MET  36           2HE      MET  36   2.069 -10.809   1.378
  277    H    GLY  37           H        GLY  37   6.601 -10.504  -4.049
  278    HA2  GLY  37           2HA      GLY  37   5.627  -9.973  -6.059
  279    HA3  GLY  37           3HA      GLY  37   4.969 -11.601  -6.084
  280    H    ALA  38           H        ALA  38   4.324  -9.081  -3.679
  281    HA   ALA  38           HA       ALA  38   1.477  -9.489  -3.999
  282    HB1  ALA  38           3HB      ALA  38   2.446  -9.241  -1.773
  283    HB2  ALA  38           1HB      ALA  38   1.244  -7.989  -2.089
  284    HB3  ALA  38           2HB      ALA  38   2.965  -7.604  -2.173
  285    H    GLN  39           H        GLN  39   3.344  -7.914  -5.989
  286    HA   GLN  39           HA       GLN  39   2.483  -5.256  -6.144
  287    HB2  GLN  39           2HB      GLN  39   3.206  -7.105  -8.435
  288    HB3  GLN  39           3HB      GLN  39   3.161  -5.348  -8.509
  289    HG2  GLN  39           2HG      GLN  39   5.015  -6.968  -6.764
  290    HG3  GLN  39           3HG      GLN  39   5.443  -6.245  -8.313
  291   HE21  GLN  39          1HE2      GLN  39   4.725  -5.619  -4.966
  292   HE22  GLN  39          2HE2      GLN  39   5.276  -3.984  -4.954
  293    H    ASN  40           H        ASN  40   1.068  -8.198  -7.496
  294    HA   ASN  40           HA       ASN  40  -1.151  -6.758  -8.727
  295    HB2  ASN  40           2HB      ASN  40  -0.455  -9.708  -8.644
  296    HB3  ASN  40           3HB      ASN  40  -1.787  -9.014  -9.565
  297   HD21  ASN  40          1HD2      ASN  40   0.816 -10.424 -10.262
  298   HD22  ASN  40          2HD2      ASN  40   1.505  -9.417 -11.484
  299    H    GLU  41           H        GLU  41  -0.692  -7.237  -5.674
  300    HA   GLU  41           HA       GLU  41  -3.297  -8.481  -5.065
  301    HB2  GLU  41           2HB      GLU  41  -1.372  -9.661  -4.118
  302    HB3  GLU  41           3HB      GLU  41  -0.828  -8.187  -3.331
  303    HG2  GLU  41           2HG      GLU  41  -2.646  -8.209  -1.817
  304    HG3  GLU  41           3HG      GLU  41  -3.493  -9.448  -2.742
  305    H    SER  42           H        SER  42  -4.805  -7.390  -3.827
  306    HA   SER  42           HA       SER  42  -4.761  -4.559  -3.875
  307    HB2  SER  42           2HB      SER  42  -6.602  -6.488  -2.449
  308    HB3  SER  42           3HB      SER  42  -6.855  -4.744  -2.471
  309    HG   SER  42           HG       SER  42  -7.317  -4.806  -4.582
  310    H    LEU  43           H        LEU  43  -4.798  -3.039  -2.161
  311    HA   LEU  43           HA       LEU  43  -2.705  -3.214  -0.369
  312    HB2  LEU  43           2HB      LEU  43  -5.170  -1.479  -0.195
  313    HB3  LEU  43           3HB      LEU  43  -3.720  -1.239   0.763
  314    HG   LEU  43           HG       LEU  43  -3.904  -1.041  -2.251
  315   HD11  LEU  43          1HD1      LEU  43  -3.490   1.103  -0.168
  316   HD12  LEU  43          2HD1      LEU  43  -4.962   0.839  -1.106
  317   HD13  LEU  43          3HD1      LEU  43  -3.477   1.333  -1.917
  318   HD21  LEU  43          3HD2      LEU  43  -1.586  -0.218  -2.132
  319   HD22  LEU  43          1HD2      LEU  43  -1.728  -1.891  -1.593
  320   HD23  LEU  43          2HD2      LEU  43  -1.552  -0.597  -0.410
  321    H    GLU  44           H        GLU  44  -6.173  -3.755   0.368
  322    HA   GLU  44           HA       GLU  44  -5.789  -4.232   3.127
  323    HB2  GLU  44           2HB      GLU  44  -8.011  -3.752   2.198
  324    HB3  GLU  44           3HB      GLU  44  -7.994  -5.288   1.338
  325    HG2  GLU  44           2HG      GLU  44  -7.942  -6.495   3.457
  326    HG3  GLU  44           3HG      GLU  44  -7.902  -4.971   4.338
  327    H    GLN  45           H        GLN  45  -5.854  -6.466   0.368
  328    HA   GLN  45           HA       GLN  45  -5.686  -8.879   1.771
  329    HB2  GLN  45           2HB      GLN  45  -4.584  -8.131  -0.943
  330    HB3  GLN  45           3HB      GLN  45  -4.639  -9.776  -0.330
  331    HG2  GLN  45           2HG      GLN  45  -7.092  -9.630  -0.203
  332    HG3  GLN  45           3HG      GLN  45  -7.015  -7.995  -0.859
  333   HE21  GLN  45          1HE2      GLN  45  -8.242  -8.579  -2.669
  334   HE22  GLN  45          2HE2      GLN  45  -7.585  -9.533  -3.952
  335    H    GLY  46           H        GLY  46  -2.998  -7.003   0.316
  336    HA2  GLY  46           2HA      GLY  46  -0.901  -8.509   1.434
  337    HA3  GLY  46           3HA      GLY  46  -0.773  -6.851   0.877
  338    H    ALA  47           H        ALA  47  -2.638  -5.695   2.717
  339    HA   ALA  47           HA       ALA  47  -1.045  -5.158   4.949
  340    HB1  ALA  47           3HB      ALA  47  -2.846  -3.679   4.226
  341    HB2  ALA  47           1HB      ALA  47  -3.036  -4.110   5.926
  342    HB3  ALA  47           2HB      ALA  47  -4.044  -4.883   4.702
  343    H    ASN  48           H        ASN  48  -4.052  -7.132   4.906
  344    HA   ASN  48           HA       ASN  48  -3.738  -8.185   7.493
  345    HB2  ASN  48           2HB      ASN  48  -5.226  -9.290   5.102
  346    HB3  ASN  48           3HB      ASN  48  -5.291 -10.021   6.703
  347   HD21  ASN  48          1HD2      ASN  48  -6.340  -7.401   4.724
  348   HD22  ASN  48          2HD2      ASN  48  -7.430  -6.709   5.865
  349    H    ALA  49           H        ALA  49  -2.498  -9.329   4.379
  350    HA   ALA  49           HA       ALA  49  -1.443 -11.793   5.182
  351    HB1  ALA  49           3HB      ALA  49   0.102 -11.572   3.293
  352    HB2  ALA  49           1HB      ALA  49  -0.297  -9.859   3.162
  353    HB3  ALA  49           2HB      ALA  49  -1.529 -11.078   2.842
  354    H    HIS  50           H        HIS  50  -0.153  -8.522   5.586
  355    HA   HIS  50           HA       HIS  50   2.205  -9.562   7.005
  356    HB2  HIS  50           2HB      HIS  50   1.445  -6.777   6.098
  357    HB3  HIS  50           3HB      HIS  50   2.858  -7.109   7.093
  358    HD1  HIS  50           HD1      HIS  50   4.798  -6.819   5.589
  359    HD2  HIS  50           HD2      HIS  50   1.739  -8.957   3.763
  360    HE1  HIS  50           HE1      HIS  50   5.697  -7.495   3.349
  361    HE2  HIS  50           HE2      HIS  50   3.936  -9.014   2.399
  362    H    GLY  51           H        GLY  51  -0.897  -8.943   7.798
  363    HA2  GLY  51           2HA      GLY  51  -1.988  -8.723   9.808
  364    HA3  GLY  51           3HA      GLY  51  -0.431  -8.906  10.598
  365    H    LEU  52           H        LEU  52  -1.627  -6.381   8.385
  366    HA   LEU  52           HA       LEU  52  -1.168  -4.382  10.511
  367    HB2  LEU  52           2HB      LEU  52  -0.527  -4.112   7.567
  368    HB3  LEU  52           3HB      LEU  52  -0.355  -2.838   8.761
  369    HG   LEU  52           HG       LEU  52   1.195  -5.437   8.777
  370   HD11  LEU  52          1HD1      LEU  52   3.110  -4.054   8.117
  371   HD12  LEU  52          2HD1      LEU  52   2.042  -2.659   7.958
  372   HD13  LEU  52          3HD1      LEU  52   1.841  -4.050   6.892
  373   HD21  LEU  52          3HD2      LEU  52   1.484  -2.949  10.466
  374   HD22  LEU  52          1HD2      LEU  52   2.552  -4.351  10.500
  375   HD23  LEU  52          2HD2      LEU  52   0.875  -4.511  11.012
  376    H    ASN  53           H        ASN  53  -2.538  -2.584  10.549
  377    HA   ASN  53           HA       ASN  53  -5.182  -2.941   9.548
  378    HB2  ASN  53           2HB      ASN  53  -4.644  -1.761  11.675
  379    HB3  ASN  53           3HB      ASN  53  -3.938  -0.446  10.742
  380   HD21  ASN  53          1HD2      ASN  53  -6.075  -0.190  12.569
  381   HD22  ASN  53          2HD2      ASN  53  -7.470   0.322  11.685
  382    H    VAL  54           H        VAL  54  -5.633  -2.729   7.431
  383    HA   VAL  54           HA       VAL  54  -4.171  -1.293   5.536
  384    HB   VAL  54           HB       VAL  54  -5.712  -3.063   4.889
  385   HG11  VAL  54          1HG1      VAL  54  -7.496  -2.650   6.503
  386   HG12  VAL  54          2HG1      VAL  54  -8.134  -2.723   4.860
  387   HG13  VAL  54          3HG1      VAL  54  -7.931  -1.163   5.658
  388   HG21  VAL  54          3HG2      VAL  54  -5.095  -1.394   3.205
  389   HG22  VAL  54          1HG2      VAL  54  -6.483  -0.409   3.663
  390   HG23  VAL  54          2HG2      VAL  54  -6.730  -1.993   2.931
  391    H    GLU  55           H        GLU  55  -6.845  -0.221   7.575
  392    HA   GLU  55           HA       GLU  55  -7.528   2.114   6.141
  393    HB2  GLU  55           2HB      GLU  55  -7.899   1.346   9.035
  394    HB3  GLU  55           3HB      GLU  55  -8.531   2.842   8.361
  395    HG2  GLU  55           2HG      GLU  55  -9.865   1.558   6.759
  396    HG3  GLU  55           3HG      GLU  55  -9.225   0.058   7.430
  397    H    ASP  56           H        ASP  56  -5.337   1.664   8.930
  398    HA   ASP  56           HA       ASP  56  -4.597   4.384   9.140
  399    HB2  ASP  56           2HB      ASP  56  -4.223   2.658  10.916
  400    HB3  ASP  56           3HB      ASP  56  -2.924   1.983   9.933
  401    H    ILE  57           H        ILE  57  -3.321   1.716   7.206
  402    HA   ILE  57           HA       ILE  57  -1.081   3.036   6.102
  403    HB   ILE  57           HB       ILE  57  -2.854   0.968   4.764
  404   HG12  ILE  57          2HG1      ILE  57  -0.337   0.571   6.413
  405   HG13  ILE  57          3HG1      ILE  57  -1.972   0.215   6.956
  406   HG21  ILE  57          1HG2      ILE  57  -1.403   2.112   3.170
  407   HG22  ILE  57          2HG2      ILE  57  -0.881   0.444   3.399
  408   HG23  ILE  57          3HG2      ILE  57   0.004   1.761   4.173
  409   HD11  ILE  57          3HD1      ILE  57  -0.565  -1.116   4.652
  410   HD12  ILE  57          1HD1      ILE  57  -2.188  -1.486   5.234
  411   HD13  ILE  57          2HD1      ILE  57  -0.789  -1.796   6.264
  412    H    LEU  58           H        LEU  58  -4.448   2.787   4.953
  413    HA   LEU  58           HA       LEU  58  -4.234   4.348   2.646
  414    HB2  LEU  58           2HB      LEU  58  -6.594   4.032   4.509
  415    HB3  LEU  58           3HB      LEU  58  -6.680   4.754   2.915
  416    HG   LEU  58           HG       LEU  58  -5.953   1.881   3.514
  417   HD11  LEU  58          1HD1      LEU  58  -8.433   3.070   2.265
  418   HD12  LEU  58          2HD1      LEU  58  -8.318   2.361   3.876
  419   HD13  LEU  58          3HD1      LEU  58  -8.087   1.349   2.450
  420   HD21  LEU  58          3HD2      LEU  58  -6.031   1.566   1.082
  421   HD22  LEU  58          1HD2      LEU  58  -4.761   2.698   1.550
  422   HD23  LEU  58          2HD2      LEU  58  -6.272   3.301   0.866
  423    H    ARG  59           H        ARG  59  -4.604   5.330   6.011
  424    HA   ARG  59           HA       ARG  59  -5.174   8.042   5.682
  425    HB2  ARG  59           2HB      ARG  59  -5.203   7.070   7.880
  426    HB3  ARG  59           3HB      ARG  59  -3.504   6.628   7.769
  427    HG2  ARG  59           2HG      ARG  59  -2.915   9.033   7.729
  428    HG3  ARG  59           3HG      ARG  59  -4.622   9.425   7.946
  429    HD2  ARG  59           2HD      ARG  59  -3.299   9.483  10.056
  430    HD3  ARG  59           3HD      ARG  59  -4.658   8.361  10.097
  431    HE   ARG  59           HE       ARG  59  -3.187   6.618  10.300
  432   HH11  ARG  59          1HH1      ARG  59  -1.418   9.416   9.320
  433   HH12  ARG  59          2HH1      ARG  59   0.112   8.677   9.625
  434   HH21  ARG  59          1HH2      ARG  59  -1.215   5.703  10.702
  435   HH22  ARG  59          2HH2      ARG  59   0.229   6.616  10.409
  436    H    ASP  60           H        ASP  60  -1.933   6.537   5.985
  437    HA   ASP  60           HA       ASP  60  -0.493   8.922   5.490
  438    HB2  ASP  60           2HB      ASP  60   0.281   6.640   6.509
  439    HB3  ASP  60           3HB      ASP  60   0.611   6.195   4.838
  440    H    LEU  61           H        LEU  61  -1.554   6.302   3.343
  441    HA   LEU  61           HA       LEU  61  -0.293   7.141   0.985
  442    HB2  LEU  61           2HB      LEU  61  -2.907   5.674   1.346
  443    HB3  LEU  61           3HB      LEU  61  -2.067   5.838  -0.183
  444    HG   LEU  61           HG       LEU  61  -1.052   4.371   2.258
  445   HD11  LEU  61          1HD1      LEU  61  -2.817   3.168   1.110
  446   HD12  LEU  61          2HD1      LEU  61  -1.263   2.379   0.842
  447   HD13  LEU  61          3HD1      LEU  61  -1.980   3.369  -0.431
  448   HD21  LEU  61          3HD2      LEU  61   0.799   5.421   1.071
  449   HD22  LEU  61          1HD2      LEU  61   0.234   4.732  -0.452
  450   HD23  LEU  61          2HD2      LEU  61   0.819   3.675   0.833
  451    H    ASN  62           H        ASN  62  -3.641   7.857   2.079
  452    HA   ASN  62           HA       ASN  62  -4.197   9.616  -0.083
  453    HB2  ASN  62           2HB      ASN  62  -5.524   9.202   2.593
  454    HB3  ASN  62           3HB      ASN  62  -6.069  10.457   1.481
  455   HD21  ASN  62          1HD2      ASN  62  -5.961   7.063   2.112
  456   HD22  ASN  62          2HD2      ASN  62  -6.994   6.582   0.817
  457    H    ALA  63           H        ALA  63  -2.606  10.078   2.991
  458    HA   ALA  63           HA       ALA  63  -2.641  12.890   3.113
  459    HB1  ALA  63           3HB      ALA  63  -0.459  11.015   4.042
  460    HB2  ALA  63           1HB      ALA  63  -1.880  11.487   4.975
  461    HB3  ALA  63           2HB      ALA  63  -0.669  12.692   4.544
  462    H    LEU  64           H        LEU  64  -0.693  10.666   1.210
  463    HA   LEU  64           HA       LEU  64   1.177  12.560   0.204
  464    HB2  LEU  64           2HB      LEU  64   0.168  10.004  -1.062
  465    HB3  LEU  64           3HB      LEU  64   1.584  10.900  -1.579
  466    HG   LEU  64           HG       LEU  64   1.261   9.512   1.091
  467   HD11  LEU  64          1HD1      LEU  64   2.973   7.974   0.210
  468   HD12  LEU  64          2HD1      LEU  64   2.881   8.783  -1.352
  469   HD13  LEU  64          3HD1      LEU  64   1.479   7.921  -0.719
  470   HD21  LEU  64          3HD2      LEU  64   3.621  10.041   1.434
  471   HD22  LEU  64          1HD2      LEU  64   2.676  11.517   1.239
  472   HD23  LEU  64          2HD2      LEU  64   3.664  10.919  -0.096
  473    H    ALA  65           H        ALA  65  -2.118  11.811  -0.610
  474    HA   ALA  65           HA       ALA  65  -2.083  13.177  -3.161
  475    HB1  ALA  65           3HB      ALA  65  -4.435  12.227  -1.514
  476    HB2  ALA  65           1HB      ALA  65  -3.605  11.290  -2.759
  477    HB3  ALA  65           2HB      ALA  65  -4.483  12.756  -3.197
  478    H    LEU  66           H        LEU  66  -3.435  13.829   0.069
  479    HA   LEU  66           HA       LEU  66  -4.384  16.440  -0.561
  480    HB2  LEU  66           2HB      LEU  66  -3.800  15.108   2.088
  481    HB3  LEU  66           3HB      LEU  66  -4.567  16.677   1.932
  482    HG   LEU  66           HG       LEU  66  -5.705  14.090   0.848
  483   HD11  LEU  66          1HD1      LEU  66  -7.327  14.252   2.666
  484   HD12  LEU  66          2HD1      LEU  66  -6.492  15.672   3.297
  485   HD13  LEU  66          3HD1      LEU  66  -5.686  14.105   3.290
  486   HD21  LEU  66          3HD2      LEU  66  -6.920  16.851   1.060
  487   HD22  LEU  66          1HD2      LEU  66  -7.738  15.395   0.486
  488   HD23  LEU  66          2HD2      LEU  66  -6.389  16.065  -0.429
  489    H    GLU  67           H        GLU  67  -1.646  15.387   1.466
  490    HA   GLU  67           HA       GLU  67   0.279  16.355   2.111
  491    HB2  GLU  67           2HB      GLU  67  -0.052  18.002  -0.406
  492    HB3  GLU  67           3HB      GLU  67   1.424  17.893   0.549
  493    HG2  GLU  67           2HG      GLU  67   1.442  15.436   0.121
  494    HG3  GLU  67           3HG      GLU  67   0.068  15.659  -0.958
  495    H    HIS  68           H        HIS  68  -1.465  19.199   0.757
  496    HA   HIS  68           HA       HIS  68  -0.797  20.963   2.810
  497    HB2  HIS  68           2HB      HIS  68  -2.772  22.305   2.083
  498    HB3  HIS  68           3HB      HIS  68  -1.733  21.809   0.753
  499    HD1  HIS  68           HD1      HIS  68  -5.021  20.779   2.367
  500    HD2  HIS  68           HD2      HIS  68  -3.046  20.556  -1.278
  501    HE1  HIS  68           HE1      HIS  68  -6.689  19.827   0.754
  502    HE2  HIS  68           HE2      HIS  68  -5.432  19.587  -1.410
  503    H    HIS  69           H        HIS  69  -1.305  21.007   4.895
  504    HA   HIS  69           HA       HIS  69  -3.169  19.121   6.002
  505    HB2  HIS  69           2HB      HIS  69  -1.532  21.300   7.327
  506    HB3  HIS  69           3HB      HIS  69  -2.449  20.065   8.188
  507    HD1  HIS  69           HD1      HIS  69  -1.142  18.034   8.790
  508    HD2  HIS  69           HD2      HIS  69   0.528  20.043   5.556
  509    HE1  HIS  69           HE1      HIS  69   0.963  16.787   8.235
  510    HE2  HIS  69           HE2      HIS  69   1.856  17.913   6.177
  511    H    HIS  70           H        HIS  70  -3.289  22.487   5.156
  512    HA   HIS  70           HA       HIS  70  -5.722  23.057   6.576
  513    HB2  HIS  70           2HB      HIS  70  -4.328  24.457   4.281
  514    HB3  HIS  70           3HB      HIS  70  -5.816  25.051   5.011
  515    HD1  HIS  70           HD1      HIS  70  -2.315  25.578   5.205
  516    HD2  HIS  70           HD2      HIS  70  -5.367  25.324   8.013
  517    HE1  HIS  70           HE1      HIS  70  -1.430  26.701   7.265
  518    HE2  HIS  70           HE2      HIS  70  -3.362  26.706   8.873
  519    H    HIS  71           H        HIS  71  -7.814  22.845   5.894
  520    HA   HIS  71           HA       HIS  71  -8.344  21.844   3.193
  521    HB2  HIS  71           2HB      HIS  71  -9.708  19.958   4.121
  522    HB3  HIS  71           3HB      HIS  71  -7.983  19.802   4.428
  523    HD1  HIS  71           HD1      HIS  71  -7.224  19.712   6.848
  524    HD2  HIS  71           HD2      HIS  71 -11.272  20.573   6.447
  525    HE1  HIS  71           HE1      HIS  71  -8.176  19.559   9.163
  526    HE2  HIS  71           HE2      HIS  71 -10.580  20.266   8.920
  527    H    HIS  72           H        HIS  72 -10.403  22.273   2.429
  528    HA   HIS  72           HA       HIS  72 -11.880  24.292   3.909
  529    HB2  HIS  72           2HB      HIS  72 -12.241  23.186   1.115
  530    HB3  HIS  72           3HB      HIS  72 -13.200  24.496   1.800
  531    HD1  HIS  72           HD1      HIS  72 -12.074  26.806   2.016
  532    HD2  HIS  72           HD2      HIS  72  -9.596  23.881   0.411
  533    HE1  HIS  72           HE1      HIS  72 -10.085  28.033   1.108
  534    HE2  HIS  72           HE2      HIS  72  -8.671  26.266   0.021
  535    H    HIS  73           H        HIS  73 -12.191  20.908   3.186
  536    HA   HIS  73           HA       HIS  73 -14.878  20.890   4.423
  537    HB2  HIS  73           2HB      HIS  73 -13.506  18.779   2.733
  538    HB3  HIS  73           3HB      HIS  73 -15.057  18.552   3.535
  539    HD1  HIS  73           HD1      HIS  73 -14.643  18.446   0.408
  540    HD2  HIS  73           HD2      HIS  73 -16.070  21.709   2.553
  541    HE1  HIS  73           HE1      HIS  73 -15.967  19.805  -1.233
  542    HE2  HIS  73           HE2      HIS  73 -16.939  21.688   0.118
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1 -17.753  11.586  -0.960
    2    H2   MET   1           2H       MET   1 -17.878  12.462   0.482
    3    H3   MET   1           3H       MET   1 -18.001  10.777   0.505
    4    HA   MET   1           HA       MET   1 -15.587  12.330  -0.230
    5    HB2  MET   1           2HB      MET   1 -16.108  12.391   2.187
    6    HB3  MET   1           3HB      MET   1 -16.169  10.634   2.214
    7    HG2  MET   1           2HG      MET   1 -13.800  10.540   1.621
    8    HG3  MET   1           3HG      MET   1 -13.740  12.301   1.574
    9    HE1  MET   1           3HE      MET   1 -11.773  10.425   3.318
   10    HE2  MET   1           1HE      MET   1 -11.696  11.352   4.816
   11    HE3  MET   1           2HE      MET   1 -11.639  12.183   3.262
   12    H    THR   2           H        THR   2 -13.948  11.181  -1.193
   13    HA   THR   2           HA       THR   2 -14.234   8.256  -1.384
   14    HB   THR   2           HB       THR   2 -15.267   9.064  -3.415
   15    HG1  THR   2           HG1      THR   2 -14.220   7.648  -4.607
   16   HG21  THR   2          3HG2      THR   2 -12.691  10.560  -3.934
   17   HG22  THR   2          1HG2      THR   2 -14.240  11.291  -3.512
   18   HG23  THR   2          2HG2      THR   2 -14.057  10.435  -5.043
   19    H    GLN   3           H        GLN   3 -12.341   7.096  -1.647
   20    HA   GLN   3           HA       GLN   3  -9.883   8.560  -0.982
   21    HB2  GLN   3           2HB      GLN   3 -10.505   5.593  -0.902
   22    HB3  GLN   3           3HB      GLN   3  -9.001   6.332  -0.367
   23    HG2  GLN   3           2HG      GLN   3 -10.139   7.500   1.403
   24    HG3  GLN   3           3HG      GLN   3 -11.703   6.933   0.824
   25   HE21  GLN   3          1HE2      GLN   3 -10.772   4.226   0.272
   26   HE22  GLN   3          2HE2      GLN   3 -10.562   3.474   1.812
   27    H    LYS   4           H        LYS   4  -8.497   9.057  -2.600
   28    HA   LYS   4           HA       LYS   4  -8.577   7.776  -5.164
   29    HB2  LYS   4           2HB      LYS   4  -6.529   9.679  -3.990
   30    HB3  LYS   4           3HB      LYS   4  -6.535   9.129  -5.662
   31    HG2  LYS   4           2HG      LYS   4  -8.863  10.100  -5.844
   32    HG3  LYS   4           3HG      LYS   4  -8.578  10.852  -4.274
   33    HD2  LYS   4           2HD      LYS   4  -6.893  11.269  -6.755
   34    HD3  LYS   4           3HD      LYS   4  -8.124  12.384  -6.161
   35    HE2  LYS   4           2HE      LYS   4  -6.823  12.641  -4.065
   36    HE3  LYS   4           3HE      LYS   4  -5.574  11.593  -4.741
   37    HZ1  LYS   4           3HZ      LYS   4  -5.280  13.204  -6.541
   38    HZ2  LYS   4           1HZ      LYS   4  -4.994  13.911  -5.034
   39    HZ3  LYS   4           2HZ      LYS   4  -6.443  14.215  -5.842
   40    H    PHE   5           H        PHE   5  -6.689   7.355  -2.255
   41    HA   PHE   5           HA       PHE   5  -5.418   4.985  -3.473
   42    HB2  PHE   5           2HB      PHE   5  -4.770   6.422  -0.879
   43    HB3  PHE   5           3HB      PHE   5  -3.942   4.987  -1.473
   44    HD1  PHE   5           HD2      PHE   5  -2.396   5.129  -3.359
   45    HD2  PHE   5           HD1      PHE   5  -4.378   8.600  -1.875
   46    HE1  PHE   5           HE2      PHE   5  -0.821   6.556  -4.595
   47    HE2  PHE   5           HE1      PHE   5  -2.803  10.028  -3.113
   48    HZ   PHE   5           HZ       PHE   5  -1.022   9.008  -4.474
   49    H    THR   6           H        THR   6  -6.945   3.394  -3.323
   50    HA   THR   6           HA       THR   6  -8.452   3.128  -0.793
   51    HB   THR   6           HB       THR   6  -9.902   3.451  -2.708
   52    HG1  THR   6           HG1      THR   6 -11.211   2.031  -1.857
   53   HG21  THR   6          3HG2      THR   6  -8.399   2.601  -4.463
   54   HG22  THR   6          1HG2      THR   6  -9.999   1.859  -4.558
   55   HG23  THR   6          2HG2      THR   6  -8.646   0.960  -3.871
   56    H    LYS   7           H        LYS   7  -9.250   0.753  -0.481
   57    HA   LYS   7           HA       LYS   7  -6.841  -0.826  -0.118
   58    HB2  LYS   7           2HB      LYS   7  -8.327  -2.337   1.174
   59    HB3  LYS   7           3HB      LYS   7  -8.357  -0.676   1.744
   60    HG2  LYS   7           2HG      LYS   7 -10.477  -0.302   0.582
   61    HG3  LYS   7           3HG      LYS   7 -10.449  -1.968  -0.004
   62    HD2  LYS   7           2HD      LYS   7 -11.902  -1.729   1.962
   63    HD3  LYS   7           3HD      LYS   7 -10.534  -2.794   2.294
   64    HE2  LYS   7           2HE      LYS   7  -9.366  -0.869   3.353
   65    HE3  LYS   7           3HE      LYS   7 -10.820   0.101   3.116
   66    HZ1  LYS   7           3HZ      LYS   7 -10.635  -2.380   4.741
   67    HZ2  LYS   7           1HZ      LYS   7 -12.034  -1.455   4.510
   68    HZ3  LYS   7           2HZ      LYS   7 -10.719  -0.799   5.345
   69    H    ASP   8           H        ASP   8  -9.468  -0.732  -2.337
   70    HA   ASP   8           HA       ASP   8  -9.405  -3.492  -3.130
   71    HB2  ASP   8           2HB      ASP   8 -11.414  -2.124  -3.442
   72    HB3  ASP   8           3HB      ASP   8 -10.538  -1.058  -4.535
   73    H    MET   9           H        MET   9  -7.757  -0.575  -4.169
   74    HA   MET   9           HA       MET   9  -6.756  -1.616  -6.630
   75    HB2  MET   9           2HB      MET   9  -5.347   0.364  -6.693
   76    HB3  MET   9           3HB      MET   9  -6.974   0.803  -6.199
   77    HG2  MET   9           2HG      MET   9  -6.133   0.719  -3.820
   78    HG3  MET   9           3HG      MET   9  -4.510   0.620  -4.495
   79    HE1  MET   9           3HE      MET   9  -3.464   2.516  -6.077
   80    HE2  MET   9           1HE      MET   9  -4.278   4.031  -6.461
   81    HE3  MET   9           2HE      MET   9  -4.881   2.513  -7.127
   82    H    THR  10           H        THR  10  -4.691  -2.386  -7.134
   83    HA   THR  10           HA       THR  10  -3.488  -3.976  -5.057
   84    HB   THR  10           HB       THR  10  -2.128  -4.968  -6.752
   85    HG1  THR  10           HG1      THR  10  -1.651  -4.008  -8.639
   86   HG21  THR  10          3HG2      THR  10  -3.765  -5.602  -8.483
   87   HG22  THR  10          1HG2      THR  10  -4.824  -4.296  -7.948
   88   HG23  THR  10          2HG2      THR  10  -4.471  -5.644  -6.867
   89    H    PHE  11           H        PHE  11  -1.185  -4.013  -4.590
   90    HA   PHE  11           HA       PHE  11  -0.049  -1.595  -3.846
   91    HB2  PHE  11           2HB      PHE  11   1.270  -4.245  -4.471
   92    HB3  PHE  11           3HB      PHE  11   2.149  -2.876  -3.800
   93    HD1  PHE  11           HD1      PHE  11  -0.349  -5.467  -3.135
   94    HD2  PHE  11           HD2      PHE  11   1.794  -2.166  -1.510
   95    HE1  PHE  11           HE1      PHE  11  -1.026  -6.145  -0.872
   96    HE2  PHE  11           HE2      PHE  11   1.117  -2.840   0.755
   97    HZ   PHE  11           HZ       PHE  11  -0.295  -4.832   1.077
   98    H    ALA  12           H        ALA  12   0.429  -3.399  -6.867
   99    HA   ALA  12           HA       ALA  12   2.400  -1.795  -8.032
  100    HB1  ALA  12           3HB      ALA  12   0.162  -3.254  -9.443
  101    HB2  ALA  12           1HB      ALA  12   1.696  -3.968  -8.941
  102    HB3  ALA  12           2HB      ALA  12   1.672  -2.704 -10.172
  103    H    GLN  13           H        GLN  13  -1.161  -1.514  -8.274
  104    HA   GLN  13           HA       GLN  13  -1.294   0.712  -9.959
  105    HB2  GLN  13           2HB      GLN  13  -3.165  -0.023  -7.687
  106    HB3  GLN  13           3HB      GLN  13  -3.537   1.118  -8.972
  107    HG2  GLN  13           2HG      GLN  13  -3.419  -0.661 -10.622
  108    HG3  GLN  13           3HG      GLN  13  -2.958  -1.814  -9.373
  109   HE21  GLN  13          1HE2      GLN  13  -5.374   0.692  -8.943
  110   HE22  GLN  13          2HE2      GLN  13  -6.725  -0.376  -8.822
  111    H    ALA  14           H        ALA  14  -1.182   0.603  -6.398
  112    HA   ALA  14           HA       ALA  14  -1.323   3.360  -5.900
  113    HB1  ALA  14           3HB      ALA  14  -1.636   1.661  -4.166
  114    HB2  ALA  14           1HB      ALA  14  -0.418   2.846  -3.692
  115    HB3  ALA  14           2HB      ALA  14   0.077   1.247  -4.254
  116    H    LEU  15           H        LEU  15   1.579   1.284  -6.190
  117    HA   LEU  15           HA       LEU  15   3.509   3.270  -5.768
  118    HB2  LEU  15           2HB      LEU  15   3.687   0.762  -7.445
  119    HB3  LEU  15           3HB      LEU  15   5.064   1.733  -6.959
  120    HG   LEU  15           HG       LEU  15   3.219   0.236  -5.085
  121   HD11  LEU  15          1HD1      LEU  15   6.073  -0.327  -5.905
  122   HD12  LEU  15          2HD1      LEU  15   4.650  -1.264  -6.361
  123   HD13  LEU  15          3HD1      LEU  15   5.160  -1.204  -4.676
  124   HD21  LEU  15          3HD2      LEU  15   5.720   1.829  -4.497
  125   HD22  LEU  15          1HD2      LEU  15   4.815   0.857  -3.333
  126   HD23  LEU  15          2HD2      LEU  15   4.072   2.280  -4.061
  127    H    GLN  16           H        GLN  16   1.778   2.376  -8.707
  128    HA   GLN  16           HA       GLN  16   3.399   4.048 -10.416
  129    HB2  GLN  16           2HB      GLN  16   0.754   2.671 -10.926
  130    HB3  GLN  16           3HB      GLN  16   1.709   3.492 -12.153
  131    HG2  GLN  16           2HG      GLN  16   2.577   1.078 -10.566
  132    HG3  GLN  16           3HG      GLN  16   2.010   1.072 -12.234
  133   HE21  GLN  16          1HE2      GLN  16   4.629   1.910 -10.108
  134   HE22  GLN  16          2HE2      GLN  16   5.817   2.141 -11.339
  135    H    THR  17           H        THR  17   0.696   4.574  -8.364
  136    HA   THR  17           HA       THR  17  -0.389   6.864  -9.726
  137    HB   THR  17           HB       THR  17  -0.696   6.081  -6.807
  138    HG1  THR  17           HG1      THR  17  -1.454   4.516  -8.423
  139   HG21  THR  17          3HG2      THR  17  -1.310   8.414  -7.203
  140   HG22  THR  17          1HG2      THR  17  -2.752   7.443  -6.897
  141   HG23  THR  17          2HG2      THR  17  -2.350   7.932  -8.544
  142    H    HIS  18           H        HIS  18   1.423   6.592  -6.647
  143    HA   HIS  18           HA       HIS  18   2.960   8.985  -7.354
  144    HB2  HIS  18           2HB      HIS  18   1.041   8.798  -5.116
  145    HB3  HIS  18           3HB      HIS  18   2.625   9.409  -4.659
  146    HD1  HIS  18           HD1      HIS  18   0.513  10.162  -7.759
  147    HD2  HIS  18           HD2      HIS  18   2.356  12.090  -4.574
  148    HE1  HIS  18           HE1      HIS  18   0.180  12.611  -8.171
  149    HE2  HIS  18           HE2      HIS  18   1.466  13.752  -6.335
  150    HA   PRO  19           HA       PRO  19   6.214   6.167  -6.167
  151    HB2  PRO  19           2HB      PRO  19   8.194   8.109  -5.946
  152    HB3  PRO  19           3HB      PRO  19   7.724   7.300  -7.445
  153    HG2  PRO  19           2HG      PRO  19   6.880   9.973  -6.383
  154    HG3  PRO  19           3HG      PRO  19   7.289   9.505  -8.045
  155    HD2  PRO  19           2HD      PRO  19   4.741   9.795  -7.284
  156    HD3  PRO  19           3HD      PRO  19   5.214   8.497  -8.402
  157    H    GLY  20           H        GLY  20   5.336   9.011  -4.291
  158    HA2  GLY  20           2HA      GLY  20   6.901   8.626  -2.001
  159    HA3  GLY  20           3HA      GLY  20   5.318   9.384  -2.024
  160    H    VAL  21           H        VAL  21   4.002   6.954  -3.038
  161    HA   VAL  21           HA       VAL  21   3.145   5.773  -0.676
  162    HB   VAL  21           HB       VAL  21   3.125   4.600  -3.471
  163   HG11  VAL  21          1HG1      VAL  21   2.779   2.825  -1.849
  164   HG12  VAL  21          2HG1      VAL  21   1.266   3.183  -2.677
  165   HG13  VAL  21          3HG1      VAL  21   1.532   3.772  -1.036
  166   HG21  VAL  21          3HG2      VAL  21   0.819   5.443  -3.567
  167   HG22  VAL  21          1HG2      VAL  21   1.977   6.750  -3.318
  168   HG23  VAL  21          2HG2      VAL  21   1.010   6.158  -1.966
  169    H    ALA  22           H        ALA  22   5.813   4.836  -2.790
  170    HA   ALA  22           HA       ALA  22   6.375   2.289  -1.802
  171    HB1  ALA  22           3HB      ALA  22   7.437   3.218  -3.796
  172    HB2  ALA  22           1HB      ALA  22   8.644   2.624  -2.656
  173    HB3  ALA  22           2HB      ALA  22   8.340   4.357  -2.797
  174    H    GLY  23           H        GLY  23   7.640   5.438  -0.674
  175    HA2  GLY  23           2HA      GLY  23   9.286   4.459   1.388
  176    HA3  GLY  23           3HA      GLY  23   8.589   6.072   1.321
  177    H    VAL  24           H        VAL  24   5.874   5.461   1.462
  178    HA   VAL  24           HA       VAL  24   5.473   5.134   4.241
  179    HB   VAL  24           HB       VAL  24   3.417   4.844   2.033
  180   HG11  VAL  24          1HG1      VAL  24   2.617   3.987   4.177
  181   HG12  VAL  24          2HG1      VAL  24   1.787   5.484   3.753
  182   HG13  VAL  24          3HG1      VAL  24   3.069   5.501   4.965
  183   HG21  VAL  24          3HG2      VAL  24   4.556   6.975   1.826
  184   HG22  VAL  24          1HG2      VAL  24   4.328   7.304   3.544
  185   HG23  VAL  24          2HG2      VAL  24   2.933   7.239   2.465
  186    H    LEU  25           H        LEU  25   4.791   2.885   1.535
  187    HA   LEU  25           HA       LEU  25   3.803   0.750   3.059
  188    HB2  LEU  25           2HB      LEU  25   5.361   0.658   0.468
  189    HB3  LEU  25           3HB      LEU  25   4.469  -0.693   1.146
  190    HG   LEU  25           HG       LEU  25   3.290   1.914   0.158
  191   HD11  LEU  25          1HD1      LEU  25   3.111  -0.892  -0.946
  192   HD12  LEU  25          2HD1      LEU  25   4.011   0.454  -1.649
  193   HD13  LEU  25          3HD1      LEU  25   2.252   0.519  -1.567
  194   HD21  LEU  25          3HD2      LEU  25   1.887  -0.510   1.297
  195   HD22  LEU  25          1HD2      LEU  25   1.109   0.914   0.604
  196   HD23  LEU  25          2HD2      LEU  25   2.046   1.059   2.089
  197    H    ARG  26           H        ARG  26   7.149   1.386   1.990
  198    HA   ARG  26           HA       ARG  26   8.315  -0.838   3.271
  199    HB2  ARG  26           2HB      ARG  26   9.555   1.835   2.564
  200    HB3  ARG  26           3HB      ARG  26  10.458   0.409   3.064
  201    HG2  ARG  26           2HG      ARG  26   9.565  -0.809   1.102
  202    HG3  ARG  26           3HG      ARG  26   8.757   0.671   0.586
  203    HD2  ARG  26           2HD      ARG  26  10.853   0.365  -0.624
  204    HD3  ARG  26           3HD      ARG  26  10.933   1.793   0.408
  205    HE   ARG  26           HE       ARG  26  12.330   0.549   1.920
  206   HH11  ARG  26          1HH1      ARG  26  11.802  -0.963  -1.132
  207   HH12  ARG  26          2HH1      ARG  26  13.188  -1.984  -0.985
  208   HH21  ARG  26          1HH2      ARG  26  14.093  -0.782   2.093
  209   HH22  ARG  26          2HH2      ARG  26  14.459  -1.885   0.813
  210    H    SER  27           H        SER  27   7.422   2.335   4.486
  211    HA   SER  27           HA       SER  27   8.774   2.197   6.983
  212    HB2  SER  27           2HB      SER  27   7.894   4.317   6.126
  213    HB3  SER  27           3HB      SER  27   6.245   3.699   6.228
  214    HG   SER  27           HG       SER  27   7.332   5.054   8.044
  215    H    TYR  28           H        TYR  28   5.556   1.132   5.938
  216    HA   TYR  28           HA       TYR  28   4.839   0.153   8.577
  217    HB2  TYR  28           2HB      TYR  28   3.490   0.105   5.883
  218    HB3  TYR  28           3HB      TYR  28   2.853  -0.824   7.233
  219    HD1  TYR  28           HD2      TYR  28   3.930   2.679   6.421
  220    HD2  TYR  28           HD1      TYR  28   1.268   0.165   8.599
  221    HE1  TYR  28           HE2      TYR  28   2.704   4.662   7.207
  222    HE2  TYR  28           HE1      TYR  28   0.043   2.140   9.389
  223    HH   TYR  28           HH       TYR  28   0.275   4.451   9.679
  224    H    ASN  29           H        ASN  29   6.994  -1.019   6.484
  225    HA   ASN  29           HA       ASN  29   7.972  -3.021   6.084
  226    HB2  ASN  29           2HB      ASN  29   7.652  -3.503   8.475
  227    HB3  ASN  29           3HB      ASN  29   6.044  -4.131   8.140
  228   HD21  ASN  29          1HD2      ASN  29   9.454  -4.698   7.842
  229   HD22  ASN  29          2HD2      ASN  29   9.342  -6.376   7.452
  230    H    LEU  30           H        LEU  30   6.608  -2.379   4.091
  231    HA   LEU  30           HA       LEU  30   5.255  -4.855   3.226
  232    HB2  LEU  30           2HB      LEU  30   4.413  -2.019   2.587
  233    HB3  LEU  30           3HB      LEU  30   3.793  -3.433   1.754
  234    HG   LEU  30           HG       LEU  30   3.469  -2.941   4.723
  235   HD11  LEU  30          1HD1      LEU  30   1.137  -2.393   4.203
  236   HD12  LEU  30          2HD1      LEU  30   1.493  -2.507   2.480
  237   HD13  LEU  30          3HD1      LEU  30   2.254  -1.251   3.456
  238   HD21  LEU  30          3HD2      LEU  30   3.410  -5.304   4.101
  239   HD22  LEU  30          1HD2      LEU  30   2.185  -4.961   2.877
  240   HD23  LEU  30          2HD2      LEU  30   1.812  -4.740   4.587
  241    H    GLY  31           H        GLY  31   8.003  -3.374   2.940
  242    HA2  GLY  31           2HA      GLY  31   8.319  -2.687   0.215
  243    HA3  GLY  31           3HA      GLY  31   9.614  -3.109   1.321
  244    H    CYS  32           H        CYS  32   8.189  -5.792   1.739
  245    HA   CYS  32           HA       CYS  32   9.673  -7.201  -0.281
  246    HB2  CYS  32           2HB      CYS  32   9.546  -8.051   2.018
  247    HB3  CYS  32           3HB      CYS  32   7.806  -8.264   1.856
  248    HG   CYS  32           HG       CYS  32   8.606 -10.803   1.641
  249    H    ILE  33           H        ILE  33   6.704  -5.765  -0.493
  250    HA   ILE  33           HA       ILE  33   4.946  -7.643  -1.522
  251    HB   ILE  33           HB       ILE  33   3.952  -5.751  -2.874
  252   HG12  ILE  33          2HG1      ILE  33   6.203  -4.200  -1.552
  253   HG13  ILE  33          3HG1      ILE  33   6.015  -4.479  -3.279
  254   HG21  ILE  33          1HG2      ILE  33   4.461  -5.307   0.067
  255   HG22  ILE  33          2HG2      ILE  33   3.166  -6.269  -0.644
  256   HG23  ILE  33          3HG2      ILE  33   3.193  -4.522  -0.874
  257   HD11  ILE  33          3HD1      ILE  33   5.355  -2.228  -2.655
  258   HD12  ILE  33          1HD1      ILE  33   4.153  -2.871  -1.539
  259   HD13  ILE  33          2HD1      ILE  33   3.978  -3.138  -3.275
  260    H    GLY  34           H        GLY  34   7.645  -6.092  -3.200
  261    HA2  GLY  34           2HA      GLY  34   7.014  -7.058  -5.801
  262    HA3  GLY  34           3HA      GLY  34   8.601  -6.544  -5.250
  263    H    CYS  35           H        CYS  35   9.094  -8.350  -3.223
  264    HA   CYS  35           HA       CYS  35   9.996 -10.617  -4.667
  265    HB2  CYS  35           2HB      CYS  35   9.827 -10.249  -1.665
  266    HB3  CYS  35           3HB      CYS  35  10.812 -11.440  -2.511
  267    HG   CYS  35           HG       CYS  35  12.891  -9.945  -2.495
  268    H    MET  36           H        MET  36   7.472 -10.311  -2.142
  269    HA   MET  36           HA       MET  36   6.669 -13.056  -2.370
  270    HB2  MET  36           2HB      MET  36   4.875 -12.466  -0.810
  271    HB3  MET  36           3HB      MET  36   6.424 -11.854  -0.259
  272    HG2  MET  36           2HG      MET  36   5.811  -9.624  -1.152
  273    HG3  MET  36           3HG      MET  36   4.224 -10.265  -1.566
  274    HE1  MET  36           3HE      MET  36   3.717 -12.231   0.952
  275    HE2  MET  36           1HE      MET  36   2.490 -11.177   0.250
  276    HE3  MET  36           2HE      MET  36   2.785 -11.150   1.988
  277    H    GLY  37           H        GLY  37   6.221 -10.646  -4.536
  278    HA2  GLY  37           2HA      GLY  37   4.990 -10.639  -6.487
  279    HA3  GLY  37           3HA      GLY  37   4.259 -12.149  -5.976
  280    H    ALA  38           H        ALA  38   3.942  -9.597  -3.717
  281    HA   ALA  38           HA       ALA  38   1.090  -9.679  -3.920
  282    HB1  ALA  38           3HB      ALA  38   2.212  -9.446  -1.766
  283    HB2  ALA  38           1HB      ALA  38   1.106  -8.104  -2.051
  284    HB3  ALA  38           2HB      ALA  38   2.843  -7.873  -2.252
  285    H    GLN  39           H        GLN  39   3.121  -8.136  -5.931
  286    HA   GLN  39           HA       GLN  39   2.226  -5.500  -6.140
  287    HB2  GLN  39           2HB      GLN  39   3.158  -7.397  -8.304
  288    HB3  GLN  39           3HB      GLN  39   2.919  -5.673  -8.544
  289    HG2  GLN  39           2HG      GLN  39   4.855  -6.905  -6.590
  290    HG3  GLN  39           3HG      GLN  39   5.270  -6.263  -8.179
  291   HE21  GLN  39          1HE2      GLN  39   4.262  -5.459  -4.949
  292   HE22  GLN  39          2HE2      GLN  39   4.630  -3.777  -5.048
  293    H    ASN  40           H        ASN  40   0.815  -8.464  -7.457
  294    HA   ASN  40           HA       ASN  40  -1.329  -7.006  -8.794
  295    HB2  ASN  40           2HB      ASN  40  -0.855  -9.990  -8.545
  296    HB3  ASN  40           3HB      ASN  40  -2.060  -9.222  -9.575
  297   HD21  ASN  40          1HD2      ASN  40   1.284  -9.975  -9.167
  298   HD22  ASN  40          2HD2      ASN  40   1.801  -9.468 -10.734
  299    H    GLU  41           H        GLU  41  -0.835  -7.630  -5.686
  300    HA   GLU  41           HA       GLU  41  -3.545  -8.614  -5.094
  301    HB2  GLU  41           2HB      GLU  41  -1.570  -9.818  -4.133
  302    HB3  GLU  41           3HB      GLU  41  -1.166  -8.360  -3.238
  303    HG2  GLU  41           2HG      GLU  41  -3.129  -8.517  -1.916
  304    HG3  GLU  41           3HG      GLU  41  -3.804  -9.775  -2.949
  305    H    SER  42           H        SER  42  -4.893  -7.482  -3.620
  306    HA   SER  42           HA       SER  42  -4.746  -4.648  -3.883
  307    HB2  SER  42           2HB      SER  42  -6.842  -4.601  -2.612
  308    HB3  SER  42           3HB      SER  42  -6.900  -5.849  -3.854
  309    HG   SER  42           HG       SER  42  -7.691  -6.551  -1.797
  310    H    LEU  43           H        LEU  43  -4.647  -3.053  -2.232
  311    HA   LEU  43           HA       LEU  43  -2.498  -3.279  -0.510
  312    HB2  LEU  43           2HB      LEU  43  -4.847  -1.392  -0.404
  313    HB3  LEU  43           3HB      LEU  43  -3.428  -1.216   0.611
  314    HG   LEU  43           HG       LEU  43  -3.444  -1.099  -2.415
  315   HD11  LEU  43          1HD1      LEU  43  -3.037   1.097  -0.386
  316   HD12  LEU  43          2HD1      LEU  43  -4.487   0.858  -1.359
  317   HD13  LEU  43          3HD1      LEU  43  -2.959   1.263  -2.140
  318   HD21  LEU  43          3HD2      LEU  43  -1.105  -0.389  -2.179
  319   HD22  LEU  43          1HD2      LEU  43  -1.354  -2.024  -1.569
  320   HD23  LEU  43          2HD2      LEU  43  -1.194  -0.675  -0.440
  321    H    GLU  44           H        GLU  44  -5.931  -3.828   0.265
  322    HA   GLU  44           HA       GLU  44  -5.541  -3.968   3.076
  323    HB2  GLU  44           2HB      GLU  44  -7.753  -3.552   2.080
  324    HB3  GLU  44           3HB      GLU  44  -7.771  -5.186   1.431
  325    HG2  GLU  44           2HG      GLU  44  -7.818  -6.129   3.645
  326    HG3  GLU  44           3HG      GLU  44  -7.606  -4.538   4.372
  327    H    GLN  45           H        GLN  45  -5.625  -6.500   0.569
  328    HA   GLN  45           HA       GLN  45  -5.488  -8.715   2.309
  329    HB2  GLN  45           2HB      GLN  45  -4.506  -8.419  -0.538
  330    HB3  GLN  45           3HB      GLN  45  -4.609  -9.954   0.316
  331    HG2  GLN  45           2HG      GLN  45  -7.024  -9.701   0.517
  332    HG3  GLN  45           3HG      GLN  45  -6.940  -8.130  -0.279
  333   HE21  GLN  45          1HE2      GLN  45  -8.296  -8.789  -1.941
  334   HE22  GLN  45          2HE2      GLN  45  -7.784  -9.875  -3.181
  335    H    GLY  46           H        GLY  46  -2.842  -7.072   0.535
  336    HA2  GLY  46           2HA      GLY  46  -0.704  -8.465   1.695
  337    HA3  GLY  46           3HA      GLY  46  -0.608  -6.839   1.036
  338    H    ALA  47           H        ALA  47  -2.456  -5.616   2.866
  339    HA   ALA  47           HA       ALA  47  -0.809  -4.955   5.046
  340    HB1  ALA  47           3HB      ALA  47  -2.628  -3.518   4.216
  341    HB2  ALA  47           1HB      ALA  47  -2.751  -3.797   5.954
  342    HB3  ALA  47           2HB      ALA  47  -3.810  -4.666   4.843
  343    H    ASN  48           H        ASN  48  -3.820  -6.920   5.084
  344    HA   ASN  48           HA       ASN  48  -3.588  -7.826   7.725
  345    HB2  ASN  48           2HB      ASN  48  -4.933  -9.081   5.327
  346    HB3  ASN  48           3HB      ASN  48  -5.052  -9.755   6.949
  347   HD21  ASN  48          1HD2      ASN  48  -6.127  -7.291   4.810
  348   HD22  ASN  48          2HD2      ASN  48  -7.274  -6.577   5.884
  349    H    ALA  49           H        ALA  49  -2.202  -9.116   4.748
  350    HA   ALA  49           HA       ALA  49  -1.216 -11.555   5.674
  351    HB1  ALA  49           3HB      ALA  49   0.388 -11.435   3.840
  352    HB2  ALA  49           1HB      ALA  49   0.054  -9.715   3.646
  353    HB3  ALA  49           2HB      ALA  49  -1.210 -10.900   3.316
  354    H    HIS  50           H        HIS  50   0.279  -8.327   5.857
  355    HA   HIS  50           HA       HIS  50   2.536  -9.392   7.385
  356    HB2  HIS  50           2HB      HIS  50   1.905  -6.647   6.296
  357    HB3  HIS  50           3HB      HIS  50   3.254  -6.934   7.390
  358    HD1  HIS  50           HD1      HIS  50   5.337  -6.958   6.070
  359    HD2  HIS  50           HD2      HIS  50   2.231  -8.860   4.056
  360    HE1  HIS  50           HE1      HIS  50   6.346  -7.833   3.946
  361    HE2  HIS  50           HE2      HIS  50   4.503  -9.160   2.860
  362    H    GLY  51           H        GLY  51  -0.535  -8.614   8.168
  363    HA2  GLY  51           2HA      GLY  51  -1.568  -8.292  10.206
  364    HA3  GLY  51           3HA      GLY  51   0.015  -8.339  10.965
  365    H    LEU  52           H        LEU  52  -1.634  -6.159   8.667
  366    HA   LEU  52           HA       LEU  52  -0.958  -3.889  10.432
  367    HB2  LEU  52           2HB      LEU  52  -0.777  -3.984   7.415
  368    HB3  LEU  52           3HB      LEU  52  -0.558  -2.539   8.387
  369    HG   LEU  52           HG       LEU  52   1.208  -4.991   8.537
  370   HD11  LEU  52          1HD1      LEU  52   2.866  -3.643   7.360
  371   HD12  LEU  52          2HD1      LEU  52   1.696  -2.333   7.191
  372   HD13  LEU  52          3HD1      LEU  52   1.419  -3.874   6.377
  373   HD21  LEU  52          3HD2      LEU  52   2.700  -3.525   9.828
  374   HD22  LEU  52          1HD2      LEU  52   1.145  -3.742  10.626
  375   HD23  LEU  52          2HD2      LEU  52   1.492  -2.243   9.763
  376    H    ASN  53           H        ASN  53  -2.514  -2.368  10.722
  377    HA   ASN  53           HA       ASN  53  -5.183  -2.841   9.834
  378    HB2  ASN  53           2HB      ASN  53  -4.783  -1.780  11.984
  379    HB3  ASN  53           3HB      ASN  53  -3.936  -0.447  11.207
  380   HD21  ASN  53          1HD2      ASN  53  -5.344   1.040  12.114
  381   HD22  ASN  53          2HD2      ASN  53  -6.966   1.237  11.552
  382    H    VAL  54           H        VAL  54  -5.592  -2.663   7.708
  383    HA   VAL  54           HA       VAL  54  -4.316  -1.109   5.818
  384    HB   VAL  54           HB       VAL  54  -5.817  -2.942   5.228
  385   HG11  VAL  54          1HG1      VAL  54  -7.569  -2.550   6.890
  386   HG12  VAL  54          2HG1      VAL  54  -8.247  -2.685   5.268
  387   HG13  VAL  54          3HG1      VAL  54  -8.077  -1.099   6.023
  388   HG21  VAL  54          3HG2      VAL  54  -6.683  -0.320   3.994
  389   HG22  VAL  54          1HG2      VAL  54  -6.914  -1.921   3.288
  390   HG23  VAL  54          2HG2      VAL  54  -5.285  -1.283   3.514
  391    H    GLU  55           H        GLU  55  -6.998  -0.185   7.920
  392    HA   GLU  55           HA       GLU  55  -7.761   2.186   6.616
  393    HB2  GLU  55           2HB      GLU  55  -7.919   1.478   9.557
  394    HB3  GLU  55           3HB      GLU  55  -8.755   2.830   8.804
  395    HG2  GLU  55           2HG      GLU  55  -9.176  -0.087   8.171
  396    HG3  GLU  55           3HG      GLU  55 -10.240   0.932   9.141
  397    H    ASP  56           H        ASP  56  -5.222   1.564   8.994
  398    HA   ASP  56           HA       ASP  56  -4.591   4.324   9.427
  399    HB2  ASP  56           2HB      ASP  56  -4.101   2.396  11.013
  400    HB3  ASP  56           3HB      ASP  56  -2.782   1.951   9.935
  401    H    ILE  57           H        ILE  57  -3.503   1.829   7.211
  402    HA   ILE  57           HA       ILE  57  -1.214   3.196   6.193
  403    HB   ILE  57           HB       ILE  57  -2.897   1.073   4.837
  404   HG12  ILE  57          2HG1      ILE  57  -0.422   0.781   6.570
  405   HG13  ILE  57          3HG1      ILE  57  -2.056   0.321   7.030
  406   HG21  ILE  57          1HG2      ILE  57  -0.874   0.610   3.521
  407   HG22  ILE  57          2HG2      ILE  57  -0.057   1.961   4.308
  408   HG23  ILE  57          3HG2      ILE  57  -1.453   2.257   3.271
  409   HD11  ILE  57          3HD1      ILE  57  -2.080  -1.360   5.255
  410   HD12  ILE  57          1HD1      ILE  57  -0.753  -1.615   6.387
  411   HD13  ILE  57          2HD1      ILE  57  -0.437  -0.901   4.805
  412    H    LEU  58           H        LEU  58  -4.485   2.718   4.788
  413    HA   LEU  58           HA       LEU  58  -4.181   4.327   2.526
  414    HB2  LEU  58           2HB      LEU  58  -6.699   3.889   4.147
  415    HB3  LEU  58           3HB      LEU  58  -6.642   4.490   2.501
  416    HG   LEU  58           HG       LEU  58  -5.832   1.728   3.424
  417   HD11  LEU  58          1HD1      LEU  58  -8.144   2.632   1.706
  418   HD12  LEU  58          2HD1      LEU  58  -8.252   2.108   3.386
  419   HD13  LEU  58          3HD1      LEU  58  -7.747   0.968   2.140
  420   HD21  LEU  58          3HD2      LEU  58  -4.405   2.488   1.594
  421   HD22  LEU  58          1HD2      LEU  58  -5.831   2.898   0.639
  422   HD23  LEU  58          2HD2      LEU  58  -5.503   1.215   1.059
  423    H    ARG  59           H        ARG  59  -5.064   5.185   5.807
  424    HA   ARG  59           HA       ARG  59  -5.793   7.835   5.614
  425    HB2  ARG  59           2HB      ARG  59  -5.881   6.699   7.711
  426    HB3  ARG  59           3HB      ARG  59  -4.163   6.337   7.665
  427    HG2  ARG  59           2HG      ARG  59  -3.963   8.983   7.701
  428    HG3  ARG  59           3HG      ARG  59  -5.559   8.849   8.445
  429    HD2  ARG  59           2HD      ARG  59  -3.747   8.880  10.121
  430    HD3  ARG  59           3HD      ARG  59  -4.667   7.373  10.159
  431    HE   ARG  59           HE       ARG  59  -2.804   6.389   8.843
  432   HH11  ARG  59          1HH1      ARG  59  -2.235   9.148  10.821
  433   HH12  ARG  59          2HH1      ARG  59  -0.537   8.851  10.924
  434   HH21  ARG  59          1HH2      ARG  59  -0.631   6.015   8.980
  435   HH22  ARG  59          2HH2      ARG  59   0.356   7.098   9.897
  436    H    ASP  60           H        ASP  60  -2.445   6.611   6.054
  437    HA   ASP  60           HA       ASP  60  -1.282   9.214   5.795
  438    HB2  ASP  60           2HB      ASP  60  -0.389   7.080   7.026
  439    HB3  ASP  60           3HB      ASP  60   0.292   6.671   5.455
  440    H    LEU  61           H        LEU  61  -1.864   6.537   3.571
  441    HA   LEU  61           HA       LEU  61  -0.252   7.395   1.425
  442    HB2  LEU  61           2HB      LEU  61  -2.818   5.798   1.390
  443    HB3  LEU  61           3HB      LEU  61  -1.780   6.029  -0.006
  444    HG   LEU  61           HG       LEU  61  -1.028   4.592   2.548
  445   HD11  LEU  61          1HD1      LEU  61  -1.524   3.549  -0.246
  446   HD12  LEU  61          2HD1      LEU  61  -2.570   3.317   1.156
  447   HD13  LEU  61          3HD1      LEU  61  -0.962   2.596   1.128
  448   HD21  LEU  61          3HD2      LEU  61   0.890   5.778   1.586
  449   HD22  LEU  61          1HD2      LEU  61   0.585   5.017   0.025
  450   HD23  LEU  61          2HD2      LEU  61   1.063   4.032   1.408
  451    H    ASN  62           H        ASN  62  -3.760   7.976   1.968
  452    HA   ASN  62           HA       ASN  62  -4.041   9.707  -0.266
  453    HB2  ASN  62           2HB      ASN  62  -5.726   9.331   2.213
  454    HB3  ASN  62           3HB      ASN  62  -6.155  10.479   0.946
  455   HD21  ASN  62          1HD2      ASN  62  -5.925   7.141   1.810
  456   HD22  ASN  62          2HD2      ASN  62  -6.730   6.509   0.420
  457    H    ALA  63           H        ALA  63  -2.897  10.229   2.982
  458    HA   ALA  63           HA       ALA  63  -3.094  13.027   3.140
  459    HB1  ALA  63           3HB      ALA  63  -0.909  11.280   4.284
  460    HB2  ALA  63           1HB      ALA  63  -2.471  11.591   5.042
  461    HB3  ALA  63           2HB      ALA  63  -1.328  12.913   4.805
  462    H    LEU  64           H        LEU  64  -0.745  10.968   1.493
  463    HA   LEU  64           HA       LEU  64   1.188  12.878   0.803
  464    HB2  LEU  64           2HB      LEU  64   0.217  10.523  -0.830
  465    HB3  LEU  64           3HB      LEU  64   1.714  11.394  -1.104
  466    HG   LEU  64           HG       LEU  64   1.065   9.804   1.386
  467   HD11  LEU  64          1HD1      LEU  64   2.689   8.180   0.555
  468   HD12  LEU  64          2HD1      LEU  64   2.878   9.115  -0.929
  469   HD13  LEU  64          3HD1      LEU  64   1.331   8.354  -0.557
  470   HD21  LEU  64          3HD2      LEU  64   3.636  11.126   0.510
  471   HD22  LEU  64          1HD2      LEU  64   3.435  10.104   1.933
  472   HD23  LEU  64          2HD2      LEU  64   2.595  11.650   1.834
  473    H    ALA  65           H        ALA  65  -1.939  12.160  -0.633
  474    HA   ALA  65           HA       ALA  65  -1.588  13.888  -2.910
  475    HB1  ALA  65           3HB      ALA  65  -3.946  13.400  -3.374
  476    HB2  ALA  65           1HB      ALA  65  -4.091  12.603  -1.807
  477    HB3  ALA  65           2HB      ALA  65  -3.037  11.925  -3.048
  478    H    LEU  66           H        LEU  66  -3.017  14.155   0.285
  479    HA   LEU  66           HA       LEU  66  -4.190  16.758  -0.247
  480    HB2  LEU  66           2HB      LEU  66  -3.945  15.206   2.335
  481    HB3  LEU  66           3HB      LEU  66  -4.881  16.673   2.119
  482    HG   LEU  66           HG       LEU  66  -5.418  14.028   0.751
  483   HD11  LEU  66          1HD1      LEU  66  -6.949  15.428   2.945
  484   HD12  LEU  66          2HD1      LEU  66  -5.945  13.992   3.141
  485   HD13  LEU  66          3HD1      LEU  66  -7.403  13.918   2.154
  486   HD21  LEU  66          3HD2      LEU  66  -7.473  15.084  -0.059
  487   HD22  LEU  66          1HD2      LEU  66  -6.043  15.918  -0.664
  488   HD23  LEU  66          2HD2      LEU  66  -6.976  16.616   0.660
  489    H    GLU  67           H        GLU  67  -1.156  15.596   0.779
  490    HA   GLU  67           HA       GLU  67   0.763  16.568   1.500
  491    HB2  GLU  67           2HB      GLU  67  -0.562  19.150   0.633
  492    HB3  GLU  67           3HB      GLU  67   1.154  18.924   0.934
  493    HG2  GLU  67           2HG      GLU  67   1.318  17.386  -0.930
  494    HG3  GLU  67           3HG      GLU  67  -0.420  17.499  -1.202
  495    H    HIS  68           H        HIS  68  -1.318  19.309   2.339
  496    HA   HIS  68           HA       HIS  68  -1.617  20.497   4.229
  497    HB2  HIS  68           2HB      HIS  68  -2.752  19.355   5.992
  498    HB3  HIS  68           3HB      HIS  68  -3.215  18.612   4.470
  499    HD1  HIS  68           HD1      HIS  68  -1.125  17.954   7.540
  500    HD2  HIS  68           HD2      HIS  68  -2.708  15.899   4.294
  501    HE1  HIS  68           HE1      HIS  68  -0.781  15.527   8.052
  502    HE2  HIS  68           HE2      HIS  68  -1.929  14.307   6.180
  503    H    HIS  69           H        HIS  69  -0.146  21.650   5.245
  504    HA   HIS  69           HA       HIS  69   1.415  20.417   7.368
  505    HB2  HIS  69           2HB      HIS  69   3.560  21.241   6.648
  506    HB3  HIS  69           3HB      HIS  69   2.872  20.296   5.333
  507    HD1  HIS  69           HD1      HIS  69   4.267  23.584   6.110
  508    HD2  HIS  69           HD2      HIS  69   1.807  21.950   3.178
  509    HE1  HIS  69           HE1      HIS  69   4.261  25.247   4.224
  510    HE2  HIS  69           HE2      HIS  69   2.897  24.163   2.406
  511    H    HIS  70           H        HIS  70   2.115  21.904   8.962
  512    HA   HIS  70           HA       HIS  70   0.388  24.123   9.317
  513    HB2  HIS  70           2HB      HIS  70   1.645  24.566  11.365
  514    HB3  HIS  70           3HB      HIS  70   1.308  22.848  11.210
  515    HD1  HIS  70           HD1      HIS  70   4.101  25.305  11.342
  516    HD2  HIS  70           HD2      HIS  70   3.581  21.221  10.759
  517    HE1  HIS  70           HE1      HIS  70   6.389  24.296  11.565
  518    HE2  HIS  70           HE2      HIS  70   6.012  21.815  11.403
  519    H    HIS  71           H        HIS  71   0.774  26.331   9.314
  520    HA   HIS  71           HA       HIS  71   2.518  27.395   7.370
  521    HB2  HIS  71           2HB      HIS  71   0.505  28.578   7.905
  522    HB3  HIS  71           3HB      HIS  71   0.941  28.686   9.607
  523    HD1  HIS  71           HD1      HIS  71   1.712  30.226   6.260
  524    HD2  HIS  71           HD2      HIS  71   2.620  30.815  10.273
  525    HE1  HIS  71           HE1      HIS  71   2.836  32.461   6.374
  526    HE2  HIS  71           HE2      HIS  71   3.217  32.868   8.822
  527    H    HIS  72           H        HIS  72   4.460  28.497   7.507
  528    HA   HIS  72           HA       HIS  72   5.700  28.825  10.154
  529    HB2  HIS  72           2HB      HIS  72   6.605  26.762   9.120
  530    HB3  HIS  72           3HB      HIS  72   7.131  27.702   7.728
  531    HD1  HIS  72           HD1      HIS  72   7.884  27.170  11.380
  532    HD2  HIS  72           HD2      HIS  72   9.526  29.070   8.066
  533    HE1  HIS  72           HE1      HIS  72  10.179  27.897  12.088
  534    HE2  HIS  72           HE2      HIS  72  11.098  29.156  10.116
  535    H    HIS  73           H        HIS  73   6.649  30.752  10.454
  536    HA   HIS  73           HA       HIS  73   6.453  32.782   8.428
  537    HB2  HIS  73           2HB      HIS  73   6.046  33.272  10.805
  538    HB3  HIS  73           3HB      HIS  73   7.716  32.872  11.183
  539    HD1  HIS  73           HD1      HIS  73   9.452  34.690  10.849
  540    HD2  HIS  73           HD2      HIS  73   5.716  35.724   9.359
  541    HE1  HIS  73           HE1      HIS  73   9.604  37.129  10.292
  542    HE2  HIS  73           HE2      HIS  73   7.403  37.678   9.209
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1 -16.265   9.236   0.247
    2    H2   MET   1           2H       MET   1 -17.241   9.622  -1.073
    3    H3   MET   1           3H       MET   1 -17.466  10.419   0.400
    4    HA   MET   1           HA       MET   1 -16.330  11.836  -1.168
    5    HB2  MET   1           2HB      MET   1 -14.411  12.446   0.239
    6    HB3  MET   1           3HB      MET   1 -15.831  12.099   1.215
    7    HG2  MET   1           2HG      MET   1 -14.925   9.858   1.700
    8    HG3  MET   1           3HG      MET   1 -13.484  10.258   0.768
    9    HE1  MET   1           3HE      MET   1 -15.512  12.681   3.120
   10    HE2  MET   1           1HE      MET   1 -14.686  12.437   4.660
   11    HE3  MET   1           2HE      MET   1 -15.627  11.128   3.948
   12    H    THR   2           H        THR   2 -14.760  12.172  -2.698
   13    HA   THR   2           HA       THR   2 -13.775   9.909  -4.081
   14    HB   THR   2           HB       THR   2 -12.898  12.793  -4.402
   15    HG1  THR   2           HG1      THR   2 -14.528  12.608  -6.186
   16   HG21  THR   2          3HG2      THR   2 -12.334  12.135  -6.699
   17   HG22  THR   2          1HG2      THR   2 -12.795  10.470  -6.340
   18   HG23  THR   2          2HG2      THR   2 -11.408  11.195  -5.528
   19    H    GLN   3           H        GLN   3 -12.114   8.653  -3.489
   20    HA   GLN   3           HA       GLN   3  -9.768   9.887  -2.170
   21    HB2  GLN   3           2HB      GLN   3 -10.890   7.096  -1.820
   22    HB3  GLN   3           3HB      GLN   3  -9.404   7.679  -1.085
   23    HG2  GLN   3           2HG      GLN   3 -10.635   9.292   0.230
   24    HG3  GLN   3           3HG      GLN   3 -12.138   8.850  -0.577
   25   HE21  GLN   3          1HE2      GLN   3  -9.744   6.483   0.348
   26   HE22  GLN   3          2HE2      GLN   3 -10.675   5.756   1.604
   27    H    LYS   4           H        LYS   4  -7.719   9.323  -2.882
   28    HA   LYS   4           HA       LYS   4  -7.531   8.144  -5.516
   29    HB2  LYS   4           2HB      LYS   4  -5.491   9.296  -3.615
   30    HB3  LYS   4           3HB      LYS   4  -5.024   8.539  -5.127
   31    HG2  LYS   4           2HG      LYS   4  -7.057  10.723  -5.203
   32    HG3  LYS   4           3HG      LYS   4  -5.367  11.146  -4.935
   33    HD2  LYS   4           2HD      LYS   4  -5.829  11.293  -7.294
   34    HD3  LYS   4           3HD      LYS   4  -4.774   9.910  -7.016
   35    HE2  LYS   4           2HE      LYS   4  -6.737   8.419  -7.146
   36    HE3  LYS   4           3HE      LYS   4  -7.759   9.818  -7.474
   37    HZ1  LYS   4           3HZ      LYS   4  -7.167   8.687  -9.510
   38    HZ2  LYS   4           1HZ      LYS   4  -5.518   8.860  -9.171
   39    HZ3  LYS   4           2HZ      LYS   4  -6.464  10.224  -9.485
   40    H    PHE   5           H        PHE   5  -6.822   7.139  -2.225
   41    HA   PHE   5           HA       PHE   5  -5.861   4.538  -3.251
   42    HB2  PHE   5           2HB      PHE   5  -5.116   5.927  -0.666
   43    HB3  PHE   5           3HB      PHE   5  -4.558   4.333  -1.163
   44    HD1  PHE   5           HD1      PHE   5  -4.287   7.943  -1.765
   45    HD2  PHE   5           HD2      PHE   5  -2.868   4.079  -2.873
   46    HE1  PHE   5           HE1      PHE   5  -2.397   8.977  -2.953
   47    HE2  PHE   5           HE2      PHE   5  -0.979   5.112  -4.057
   48    HZ   PHE   5           HZ       PHE   5  -0.740   7.566  -4.100
   49    H    THR   6           H        THR   6  -7.077   2.845  -2.813
   50    HA   THR   6           HA       THR   6  -8.868   2.869  -0.452
   51    HB   THR   6           HB       THR   6 -10.315   3.091  -2.354
   52    HG1  THR   6           HG1      THR   6 -11.561   1.256  -2.058
   53   HG21  THR   6          3HG2      THR   6  -8.766   2.364  -4.113
   54   HG22  THR   6          1HG2      THR   6 -10.303   1.507  -4.233
   55   HG23  THR   6          2HG2      THR   6  -8.894   0.699  -3.546
   56    H    LYS   7           H        LYS   7  -9.482   0.669   0.317
   57    HA   LYS   7           HA       LYS   7  -7.173  -0.896   0.786
   58    HB2  LYS   7           2HB      LYS   7  -8.724  -2.482   1.897
   59    HB3  LYS   7           3HB      LYS   7  -8.968  -0.817   2.409
   60    HG2  LYS   7           2HG      LYS   7 -10.967  -0.612   1.164
   61    HG3  LYS   7           3HG      LYS   7 -10.643  -2.087   0.254
   62    HD2  LYS   7           2HD      LYS   7 -12.378  -2.446   1.940
   63    HD3  LYS   7           3HD      LYS   7 -10.948  -3.422   2.278
   64    HE2  LYS   7           2HE      LYS   7 -10.222  -1.701   3.923
   65    HE3  LYS   7           3HE      LYS   7 -11.735  -0.835   3.632
   66    HZ1  LYS   7           3HZ      LYS   7 -11.873  -2.233   5.591
   67    HZ2  LYS   7           1HZ      LYS   7 -11.492  -3.603   4.677
   68    HZ3  LYS   7           2HZ      LYS   7 -12.945  -2.778   4.404
   69    H    ASP   8           H        ASP   8  -9.598  -1.078  -1.694
   70    HA   ASP   8           HA       ASP   8  -9.053  -3.893  -2.264
   71    HB2  ASP   8           2HB      ASP   8 -11.390  -2.865  -2.120
   72    HB3  ASP   8           3HB      ASP   8 -11.049  -2.118  -3.676
   73    H    MET   9           H        MET   9  -7.523  -1.150  -3.160
   74    HA   MET   9           HA       MET   9  -7.186  -1.874  -5.985
   75    HB2  MET   9           2HB      MET   9  -6.000   0.201  -6.256
   76    HB3  MET   9           3HB      MET   9  -7.470   0.523  -5.347
   77    HG2  MET   9           2HG      MET   9  -6.095   0.448  -3.259
   78    HG3  MET   9           3HG      MET   9  -4.663   0.353  -4.277
   79    HE1  MET   9           3HE      MET   9  -3.918   2.259  -5.961
   80    HE2  MET   9           1HE      MET   9  -4.780   3.783  -6.167
   81    HE3  MET   9           2HE      MET   9  -5.508   2.276  -6.722
   82    H    THR  10           H        THR  10  -5.068  -2.249  -6.897
   83    HA   THR  10           HA       THR  10  -3.509  -4.008  -5.239
   84    HB   THR  10           HB       THR  10  -2.177  -4.481  -7.205
   85    HG1  THR  10           HG1      THR  10  -3.188  -3.112  -9.154
   86   HG21  THR  10          3HG2      THR  10  -5.091  -4.175  -7.958
   87   HG22  THR  10          1HG2      THR  10  -4.382  -5.547  -7.105
   88   HG23  THR  10          2HG2      THR  10  -3.919  -5.209  -8.773
   89    H    PHE  11           H        PHE  11  -1.298  -3.855  -4.704
   90    HA   PHE  11           HA       PHE  11  -0.258  -1.417  -3.883
   91    HB2  PHE  11           2HB      PHE  11   1.175  -3.981  -4.616
   92    HB3  PHE  11           3HB      PHE  11   1.985  -2.607  -3.874
   93    HD1  PHE  11           HD2      PHE  11  -0.440  -5.316  -3.350
   94    HD2  PHE  11           HD1      PHE  11   1.655  -2.074  -1.545
   95    HE1  PHE  11           HE2      PHE  11  -1.069  -6.152  -1.126
   96    HE2  PHE  11           HE1      PHE  11   1.029  -2.909   0.682
   97    HZ   PHE  11           HZ       PHE  11  -0.334  -4.949   0.895
   98    H    ALA  12           H        ALA  12   0.157  -3.054  -6.989
   99    HA   ALA  12           HA       ALA  12   2.118  -1.433  -8.128
  100    HB1  ALA  12           3HB      ALA  12  -0.211  -2.741  -9.539
  101    HB2  ALA  12           1HB      ALA  12   1.311  -3.531  -9.119
  102    HB3  ALA  12           2HB      ALA  12   1.297  -2.204 -10.282
  103    H    GLN  13           H        GLN  13  -1.435  -1.056  -8.323
  104    HA   GLN  13           HA       GLN  13  -1.501   1.307  -9.818
  105    HB2  GLN  13           2HB      GLN  13  -3.432   0.389  -7.672
  106    HB3  GLN  13           3HB      GLN  13  -3.757   1.659  -8.843
  107    HG2  GLN  13           2HG      GLN  13  -3.600   0.046 -10.663
  108    HG3  GLN  13           3HG      GLN  13  -3.218  -1.231  -9.509
  109   HE21  GLN  13          1HE2      GLN  13  -5.574   1.308  -8.950
  110   HE22  GLN  13          2HE2      GLN  13  -6.958   0.281  -8.957
  111    H    ALA  14           H        ALA  14  -1.326   0.870  -6.292
  112    HA   ALA  14           HA       ALA  14  -1.486   3.546  -5.505
  113    HB1  ALA  14           3HB      ALA  14   0.116   1.332  -4.215
  114    HB2  ALA  14           1HB      ALA  14  -1.592   1.671  -3.934
  115    HB3  ALA  14           2HB      ALA  14  -0.369   2.844  -3.446
  116    H    LEU  15           H        LEU  15   1.424   1.607  -6.220
  117    HA   LEU  15           HA       LEU  15   3.321   3.654  -5.900
  118    HB2  LEU  15           2HB      LEU  15   3.417   1.242  -7.720
  119    HB3  LEU  15           3HB      LEU  15   4.798   2.235  -7.293
  120    HG   LEU  15           HG       LEU  15   3.171   0.585  -5.344
  121   HD11  LEU  15          1HD1      LEU  15   4.495  -0.806  -6.864
  122   HD12  LEU  15          2HD1      LEU  15   5.134  -0.857  -5.220
  123   HD13  LEU  15          3HD1      LEU  15   5.942   0.116  -6.450
  124   HD21  LEU  15          3HD2      LEU  15   4.100   2.564  -4.282
  125   HD22  LEU  15          1HD2      LEU  15   5.694   2.198  -4.949
  126   HD23  LEU  15          2HD2      LEU  15   4.969   1.125  -3.751
  127    H    GLN  16           H        GLN  16   1.454   2.678  -8.764
  128    HA   GLN  16           HA       GLN  16   2.756   4.428 -10.592
  129    HB2  GLN  16           2HB      GLN  16   0.011   3.152 -10.717
  130    HB3  GLN  16           3HB      GLN  16   0.777   3.998 -12.055
  131    HG2  GLN  16           2HG      GLN  16   1.812   1.496 -10.724
  132    HG3  GLN  16           3HG      GLN  16   0.992   1.579 -12.281
  133   HE21  GLN  16          1HE2      GLN  16   3.931   2.239 -10.557
  134   HE22  GLN  16          2HE2      GLN  16   4.919   2.504 -11.948
  135    H    THR  17           H        THR  17   0.438   5.019  -8.134
  136    HA   THR  17           HA       THR  17  -0.658   7.418  -9.334
  137    HB   THR  17           HB       THR  17  -0.916   6.363  -6.503
  138    HG1  THR  17           HG1      THR  17  -1.886   5.050  -8.162
  139   HG21  THR  17          3HG2      THR  17  -1.302   8.788  -6.607
  140   HG22  THR  17          1HG2      THR  17  -2.803   7.916  -6.293
  141   HG23  THR  17          2HG2      THR  17  -2.471   8.551  -7.905
  142    H    HIS  18           H        HIS  18   1.447   6.755  -6.500
  143    HA   HIS  18           HA       HIS  18   2.894   9.246  -7.032
  144    HB2  HIS  18           2HB      HIS  18   1.530   8.648  -4.396
  145    HB3  HIS  18           3HB      HIS  18   2.819   9.835  -4.561
  146    HD1  HIS  18           HD1      HIS  18  -0.717   9.677  -4.461
  147    HD2  HIS  18           HD2      HIS  18   2.013  11.837  -6.731
  148    HE1  HIS  18           HE1      HIS  18  -1.990  11.649  -5.347
  149    HE2  HIS  18           HE2      HIS  18  -0.330  12.936  -6.728
  150    HA   PRO  19           HA       PRO  19   6.340   6.482  -6.296
  151    HB2  PRO  19           2HB      PRO  19   7.724   9.050  -5.655
  152    HB3  PRO  19           3HB      PRO  19   8.201   7.758  -6.764
  153    HG2  PRO  19           2HG      PRO  19   7.208  10.032  -7.715
  154    HG3  PRO  19           3HG      PRO  19   6.746   8.478  -8.439
  155    HD2  PRO  19           2HD      PRO  19   5.198  10.234  -6.567
  156    HD3  PRO  19           3HD      PRO  19   4.629   9.290  -7.961
  157    H    GLY  20           H        GLY  20   5.587   9.087  -3.999
  158    HA2  GLY  20           2HA      GLY  20   7.165   8.305  -1.835
  159    HA3  GLY  20           3HA      GLY  20   5.658   9.192  -1.705
  160    H    VAL  21           H        VAL  21   4.334   6.748  -3.058
  161    HA   VAL  21           HA       VAL  21   3.352   5.497  -0.753
  162    HB   VAL  21           HB       VAL  21   3.391   4.460  -3.598
  163   HG11  VAL  21          1HG1      VAL  21   1.689   3.571  -1.262
  164   HG12  VAL  21          2HG1      VAL  21   2.979   2.635  -2.019
  165   HG13  VAL  21          3HG1      VAL  21   1.520   3.024  -2.929
  166   HG21  VAL  21          3HG2      VAL  21   1.269   5.975  -2.069
  167   HG22  VAL  21          1HG2      VAL  21   1.100   5.336  -3.705
  168   HG23  VAL  21          2HG2      VAL  21   2.266   6.616  -3.375
  169    H    ALA  22           H        ALA  22   6.125   4.724  -2.775
  170    HA   ALA  22           HA       ALA  22   6.667   2.119  -1.876
  171    HB1  ALA  22           3HB      ALA  22   8.953   2.499  -2.643
  172    HB2  ALA  22           1HB      ALA  22   8.652   4.237  -2.718
  173    HB3  ALA  22           2HB      ALA  22   7.791   3.144  -3.801
  174    H    GLY  23           H        GLY  23   7.855   5.251  -0.622
  175    HA2  GLY  23           2HA      GLY  23   9.339   4.204   1.542
  176    HA3  GLY  23           3HA      GLY  23   8.717   5.841   1.424
  177    H    VAL  24           H        VAL  24   5.951   5.266   1.343
  178    HA   VAL  24           HA       VAL  24   5.319   4.978   4.078
  179    HB   VAL  24           HB       VAL  24   3.462   4.617   1.710
  180   HG11  VAL  24          1HG1      VAL  24   2.496   3.753   3.774
  181   HG12  VAL  24          2HG1      VAL  24   1.679   5.235   3.281
  182   HG13  VAL  24          3HG1      VAL  24   2.852   5.272   4.599
  183   HG21  VAL  24          3HG2      VAL  24   4.145   7.110   3.281
  184   HG22  VAL  24          1HG2      VAL  24   2.897   6.990   2.039
  185   HG23  VAL  24          2HG2      VAL  24   4.592   6.771   1.608
  186    H    LEU  25           H        LEU  25   4.839   2.678   1.372
  187    HA   LEU  25           HA       LEU  25   3.792   0.563   2.865
  188    HB2  LEU  25           2HB      LEU  25   5.505   0.470   0.374
  189    HB3  LEU  25           3HB      LEU  25   4.621  -0.902   1.021
  190    HG   LEU  25           HG       LEU  25   3.376   1.661   0.003
  191   HD11  LEU  25          1HD1      LEU  25   2.553   0.299  -1.844
  192   HD12  LEU  25          2HD1      LEU  25   3.426  -1.098  -1.215
  193   HD13  LEU  25          3HD1      LEU  25   4.315   0.311  -1.795
  194   HD21  LEU  25          3HD2      LEU  25   2.079  -0.882   0.992
  195   HD22  LEU  25          1HD2      LEU  25   1.240   0.483   0.254
  196   HD23  LEU  25          2HD2      LEU  25   2.058   0.685   1.802
  197    H    ARG  26           H        ARG  26   7.218   1.236   2.059
  198    HA   ARG  26           HA       ARG  26   8.273  -0.947   3.511
  199    HB2  ARG  26           2HB      ARG  26   9.557   1.701   2.803
  200    HB3  ARG  26           3HB      ARG  26  10.424   0.331   3.487
  201    HG2  ARG  26           2HG      ARG  26   9.728  -1.021   1.511
  202    HG3  ARG  26           3HG      ARG  26   9.029   0.441   0.813
  203    HD2  ARG  26           2HD      ARG  26  11.226   0.073  -0.122
  204    HD3  ARG  26           3HD      ARG  26  11.263   1.508   0.901
  205    HE   ARG  26           HE       ARG  26  12.088  -0.388   2.603
  206   HH11  ARG  26          1HH1      ARG  26  13.065   0.264  -0.645
  207   HH12  ARG  26          2HH1      ARG  26  14.695  -0.238  -0.366
  208   HH21  ARG  26          1HH2      ARG  26  14.186  -1.041   2.930
  209   HH22  ARG  26          2HH2      ARG  26  15.316  -0.971   1.622
  210    H    SER  27           H        SER  27   7.322   2.285   4.512
  211    HA   SER  27           HA       SER  27   8.402   2.301   7.112
  212    HB2  SER  27           2HB      SER  27   7.425   4.314   6.095
  213    HB3  SER  27           3HB      SER  27   5.826   3.568   6.124
  214    HG   SER  27           HG       SER  27   6.082   4.942   7.906
  215    H    TYR  28           H        TYR  28   5.543   0.764   5.794
  216    HA   TYR  28           HA       TYR  28   4.755  -0.258   8.432
  217    HB2  TYR  28           2HB      TYR  28   3.419  -0.292   5.722
  218    HB3  TYR  28           3HB      TYR  28   2.804  -1.226   7.083
  219    HD1  TYR  28           HD1      TYR  28   3.660   2.260   6.056
  220    HD2  TYR  28           HD2      TYR  28   1.367  -0.230   8.637
  221    HE1  TYR  28           HE1      TYR  28   2.436   4.233   6.859
  222    HE2  TYR  28           HE2      TYR  28   0.135   1.736   9.447
  223    HH   TYR  28           HH       TYR  28   0.118   4.001   9.508
  224    H    ASN  29           H        ASN  29   7.158  -1.126   6.712
  225    HA   ASN  29           HA       ASN  29   8.334  -3.016   6.262
  226    HB2  ASN  29           2HB      ASN  29   7.647  -3.423   8.686
  227    HB3  ASN  29           3HB      ASN  29   6.389  -4.485   8.059
  228   HD21  ASN  29          1HD2      ASN  29   7.297  -6.305   9.055
  229   HD22  ASN  29          2HD2      ASN  29   8.766  -7.019   8.493
  230    H    LEU  30           H        LEU  30   5.999  -2.367   4.575
  231    HA   LEU  30           HA       LEU  30   5.158  -4.994   3.573
  232    HB2  LEU  30           2HB      LEU  30   4.327  -2.227   2.677
  233    HB3  LEU  30           3HB      LEU  30   3.608  -3.737   2.150
  234    HG   LEU  30           HG       LEU  30   3.511  -2.658   4.978
  235   HD11  LEU  30          1HD1      LEU  30   1.149  -2.226   4.529
  236   HD12  LEU  30          2HD1      LEU  30   1.361  -2.747   2.858
  237   HD13  LEU  30          3HD1      LEU  30   2.184  -1.301   3.444
  238   HD21  LEU  30          3HD2      LEU  30   3.462  -5.098   4.907
  239   HD22  LEU  30          1HD2      LEU  30   2.140  -5.049   3.738
  240   HD23  LEU  30          2HD2      LEU  30   1.892  -4.450   5.379
  241    H    GLY  31           H        GLY  31   7.867  -3.330   3.181
  242    HA2  GLY  31           2HA      GLY  31   8.080  -2.623   0.479
  243    HA3  GLY  31           3HA      GLY  31   9.428  -3.017   1.527
  244    H    CYS  32           H        CYS  32   8.328  -5.788   1.945
  245    HA   CYS  32           HA       CYS  32   9.750  -7.006  -0.219
  246    HB2  CYS  32           2HB      CYS  32   8.181  -8.205   2.065
  247    HB3  CYS  32           3HB      CYS  32   9.093  -9.159   0.898
  248    HG   CYS  32           HG       CYS  32  10.178  -8.107   3.675
  249    H    ILE  33           H        ILE  33   6.701  -5.802  -0.294
  250    HA   ILE  33           HA       ILE  33   5.071  -7.721  -1.442
  251    HB   ILE  33           HB       ILE  33   4.054  -5.837  -2.795
  252   HG12  ILE  33          2HG1      ILE  33   6.130  -4.193  -1.316
  253   HG13  ILE  33          3HG1      ILE  33   6.115  -4.496  -3.050
  254   HG21  ILE  33          1HG2      ILE  33   4.395  -5.427   0.175
  255   HG22  ILE  33          2HG2      ILE  33   3.189  -6.439  -0.618
  256   HG23  ILE  33          3HG2      ILE  33   3.140  -4.687  -0.819
  257   HD11  ILE  33          3HD1      ILE  33   5.271  -2.290  -2.553
  258   HD12  ILE  33          1HD1      ILE  33   4.034  -2.974  -1.498
  259   HD13  ILE  33          2HD1      ILE  33   3.993  -3.298  -3.231
  260    H    GLY  34           H        GLY  34   7.703  -5.914  -2.972
  261    HA2  GLY  34           2HA      GLY  34   7.214  -6.814  -5.632
  262    HA3  GLY  34           3HA      GLY  34   8.717  -6.138  -5.027
  263    H    CYS  35           H        CYS  35   8.862  -8.244  -2.912
  264    HA   CYS  35           HA       CYS  35  10.218 -10.267  -4.477
  265    HB2  CYS  35           2HB      CYS  35  11.266  -9.513  -2.427
  266    HB3  CYS  35           3HB      CYS  35   9.840  -9.944  -1.488
  267    HG   CYS  35           HG       CYS  35  11.270 -11.994  -0.723
  268    H    MET  36           H        MET  36   7.346 -10.121  -2.398
  269    HA   MET  36           HA       MET  36   6.765 -12.947  -2.810
  270    HB2  MET  36           2HB      MET  36   4.862 -12.565  -1.302
  271    HB3  MET  36           3HB      MET  36   6.365 -11.974  -0.605
  272    HG2  MET  36           2HG      MET  36   5.767  -9.692  -1.214
  273    HG3  MET  36           3HG      MET  36   4.276 -10.269  -1.955
  274    HE1  MET  36           3HE      MET  36   2.233 -11.249  -0.618
  275    HE2  MET  36           1HE      MET  36   2.228 -11.514   1.127
  276    HE3  MET  36           2HE      MET  36   3.270 -12.488   0.091
  277    H    GLY  37           H        GLY  37   6.448 -10.523  -4.868
  278    HA2  GLY  37           2HA      GLY  37   5.167 -10.174  -6.746
  279    HA3  GLY  37           3HA      GLY  37   4.508 -11.778  -6.485
  280    H    ALA  38           H        ALA  38   4.133  -9.320  -4.030
  281    HA   ALA  38           HA       ALA  38   1.261  -9.551  -4.184
  282    HB1  ALA  38           3HB      ALA  38   2.413  -9.417  -2.020
  283    HB2  ALA  38           1HB      ALA  38   1.223  -8.127  -2.209
  284    HB3  ALA  38           2HB      ALA  38   2.941  -7.780  -2.408
  285    H    GLN  39           H        GLN  39   3.197  -7.894  -6.135
  286    HA   GLN  39           HA       GLN  39   2.330  -5.235  -6.164
  287    HB2  GLN  39           2HB      GLN  39   3.119  -6.977  -8.519
  288    HB3  GLN  39           3HB      GLN  39   3.031  -5.220  -8.538
  289    HG2  GLN  39           2HG      GLN  39   4.886  -6.839  -6.796
  290    HG3  GLN  39           3HG      GLN  39   5.331  -6.077  -8.321
  291   HE21  GLN  39          1HE2      GLN  39   4.483  -5.522  -4.989
  292   HE22  GLN  39          2HE2      GLN  39   5.007  -3.880  -4.930
  293    H    ASN  40           H        ASN  40   0.892  -8.120  -7.603
  294    HA   ASN  40           HA       ASN  40  -1.280  -6.588  -8.815
  295    HB2  ASN  40           2HB      ASN  40  -0.763  -9.574  -8.831
  296    HB3  ASN  40           3HB      ASN  40  -1.933  -8.715  -9.830
  297   HD21  ASN  40          1HD2      ASN  40   0.338 -10.382 -10.605
  298   HD22  ASN  40          2HD2      ASN  40   1.335  -9.384 -11.604
  299    H    GLU  41           H        GLU  41  -0.815  -7.254  -5.785
  300    HA   GLU  41           HA       GLU  41  -3.445  -8.464  -5.216
  301    HB2  GLU  41           2HB      GLU  41  -1.484  -9.638  -4.285
  302    HB3  GLU  41           3HB      GLU  41  -1.017  -8.179  -3.423
  303    HG2  GLU  41           2HG      GLU  41  -2.998  -8.293  -2.055
  304    HG3  GLU  41           3HG      GLU  41  -3.609  -9.655  -2.990
  305    H    SER  42           H        SER  42  -4.780  -7.518  -3.561
  306    HA   SER  42           HA       SER  42  -4.878  -4.664  -3.707
  307    HB2  SER  42           2HB      SER  42  -6.491  -6.554  -1.966
  308    HB3  SER  42           3HB      SER  42  -6.874  -4.862  -2.280
  309    HG   SER  42           HG       SER  42  -8.045  -6.352  -3.616
  310    H    LEU  43           H        LEU  43  -4.744  -3.140  -2.027
  311    HA   LEU  43           HA       LEU  43  -2.537  -3.309  -0.364
  312    HB2  LEU  43           2HB      LEU  43  -4.960  -1.525  -0.088
  313    HB3  LEU  43           3HB      LEU  43  -3.446  -1.285   0.765
  314    HG   LEU  43           HG       LEU  43  -3.831  -1.139  -2.237
  315   HD11  LEU  43          1HD1      LEU  43  -3.262   1.019  -0.201
  316   HD12  LEU  43          2HD1      LEU  43  -4.781   0.775  -1.062
  317   HD13  LEU  43          3HD1      LEU  43  -3.332   1.240  -1.952
  318   HD21  LEU  43          3HD2      LEU  43  -1.627  -2.024  -1.658
  319   HD22  LEU  43          1HD2      LEU  43  -1.355  -0.659  -0.575
  320   HD23  LEU  43          2HD2      LEU  43  -1.506  -0.392  -2.313
  321    H    GLU  44           H        GLU  44  -5.952  -3.858   0.500
  322    HA   GLU  44           HA       GLU  44  -5.576  -4.135   3.270
  323    HB2  GLU  44           2HB      GLU  44  -7.790  -3.858   2.284
  324    HB3  GLU  44           3HB      GLU  44  -7.666  -5.434   1.511
  325    HG2  GLU  44           2HG      GLU  44  -7.596  -6.509   3.713
  326    HG3  GLU  44           3HG      GLU  44  -7.709  -4.929   4.486
  327    H    GLN  45           H        GLN  45  -5.429  -6.556   0.696
  328    HA   GLN  45           HA       GLN  45  -5.301  -8.825   2.353
  329    HB2  GLN  45           2HB      GLN  45  -4.189  -8.489  -0.441
  330    HB3  GLN  45           3HB      GLN  45  -4.545 -10.016   0.359
  331    HG2  GLN  45           2HG      GLN  45  -6.920  -9.426   0.434
  332    HG3  GLN  45           3HG      GLN  45  -6.565  -7.895  -0.361
  333   HE21  GLN  45          1HE2      GLN  45  -7.871  -8.345  -2.122
  334   HE22  GLN  45          2HE2      GLN  45  -7.460  -9.530  -3.310
  335    H    GLY  46           H        GLY  46  -2.643  -7.071   0.701
  336    HA2  GLY  46           2HA      GLY  46  -0.508  -8.460   1.863
  337    HA3  GLY  46           3HA      GLY  46  -0.435  -6.802   1.288
  338    H    ALA  47           H        ALA  47  -2.340  -5.691   3.095
  339    HA   ALA  47           HA       ALA  47  -0.789  -5.094   5.345
  340    HB1  ALA  47           3HB      ALA  47  -2.611  -3.660   4.552
  341    HB2  ALA  47           1HB      ALA  47  -2.798  -4.043   6.263
  342    HB3  ALA  47           2HB      ALA  47  -3.791  -4.868   5.060
  343    H    ASN  48           H        ASN  48  -3.715  -7.176   5.200
  344    HA   ASN  48           HA       ASN  48  -3.507  -8.173   7.821
  345    HB2  ASN  48           2HB      ASN  48  -4.799  -9.393   5.372
  346    HB3  ASN  48           3HB      ASN  48  -4.951 -10.068   6.993
  347   HD21  ASN  48          1HD2      ASN  48  -5.982  -7.608   4.830
  348   HD22  ASN  48          2HD2      ASN  48  -7.151  -6.889   5.876
  349    H    ALA  49           H        ALA  49  -1.961  -9.223   4.833
  350    HA   ALA  49           HA       ALA  49  -0.915 -11.683   5.697
  351    HB1  ALA  49           3HB      ALA  49   0.728 -11.430   3.915
  352    HB2  ALA  49           1HB      ALA  49   0.335  -9.716   3.775
  353    HB3  ALA  49           2HB      ALA  49  -0.871 -10.934   3.360
  354    H    HIS  50           H        HIS  50   0.130  -8.398   6.375
  355    HA   HIS  50           HA       HIS  50   2.428  -9.444   7.908
  356    HB2  HIS  50           2HB      HIS  50   1.806  -6.658   6.911
  357    HB3  HIS  50           3HB      HIS  50   3.128  -7.014   8.015
  358    HD1  HIS  50           HD1      HIS  50   5.274  -7.865   7.010
  359    HD2  HIS  50           HD2      HIS  50   2.138  -7.833   4.285
  360    HE1  HIS  50           HE1      HIS  50   6.324  -8.294   4.776
  361    HE2  HIS  50           HE2      HIS  50   4.424  -8.203   3.135
  362    H    GLY  51           H        GLY  51  -0.661  -9.040   8.567
  363    HA2  GLY  51           2HA      GLY  51  -1.860  -8.742  10.508
  364    HA3  GLY  51           3HA      GLY  51  -0.327  -8.730  11.364
  365    H    LEU  52           H        LEU  52  -1.618  -6.497   8.910
  366    HA   LEU  52           HA       LEU  52  -1.420  -4.305  10.884
  367    HB2  LEU  52           2HB      LEU  52  -0.792  -4.186   7.929
  368    HB3  LEU  52           3HB      LEU  52  -0.752  -2.822   9.032
  369    HG   LEU  52           HG       LEU  52   1.055  -5.245   9.199
  370   HD11  LEU  52          1HD1      LEU  52   2.817  -3.731   8.444
  371   HD12  LEU  52          2HD1      LEU  52   1.630  -2.442   8.239
  372   HD13  LEU  52          3HD1      LEU  52   1.542  -3.892   7.237
  373   HD21  LEU  52          3HD2      LEU  52   1.071  -2.656  10.760
  374   HD22  LEU  52          1HD2      LEU  52   2.295  -3.922  10.853
  375   HD23  LEU  52          2HD2      LEU  52   0.647  -4.249  11.387
  376    H    ASN  53           H        ASN  53  -2.764  -2.393  10.348
  377    HA   ASN  53           HA       ASN  53  -5.350  -3.178   9.208
  378    HB2  ASN  53           2HB      ASN  53  -5.493  -2.224  11.421
  379    HB3  ASN  53           3HB      ASN  53  -4.529  -0.832  10.939
  380   HD21  ASN  53          1HD2      ASN  53  -6.156   0.583  11.584
  381   HD22  ASN  53          2HD2      ASN  53  -7.601   0.798  10.662
  382    H    VAL  54           H        VAL  54  -5.628  -2.758   7.123
  383    HA   VAL  54           HA       VAL  54  -4.047  -1.110   5.525
  384    HB   VAL  54           HB       VAL  54  -5.444  -2.908   4.619
  385   HG11  VAL  54          1HG1      VAL  54  -7.431  -2.596   6.009
  386   HG12  VAL  54          2HG1      VAL  54  -7.853  -2.612   4.297
  387   HG13  VAL  54          3HG1      VAL  54  -7.789  -1.083   5.174
  388   HG21  VAL  54          3HG2      VAL  54  -4.644  -1.169   3.106
  389   HG22  VAL  54          1HG2      VAL  54  -6.086  -0.205   3.428
  390   HG23  VAL  54          2HG2      VAL  54  -6.228  -1.755   2.598
  391    H    GLU  55           H        GLU  55  -6.965  -0.355   7.335
  392    HA   GLU  55           HA       GLU  55  -7.655   2.060   6.072
  393    HB2  GLU  55           2HB      GLU  55  -8.110   1.179   8.934
  394    HB3  GLU  55           3HB      GLU  55  -8.921   2.534   8.155
  395    HG2  GLU  55           2HG      GLU  55 -10.030   1.071   6.609
  396    HG3  GLU  55           3HG      GLU  55  -9.087  -0.311   7.163
  397    H    ASP  56           H        ASP  56  -5.342   1.388   8.662
  398    HA   ASP  56           HA       ASP  56  -4.762   4.132   9.225
  399    HB2  ASP  56           2HB      ASP  56  -4.288   2.342  10.846
  400    HB3  ASP  56           3HB      ASP  56  -3.091   1.660   9.748
  401    H    ILE  57           H        ILE  57  -3.381   1.698   7.073
  402    HA   ILE  57           HA       ILE  57  -1.152   3.184   6.170
  403    HB   ILE  57           HB       ILE  57  -2.710   1.122   4.585
  404   HG12  ILE  57          2HG1      ILE  57  -0.402   0.695   6.509
  405   HG13  ILE  57          3HG1      ILE  57  -2.082   0.288   6.837
  406   HG21  ILE  57          1HG2      ILE  57  -1.071   2.423   3.281
  407   HG22  ILE  57          2HG2      ILE  57  -0.596   0.730   3.426
  408   HG23  ILE  57          3HG2      ILE  57   0.193   1.957   4.419
  409   HD11  ILE  57          3HD1      ILE  57  -0.382  -0.922   4.668
  410   HD12  ILE  57          1HD1      ILE  57  -2.052  -1.354   5.045
  411   HD13  ILE  57          2HD1      ILE  57  -0.771  -1.668   6.217
  412    H    LEU  58           H        LEU  58  -4.428   2.803   4.822
  413    HA   LEU  58           HA       LEU  58  -4.198   4.431   2.580
  414    HB2  LEU  58           2HB      LEU  58  -6.613   4.018   4.353
  415    HB3  LEU  58           3HB      LEU  58  -6.658   4.731   2.750
  416    HG   LEU  58           HG       LEU  58  -5.848   1.889   3.397
  417   HD11  LEU  58          1HD1      LEU  58  -8.326   2.982   2.057
  418   HD12  LEU  58          2HD1      LEU  58  -8.239   2.253   3.661
  419   HD13  LEU  58          3HD1      LEU  58  -7.916   1.274   2.231
  420   HD21  LEU  58          3HD2      LEU  58  -6.096   3.288   0.731
  421   HD22  LEU  58          1HD2      LEU  58  -5.810   1.561   0.961
  422   HD23  LEU  58          2HD2      LEU  58  -4.603   2.732   1.486
  423    H    ARG  59           H        ARG  59  -4.808   5.327   5.940
  424    HA   ARG  59           HA       ARG  59  -5.426   8.009   5.729
  425    HB2  ARG  59           2HB      ARG  59  -5.406   7.006   7.886
  426    HB3  ARG  59           3HB      ARG  59  -3.728   6.511   7.726
  427    HG2  ARG  59           2HG      ARG  59  -3.079   8.919   7.779
  428    HG3  ARG  59           3HG      ARG  59  -4.766   9.314   8.112
  429    HD2  ARG  59           2HD      ARG  59  -3.381   9.217  10.161
  430    HD3  ARG  59           3HD      ARG  59  -4.702   8.052  10.172
  431    HE   ARG  59           HE       ARG  59  -3.129   6.304   9.843
  432   HH11  ARG  59          1HH1      ARG  59  -1.640   9.377  10.324
  433   HH12  ARG  59          2HH1      ARG  59  -0.126   8.687  10.775
  434   HH21  ARG  59          1HH2      ARG  59  -1.185   5.442  10.411
  435   HH22  ARG  59          2HH2      ARG  59   0.136   6.485  10.816
  436    H    ASP  60           H        ASP  60  -2.114   6.660   5.961
  437    HA   ASP  60           HA       ASP  60  -0.879   9.202   5.513
  438    HB2  ASP  60           2HB      ASP  60   0.058   7.171   6.795
  439    HB3  ASP  60           3HB      ASP  60   0.500   6.530   5.216
  440    H    LEU  61           H        LEU  61  -1.734   6.478   3.451
  441    HA   LEU  61           HA       LEU  61  -0.264   7.203   1.156
  442    HB2  LEU  61           2HB      LEU  61  -2.826   5.640   1.440
  443    HB3  LEU  61           3HB      LEU  61  -1.986   5.836  -0.087
  444    HG   LEU  61           HG       LEU  61  -0.903   4.449   2.376
  445   HD11  LEU  61          1HD1      LEU  61  -2.622   3.159   1.217
  446   HD12  LEU  61          2HD1      LEU  61  -1.031   2.428   1.006
  447   HD13  LEU  61          3HD1      LEU  61  -1.755   3.358  -0.308
  448   HD21  LEU  61          3HD2      LEU  61   0.875   5.589   1.157
  449   HD22  LEU  61          1HD2      LEU  61   0.347   4.834  -0.347
  450   HD23  LEU  61          2HD2      LEU  61   0.998   3.841   0.958
  451    H    ASN  62           H        ASN  62  -3.713   7.883   1.922
  452    HA   ASN  62           HA       ASN  62  -4.125   9.454  -0.409
  453    HB2  ASN  62           2HB      ASN  62  -5.679   9.239   2.171
  454    HB3  ASN  62           3HB      ASN  62  -6.174  10.310   0.860
  455   HD21  ASN  62          1HD2      ASN  62  -5.953   7.043   1.938
  456   HD22  ASN  62          2HD2      ASN  62  -6.812   6.331   0.621
  457    H    ALA  63           H        ALA  63  -2.897  10.209   2.772
  458    HA   ALA  63           HA       ALA  63  -3.023  13.004   2.706
  459    HB1  ALA  63           3HB      ALA  63  -2.365  11.745   4.696
  460    HB2  ALA  63           1HB      ALA  63  -1.157  12.964   4.289
  461    HB3  ALA  63           2HB      ALA  63  -0.862  11.268   3.907
  462    H    LEU  64           H        LEU  64  -0.811  10.770   1.117
  463    HA   LEU  64           HA       LEU  64   1.139  12.605   0.235
  464    HB2  LEU  64           2HB      LEU  64   0.173  10.072  -1.105
  465    HB3  LEU  64           3HB      LEU  64   1.644  10.931  -1.520
  466    HG   LEU  64           HG       LEU  64   1.092   9.616   1.147
  467   HD11  LEU  64          1HD1      LEU  64   2.752   7.963   0.450
  468   HD12  LEU  64          2HD1      LEU  64   2.874   8.743  -1.128
  469   HD13  LEU  64          3HD1      LEU  64   1.362   7.976  -0.638
  470   HD21  LEU  64          3HD2      LEU  64   3.607  10.902   0.068
  471   HD22  LEU  64          1HD2      LEU  64   3.453  10.056   1.609
  472   HD23  LEU  64          2HD2      LEU  64   2.571  11.557   1.336
  473    H    ALA  65           H        ALA  65  -2.095  11.992  -0.892
  474    HA   ALA  65           HA       ALA  65  -1.714  13.376  -3.421
  475    HB1  ALA  65           3HB      ALA  65  -4.242  12.347  -2.132
  476    HB2  ALA  65           1HB      ALA  65  -3.244  11.471  -3.291
  477    HB3  ALA  65           2HB      ALA  65  -4.088  12.938  -3.786
  478    H    LEU  66           H        LEU  66  -2.484  14.217  -0.200
  479    HA   LEU  66           HA       LEU  66  -3.853  16.693  -0.940
  480    HB2  LEU  66           2HB      LEU  66  -3.177  15.591   1.792
  481    HB3  LEU  66           3HB      LEU  66  -4.188  16.989   1.466
  482    HG   LEU  66           HG       LEU  66  -4.832  14.139   0.669
  483   HD11  LEU  66          1HD1      LEU  66  -6.597  14.295   2.359
  484   HD12  LEU  66          2HD1      LEU  66  -6.009  15.891   2.827
  485   HD13  LEU  66          3HD1      LEU  66  -4.996  14.468   3.076
  486   HD21  LEU  66          3HD2      LEU  66  -7.016  15.022   0.024
  487   HD22  LEU  66          1HD2      LEU  66  -5.729  15.781  -0.914
  488   HD23  LEU  66          2HD2      LEU  66  -6.484  16.657   0.417
  489    H    GLU  67           H        GLU  67  -1.002  15.723   0.964
  490    HA   GLU  67           HA       GLU  67   1.023  16.659   1.318
  491    HB2  GLU  67           2HB      GLU  67   0.221  18.489  -0.949
  492    HB3  GLU  67           3HB      GLU  67   1.811  18.500  -0.194
  493    HG2  GLU  67           2HG      GLU  67   2.158  16.174  -0.867
  494    HG3  GLU  67           3HG      GLU  67   0.556  16.148  -1.609
  495    H    HIS  68           H        HIS  68  -1.390  19.260   0.862
  496    HA   HIS  68           HA       HIS  68  -0.161  21.125   2.565
  497    HB2  HIS  68           2HB      HIS  68  -3.098  20.852   1.858
  498    HB3  HIS  68           3HB      HIS  68  -2.337  22.284   2.551
  499    HD1  HIS  68           HD1      HIS  68  -0.500  23.470   0.992
  500    HD2  HIS  68           HD2      HIS  68  -2.947  20.689  -0.895
  501    HE1  HIS  68           HE1      HIS  68  -0.229  23.897  -1.466
  502    HE2  HIS  68           HE2      HIS  68  -1.678  22.180  -2.594
  503    H    HIS  69           H        HIS  69   0.170  21.018   4.671
  504    HA   HIS  69           HA       HIS  69  -0.942  18.854   6.203
  505    HB2  HIS  69           2HB      HIS  69   0.901  21.068   7.134
  506    HB3  HIS  69           3HB      HIS  69   0.615  19.524   7.935
  507    HD1  HIS  69           HD1      HIS  69   1.647  17.393   6.795
  508    HD2  HIS  69           HD2      HIS  69   2.749  21.003   5.055
  509    HE1  HIS  69           HE1      HIS  69   3.585  16.856   5.305
  510    HE2  HIS  69           HE2      HIS  69   4.118  19.013   4.131
  511    H    HIS  70           H        HIS  70  -2.671  18.908   7.484
  512    HA   HIS  70           HA       HIS  70  -3.986  21.450   8.001
  513    HB2  HIS  70           2HB      HIS  70  -4.856  18.606   8.574
  514    HB3  HIS  70           3HB      HIS  70  -5.849  20.040   8.838
  515    HD1  HIS  70           HD1      HIS  70  -6.730  21.280   6.738
  516    HD2  HIS  70           HD2      HIS  70  -4.629  17.794   5.892
  517    HE1  HIS  70           HE1      HIS  70  -7.172  20.798   4.315
  518    HE2  HIS  70           HE2      HIS  70  -5.706  18.829   3.778
  519    H    HIS  71           H        HIS  71  -4.301  22.368   9.989
  520    HA   HIS  71           HA       HIS  71  -2.130  21.949  11.786
  521    HB2  HIS  71           2HB      HIS  71  -4.527  23.766  12.111
  522    HB3  HIS  71           3HB      HIS  71  -3.012  23.870  13.003
  523    HD1  HIS  71           HD1      HIS  71  -4.659  25.402  10.267
  524    HD2  HIS  71           HD2      HIS  71  -0.739  24.241  11.004
  525    HE1  HIS  71           HE1      HIS  71  -3.261  26.684   8.631
  526    HE2  HIS  71           HE2      HIS  71  -0.922  25.832   8.969
  527    H    HIS  72           H        HIS  72  -2.061  20.327  13.200
  528    HA   HIS  72           HA       HIS  72  -3.940  20.170  15.337
  529    HB2  HIS  72           2HB      HIS  72  -4.795  17.925  15.007
  530    HB3  HIS  72           3HB      HIS  72  -5.204  18.904  13.605
  531    HD1  HIS  72           HD1      HIS  72  -3.806  18.413  11.400
  532    HD2  HIS  72           HD2      HIS  72  -3.279  15.679  14.479
  533    HE1  HIS  72           HE1      HIS  72  -2.737  16.415  10.340
  534    HE2  HIS  72           HE2      HIS  72  -2.618  14.706  12.175
  535    H    HIS  73           H        HIS  73  -3.120  19.088  17.117
  536    HA   HIS  73           HA       HIS  73  -0.781  17.396  16.879
  537    HB2  HIS  73           2HB      HIS  73   0.557  18.837  18.497
  538    HB3  HIS  73           3HB      HIS  73   0.417  19.436  16.851
  539    HD1  HIS  73           HD1      HIS  73  -0.971  20.079  20.316
  540    HD2  HIS  73           HD2      HIS  73  -0.671  21.948  16.619
  541    HE1  HIS  73           HE1      HIS  73  -1.714  22.440  20.696
  542    HE2  HIS  73           HE2      HIS  73  -1.282  23.599  18.511
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1 -17.248  10.561  -0.192
    2    H2   MET   1           2H       MET   1 -17.186  11.270   1.341
    3    H3   MET   1           3H       MET   1 -16.292   9.870   1.023
    4    HA   MET   1           HA       MET   1 -15.869  12.519  -0.242
    5    HB2  MET   1           2HB      MET   1 -15.210  12.480   2.124
    6    HB3  MET   1           3HB      MET   1 -14.239  11.043   1.846
    7    HG2  MET   1           2HG      MET   1 -12.802  12.338   0.316
    8    HG3  MET   1           3HG      MET   1 -13.757  13.778   0.678
    9    HE1  MET   1           3HE      MET   1 -10.588  13.682   1.004
   10    HE2  MET   1           1HE      MET   1 -10.393  14.494   2.555
   11    HE3  MET   1           2HE      MET   1 -11.565  15.099   1.386
   12    H    THR   2           H        THR   2 -15.148  12.211  -2.280
   13    HA   THR   2           HA       THR   2 -14.157   9.797  -3.318
   14    HB   THR   2           HB       THR   2 -13.720  12.601  -4.393
   15    HG1  THR   2           HG1      THR   2 -15.524  11.997  -5.741
   16   HG21  THR   2          3HG2      THR   2 -13.370  11.485  -6.563
   17   HG22  THR   2          1HG2      THR   2 -13.466   9.915  -5.768
   18   HG23  THR   2          2HG2      THR   2 -12.143  11.016  -5.391
   19    H    GLN   3           H        GLN   3 -12.391   8.821  -2.506
   20    HA   GLN   3           HA       GLN   3 -10.036  10.385  -1.763
   21    HB2  GLN   3           2HB      GLN   3 -10.675   7.443  -1.455
   22    HB3  GLN   3           3HB      GLN   3  -9.181   8.195  -0.907
   23    HG2  GLN   3           2HG      GLN   3 -10.444   9.616   0.623
   24    HG3  GLN   3           3HG      GLN   3 -11.950   8.896   0.058
   25   HE21  GLN   3          1HE2      GLN   3  -9.025   7.036   0.544
   26   HE22  GLN   3          2HE2      GLN   3  -9.596   6.159   1.916
   27    H    LYS   4           H        LYS   4  -7.873   9.126  -2.284
   28    HA   LYS   4           HA       LYS   4  -7.858   8.529  -5.183
   29    HB2  LYS   4           2HB      LYS   4  -5.723   9.856  -3.491
   30    HB3  LYS   4           3HB      LYS   4  -5.524   9.415  -5.181
   31    HG2  LYS   4           2HG      LYS   4  -7.837  11.155  -4.492
   32    HG3  LYS   4           3HG      LYS   4  -6.230  11.868  -4.403
   33    HD2  LYS   4           2HD      LYS   4  -7.239  12.260  -6.592
   34    HD3  LYS   4           3HD      LYS   4  -5.810  11.239  -6.734
   35    HE2  LYS   4           2HE      LYS   4  -7.622  10.448  -8.173
   36    HE3  LYS   4           3HE      LYS   4  -7.226   9.261  -6.935
   37    HZ1  LYS   4           3HZ      LYS   4  -9.507  11.159  -6.804
   38    HZ2  LYS   4           1HZ      LYS   4  -9.156   9.940  -5.687
   39    HZ3  LYS   4           2HZ      LYS   4  -9.621   9.536  -7.258
   40    H    PHE   5           H        PHE   5  -7.121   7.363  -2.067
   41    HA   PHE   5           HA       PHE   5  -5.886   4.964  -3.248
   42    HB2  PHE   5           2HB      PHE   5  -5.057   6.354  -0.687
   43    HB3  PHE   5           3HB      PHE   5  -4.526   4.740  -1.146
   44    HD1  PHE   5           HD1      PHE   5  -4.272   8.326  -1.928
   45    HD2  PHE   5           HD2      PHE   5  -2.886   4.406  -2.863
   46    HE1  PHE   5           HE1      PHE   5  -2.410   9.291  -3.214
   47    HE2  PHE   5           HE2      PHE   5  -1.023   5.370  -4.144
   48    HZ   PHE   5           HZ       PHE   5  -0.786   7.814  -4.322
   49    H    THR   6           H        THR   6  -6.895   3.136  -2.749
   50    HA   THR   6           HA       THR   6  -8.567   2.981  -0.321
   51    HB   THR   6           HB       THR   6 -10.169   3.446  -2.057
   52    HG1  THR   6           HG1      THR   6 -11.418   1.540  -1.907
   53   HG21  THR   6          3HG2      THR   6  -8.799   2.865  -4.010
   54   HG22  THR   6          1HG2      THR   6 -10.374   2.069  -4.080
   55   HG23  THR   6          2HG2      THR   6  -8.943   1.152  -3.609
   56    H    LYS   7           H        LYS   7  -8.971   0.829   0.432
   57    HA   LYS   7           HA       LYS   7  -6.754  -0.899   0.319
   58    HB2  LYS   7           2HB      LYS   7  -8.176  -2.479   1.569
   59    HB3  LYS   7           3HB      LYS   7  -8.284  -0.845   2.216
   60    HG2  LYS   7           2HG      LYS   7 -10.416  -0.507   1.089
   61    HG3  LYS   7           3HG      LYS   7 -10.303  -2.112   0.360
   62    HD2  LYS   7           2HD      LYS   7 -11.790  -2.115   2.307
   63    HD3  LYS   7           3HD      LYS   7 -10.378  -3.139   2.571
   64    HE2  LYS   7           2HE      LYS   7  -9.322  -1.289   3.831
   65    HE3  LYS   7           3HE      LYS   7 -10.791  -0.337   3.625
   66    HZ1  LYS   7           3HZ      LYS   7 -10.603  -2.944   5.033
   67    HZ2  LYS   7           1HZ      LYS   7 -12.009  -2.019   4.853
   68    HZ3  LYS   7           2HZ      LYS   7 -10.722  -1.425   5.776
   69    H    ASP   8           H        ASP   8  -9.441  -0.588  -1.776
   70    HA   ASP   8           HA       ASP   8  -9.574  -3.237  -2.803
   71    HB2  ASP   8           2HB      ASP   8 -11.441  -1.673  -2.961
   72    HB3  ASP   8           3HB      ASP   8 -10.486  -0.595  -3.975
   73    H    MET   9           H        MET   9  -7.725  -0.371  -3.728
   74    HA   MET   9           HA       MET   9  -6.970  -1.331  -6.309
   75    HB2  MET   9           2HB      MET   9  -5.560   0.600  -6.455
   76    HB3  MET   9           3HB      MET   9  -7.038   1.089  -5.639
   77    HG2  MET   9           2HG      MET   9  -5.748   0.718  -3.466
   78    HG3  MET   9           3HG      MET   9  -4.305   0.677  -4.473
   79    HE1  MET   9           3HE      MET   9  -4.414   4.265  -6.108
   80    HE2  MET   9           1HE      MET   9  -5.174   2.814  -6.762
   81    HE3  MET   9           2HE      MET   9  -3.561   2.722  -6.050
   82    H    THR  10           H        THR  10  -4.829  -1.909  -7.010
   83    HA   THR  10           HA       THR  10  -3.537  -3.738  -5.170
   84    HB   THR  10           HB       THR  10  -2.177  -4.438  -7.074
   85    HG1  THR  10           HG1      THR  10  -3.248  -3.142  -9.102
   86   HG21  THR  10          3HG2      THR  10  -5.090  -4.089  -7.831
   87   HG22  THR  10          1HG2      THR  10  -4.419  -5.409  -6.871
   88   HG23  THR  10          2HG2      THR  10  -3.966  -5.233  -8.565
   89    H    PHE  11           H        PHE  11  -1.219  -3.789  -4.813
   90    HA   PHE  11           HA       PHE  11  -0.076  -1.420  -3.922
   91    HB2  PHE  11           2HB      PHE  11   1.214  -4.021  -4.763
   92    HB3  PHE  11           3HB      PHE  11   2.121  -2.700  -4.030
   93    HD1  PHE  11           HD2      PHE  11  -0.373  -5.328  -3.449
   94    HD2  PHE  11           HD1      PHE  11   1.846  -2.144  -1.694
   95    HE1  PHE  11           HE2      PHE  11  -0.967  -6.153  -1.206
   96    HE2  PHE  11           HE1      PHE  11   1.255  -2.963   0.543
   97    HZ   PHE  11           HZ       PHE  11  -0.151  -4.969   0.793
   98    H    ALA  12           H        ALA  12   0.306  -3.018  -7.075
   99    HA   ALA  12           HA       ALA  12   2.241  -1.329  -8.188
  100    HB1  ALA  12           3HB      ALA  12   1.529  -3.428  -9.228
  101    HB2  ALA  12           1HB      ALA  12   1.426  -2.085 -10.365
  102    HB3  ALA  12           2HB      ALA  12  -0.037  -2.715  -9.609
  103    H    GLN  13           H        GLN  13  -1.323  -1.025  -8.257
  104    HA   GLN  13           HA       GLN  13  -1.442   1.330  -9.794
  105    HB2  GLN  13           2HB      GLN  13  -3.366   0.313  -7.687
  106    HB3  GLN  13           3HB      GLN  13  -3.719   1.616  -8.816
  107    HG2  GLN  13           2HG      GLN  13  -3.479   0.074 -10.690
  108    HG3  GLN  13           3HG      GLN  13  -3.083  -1.231  -9.576
  109   HE21  GLN  13          1HE2      GLN  13  -5.550   1.203  -8.985
  110   HE22  GLN  13          2HE2      GLN  13  -6.892   0.116  -9.082
  111    H    ALA  14           H        ALA  14  -1.329   0.896  -6.257
  112    HA   ALA  14           HA       ALA  14  -1.566   3.572  -5.485
  113    HB1  ALA  14           3HB      ALA  14  -1.701   1.706  -3.912
  114    HB2  ALA  14           1HB      ALA  14  -0.504   2.891  -3.384
  115    HB3  ALA  14           2HB      ALA  14   0.019   1.381  -4.135
  116    H    LEU  15           H        LEU  15   1.417   1.692  -6.067
  117    HA   LEU  15           HA       LEU  15   3.290   3.711  -5.632
  118    HB2  LEU  15           2HB      LEU  15   3.405   1.380  -7.554
  119    HB3  LEU  15           3HB      LEU  15   4.785   2.378  -7.137
  120    HG   LEU  15           HG       LEU  15   3.224   0.663  -5.190
  121   HD11  LEU  15          1HD1      LEU  15   4.494  -0.699  -6.762
  122   HD12  LEU  15          2HD1      LEU  15   5.222  -0.759  -5.157
  123   HD13  LEU  15          3HD1      LEU  15   5.952   0.233  -6.419
  124   HD21  LEU  15          3HD2      LEU  15   4.192   2.659  -4.143
  125   HD22  LEU  15          1HD2      LEU  15   5.773   2.245  -4.803
  126   HD23  LEU  15          2HD2      LEU  15   5.010   1.192  -3.609
  127    H    GLN  16           H        GLN  16   1.399   2.998  -8.523
  128    HA   GLN  16           HA       GLN  16   2.829   4.897 -10.157
  129    HB2  GLN  16           2HB      GLN  16   0.312   3.296 -10.626
  130    HB3  GLN  16           3HB      GLN  16   0.984   4.399 -11.819
  131    HG2  GLN  16           2HG      GLN  16   2.338   1.962 -10.675
  132    HG3  GLN  16           3HG      GLN  16   1.648   2.118 -12.290
  133   HE21  GLN  16          1HE2      GLN  16   4.296   2.978 -10.217
  134   HE22  GLN  16          2HE2      GLN  16   5.322   3.617 -11.451
  135    H    THR  17           H        THR  17  -0.011   5.030  -8.113
  136    HA   THR  17           HA       THR  17  -1.067   7.459  -9.201
  137    HB   THR  17           HB       THR  17  -1.441   6.339  -6.405
  138    HG1  THR  17           HG1      THR  17  -2.391   5.524  -8.805
  139   HG21  THR  17          3HG2      THR  17  -2.019   8.725  -6.564
  140   HG22  THR  17          1HG2      THR  17  -3.458   7.734  -6.338
  141   HG23  THR  17          2HG2      THR  17  -3.074   8.381  -7.934
  142    H    HIS  18           H        HIS  18   1.029   6.749  -6.401
  143    HA   HIS  18           HA       HIS  18   2.350   9.322  -6.785
  144    HB2  HIS  18           2HB      HIS  18   0.802   8.603  -4.324
  145    HB3  HIS  18           3HB      HIS  18   2.301   9.499  -4.125
  146    HD1  HIS  18           HD1      HIS  18   2.319  11.950  -4.825
  147    HD2  HIS  18           HD2      HIS  18  -1.283  10.038  -5.606
  148    HE1  HIS  18           HE1      HIS  18   0.705  13.772  -5.422
  149    HE2  HIS  18           HE2      HIS  18  -1.383  12.569  -6.123
  150    HA   PRO  19           HA       PRO  19   5.800   6.448  -6.327
  151    HB2  PRO  19           2HB      PRO  19   7.257   9.045  -6.083
  152    HB3  PRO  19           3HB      PRO  19   7.603   7.654  -7.117
  153    HG2  PRO  19           2HG      PRO  19   6.515   9.841  -8.156
  154    HG3  PRO  19           3HG      PRO  19   5.957   8.237  -8.671
  155    HD2  PRO  19           2HD      PRO  19   4.663  10.183  -6.796
  156    HD3  PRO  19           3HD      PRO  19   3.920   9.139  -8.025
  157    H    GLY  20           H        GLY  20   5.023   9.068  -4.120
  158    HA2  GLY  20           2HA      GLY  20   6.879   8.536  -2.065
  159    HA3  GLY  20           3HA      GLY  20   5.320   9.316  -1.853
  160    H    VAL  21           H        VAL  21   4.046   6.799  -3.023
  161    HA   VAL  21           HA       VAL  21   3.350   5.489  -0.657
  162    HB   VAL  21           HB       VAL  21   3.216   4.455  -3.504
  163   HG11  VAL  21          1HG1      VAL  21   3.066   2.594  -1.940
  164   HG12  VAL  21          2HG1      VAL  21   1.495   2.902  -2.676
  165   HG13  VAL  21          3HG1      VAL  21   1.814   3.438  -1.027
  166   HG21  VAL  21          3HG2      VAL  21   1.126   5.804  -1.786
  167   HG22  VAL  21          1HG2      VAL  21   0.878   5.178  -3.416
  168   HG23  VAL  21          2HG2      VAL  21   1.975   6.532  -3.150
  169    H    ALA  22           H        ALA  22   6.018   4.901  -2.871
  170    HA   ALA  22           HA       ALA  22   6.812   2.344  -2.141
  171    HB1  ALA  22           3HB      ALA  22   8.596   4.697  -2.795
  172    HB2  ALA  22           1HB      ALA  22   7.856   3.597  -3.960
  173    HB3  ALA  22           2HB      ALA  22   9.074   2.998  -2.833
  174    H    GLY  23           H        GLY  23   7.771   5.429  -0.603
  175    HA2  GLY  23           2HA      GLY  23   9.298   4.278   1.486
  176    HA3  GLY  23           3HA      GLY  23   8.605   5.894   1.487
  177    H    VAL  24           H        VAL  24   5.879   5.221   1.304
  178    HA   VAL  24           HA       VAL  24   5.181   4.824   3.990
  179    HB   VAL  24           HB       VAL  24   3.411   4.353   1.578
  180   HG11  VAL  24          1HG1      VAL  24   2.428   3.481   3.628
  181   HG12  VAL  24          2HG1      VAL  24   1.567   4.931   3.113
  182   HG13  VAL  24          3HG1      VAL  24   2.719   5.016   4.446
  183   HG21  VAL  24          3HG2      VAL  24   3.955   6.902   3.108
  184   HG22  VAL  24          1HG2      VAL  24   2.724   6.704   1.860
  185   HG23  VAL  24          2HG2      VAL  24   4.432   6.549   1.445
  186    H    LEU  25           H        LEU  25   4.950   2.549   1.244
  187    HA   LEU  25           HA       LEU  25   3.929   0.356   2.626
  188    HB2  LEU  25           2HB      LEU  25   5.801   0.393   0.253
  189    HB3  LEU  25           3HB      LEU  25   4.933  -1.025   0.813
  190    HG   LEU  25           HG       LEU  25   3.689   1.502  -0.291
  191   HD11  LEU  25          1HD1      LEU  25   3.850  -1.288  -1.430
  192   HD12  LEU  25          2HD1      LEU  25   4.747   0.122  -1.998
  193   HD13  LEU  25          3HD1      LEU  25   2.990   0.077  -2.146
  194   HD21  LEU  25          3HD2      LEU  25   2.376  -1.036   0.692
  195   HD22  LEU  25          1HD2      LEU  25   1.560   0.288  -0.143
  196   HD23  LEU  25          2HD2      LEU  25   2.276   0.556   1.445
  197    H    ARG  26           H        ARG  26   7.368   1.106   1.943
  198    HA   ARG  26           HA       ARG  26   8.464  -1.047   3.374
  199    HB2  ARG  26           2HB      ARG  26   9.690   1.702   3.051
  200    HB3  ARG  26           3HB      ARG  26  10.550   0.206   3.395
  201    HG2  ARG  26           2HG      ARG  26   9.848  -0.670   1.194
  202    HG3  ARG  26           3HG      ARG  26   9.065   0.874   0.856
  203    HD2  ARG  26           2HD      ARG  26  11.157   0.998  -0.212
  204    HD3  ARG  26           3HD      ARG  26  11.336   1.949   1.263
  205    HE   ARG  26           HE       ARG  26  12.269  -0.843   1.108
  206   HH11  ARG  26          1HH1      ARG  26  12.816   2.454   1.924
  207   HH12  ARG  26          2HH1      ARG  26  14.464   2.178   2.377
  208   HH21  ARG  26          1HH2      ARG  26  14.364  -1.192   1.714
  209   HH22  ARG  26          2HH2      ARG  26  15.333   0.129   2.268
  210    H    SER  27           H        SER  27   7.455   2.160   4.439
  211    HA   SER  27           HA       SER  27   8.394   2.075   7.087
  212    HB2  SER  27           2HB      SER  27   7.556   4.125   5.982
  213    HB3  SER  27           3HB      SER  27   5.919   3.478   6.041
  214    HG   SER  27           HG       SER  27   6.827   4.976   7.809
  215    H    TYR  28           H        TYR  28   5.549   0.656   5.618
  216    HA   TYR  28           HA       TYR  28   4.635  -0.322   8.248
  217    HB2  TYR  28           2HB      TYR  28   3.209  -0.039   5.598
  218    HB3  TYR  28           3HB      TYR  28   2.533  -0.957   6.936
  219    HD1  TYR  28           HD1      TYR  28   2.329   0.342   9.215
  220    HD2  TYR  28           HD2      TYR  28   2.691   2.236   5.412
  221    HE1  TYR  28           HE1      TYR  28   1.322   2.386  10.140
  222    HE2  TYR  28           HE2      TYR  28   1.694   4.286   6.335
  223    HH   TYR  28           HH       TYR  28   0.050   4.778   8.359
  224    H    ASN  29           H        ASN  29   6.910  -1.498   6.708
  225    HA   ASN  29           HA       ASN  29   7.801  -3.588   6.492
  226    HB2  ASN  29           2HB      ASN  29   6.553  -4.080   8.580
  227    HB3  ASN  29           3HB      ASN  29   5.167  -4.579   7.619
  228   HD21  ASN  29          1HD2      ASN  29   8.548  -5.260   6.899
  229   HD22  ASN  29          2HD2      ASN  29   8.424  -6.970   7.093
  230    H    LEU  30           H        LEU  30   5.511  -2.452   4.554
  231    HA   LEU  30           HA       LEU  30   4.939  -4.892   3.053
  232    HB2  LEU  30           2HB      LEU  30   4.080  -2.026   2.612
  233    HB3  LEU  30           3HB      LEU  30   3.548  -3.390   1.645
  234    HG   LEU  30           HG       LEU  30   3.020  -3.086   4.611
  235   HD11  LEU  30          1HD1      LEU  30   1.136  -2.654   2.291
  236   HD12  LEU  30          2HD1      LEU  30   1.822  -1.387   3.307
  237   HD13  LEU  30          3HD1      LEU  30   0.722  -2.578   4.003
  238   HD21  LEU  30          3HD2      LEU  30   3.110  -5.413   3.885
  239   HD22  LEU  30          1HD2      LEU  30   1.957  -5.069   2.593
  240   HD23  LEU  30          2HD2      LEU  30   1.457  -4.945   4.279
  241    H    GLY  31           H        GLY  31   7.635  -3.214   3.225
  242    HA2  GLY  31           2HA      GLY  31   8.193  -2.438   0.538
  243    HA3  GLY  31           3HA      GLY  31   9.378  -2.715   1.802
  244    H    CYS  32           H        CYS  32   7.998  -5.533   1.975
  245    HA   CYS  32           HA       CYS  32   9.834  -6.763   0.062
  246    HB2  CYS  32           2HB      CYS  32   8.241  -7.975   2.333
  247    HB3  CYS  32           3HB      CYS  32   9.387  -8.855   1.322
  248    HG   CYS  32           HG       CYS  32  10.151  -7.818   4.090
  249    H    ILE  33           H        ILE  33   6.881  -5.669  -0.403
  250    HA   ILE  33           HA       ILE  33   5.254  -7.782  -1.197
  251    HB   ILE  33           HB       ILE  33   4.206  -6.158  -2.816
  252   HG12  ILE  33          2HG1      ILE  33   6.271  -4.255  -1.655
  253   HG13  ILE  33          3HG1      ILE  33   6.246  -4.844  -3.313
  254   HG21  ILE  33          1HG2      ILE  33   3.379  -6.409  -0.552
  255   HG22  ILE  33          2HG2      ILE  33   3.298  -4.717  -1.040
  256   HG23  ILE  33          3HG2      ILE  33   4.578  -5.261   0.043
  257   HD11  ILE  33          3HD1      ILE  33   4.113  -3.149  -2.033
  258   HD12  ILE  33          1HD1      ILE  33   4.143  -3.701  -3.707
  259   HD13  ILE  33          2HD1      ILE  33   5.370  -2.577  -3.127
  260    H    GLY  34           H        GLY  34   7.895  -6.248  -2.981
  261    HA2  GLY  34           2HA      GLY  34   7.401  -7.503  -5.484
  262    HA3  GLY  34           3HA      GLY  34   8.926  -6.803  -4.970
  263    H    CYS  35           H        CYS  35   8.911  -8.645  -2.572
  264    HA   CYS  35           HA       CYS  35  10.218 -10.891  -3.873
  265    HB2  CYS  35           2HB      CYS  35   9.887 -10.257  -0.930
  266    HB3  CYS  35           3HB      CYS  35  10.907 -11.529  -1.595
  267    HG   CYS  35           HG       CYS  35  12.499  -9.605  -3.035
  268    H    MET  36           H        MET  36   7.561 -10.462  -1.519
  269    HA   MET  36           HA       MET  36   6.800 -13.206  -1.511
  270    HB2  MET  36           2HB      MET  36   4.809 -12.459  -0.283
  271    HB3  MET  36           3HB      MET  36   6.275 -11.744   0.369
  272    HG2  MET  36           2HG      MET  36   5.781  -9.660  -0.830
  273    HG3  MET  36           3HG      MET  36   4.292 -10.380  -1.443
  274    HE1  MET  36           3HE      MET  36   3.302 -12.061   1.110
  275    HE2  MET  36           1HE      MET  36   2.241 -11.076   0.100
  276    HE3  MET  36           2HE      MET  36   2.223 -10.881   1.853
  277    H    GLY  37           H        GLY  37   6.093 -10.613  -3.680
  278    HA2  GLY  37           2HA      GLY  37   5.110 -10.852  -5.797
  279    HA3  GLY  37           3HA      GLY  37   4.458 -12.406  -5.304
  280    H    ALA  38           H        ALA  38   4.103  -8.928  -4.549
  281    HA   ALA  38           HA       ALA  38   1.195  -9.395  -4.269
  282    HB1  ALA  38           3HB      ALA  38   1.102  -7.898  -2.382
  283    HB2  ALA  38           1HB      ALA  38   2.828  -7.555  -2.524
  284    HB3  ALA  38           2HB      ALA  38   2.283  -9.169  -2.066
  285    H    GLN  39           H        GLN  39   3.213  -7.973  -6.322
  286    HA   GLN  39           HA       GLN  39   2.458  -5.269  -6.457
  287    HB2  GLN  39           2HB      GLN  39   3.370  -7.197  -8.592
  288    HB3  GLN  39           3HB      GLN  39   3.011  -5.514  -8.955
  289    HG2  GLN  39           2HG      GLN  39   5.061  -6.448  -6.949
  290    HG3  GLN  39           3HG      GLN  39   5.411  -5.942  -8.603
  291   HE21  GLN  39          1HE2      GLN  39   4.459  -4.886  -5.431
  292   HE22  GLN  39          2HE2      GLN  39   4.710  -3.202  -5.703
  293    H    ASN  40           H        ASN  40   0.907  -8.129  -7.841
  294    HA   ASN  40           HA       ASN  40  -1.229  -6.506  -9.023
  295    HB2  ASN  40           2HB      ASN  40  -0.878  -9.515  -9.096
  296    HB3  ASN  40           3HB      ASN  40  -1.954  -8.550 -10.103
  297   HD21  ASN  40          1HD2      ASN  40   1.309  -9.529  -9.524
  298   HD22  ASN  40          2HD2      ASN  40   1.964  -8.945 -11.010
  299    H    GLU  41           H        GLU  41  -0.731  -7.218  -6.020
  300    HA   GLU  41           HA       GLU  41  -3.369  -8.390  -5.414
  301    HB2  GLU  41           2HB      GLU  41  -1.334  -9.568  -4.559
  302    HB3  GLU  41           3HB      GLU  41  -0.948  -8.142  -3.608
  303    HG2  GLU  41           2HG      GLU  41  -2.931  -8.415  -2.283
  304    HG3  GLU  41           3HG      GLU  41  -3.495  -9.726  -3.317
  305    H    SER  42           H        SER  42  -4.687  -7.414  -3.770
  306    HA   SER  42           HA       SER  42  -4.661  -4.553  -3.881
  307    HB2  SER  42           2HB      SER  42  -6.418  -6.404  -2.249
  308    HB3  SER  42           3HB      SER  42  -6.702  -4.682  -2.498
  309    HG   SER  42           HG       SER  42  -7.283  -5.047  -4.539
  310    H    LEU  43           H        LEU  43  -4.536  -3.064  -2.167
  311    HA   LEU  43           HA       LEU  43  -2.392  -3.273  -0.455
  312    HB2  LEU  43           2HB      LEU  43  -4.856  -1.544  -0.205
  313    HB3  LEU  43           3HB      LEU  43  -3.420  -1.334   0.781
  314    HG   LEU  43           HG       LEU  43  -3.487  -1.085  -2.237
  315   HD11  LEU  43          1HD1      LEU  43  -3.376   1.064  -0.118
  316   HD12  LEU  43          2HD1      LEU  43  -4.757   0.703  -1.154
  317   HD13  LEU  43          3HD1      LEU  43  -3.262   1.316  -1.861
  318   HD21  LEU  43          3HD2      LEU  43  -1.241  -0.142  -1.975
  319   HD22  LEU  43          1HD2      LEU  43  -1.311  -1.800  -1.378
  320   HD23  LEU  43          2HD2      LEU  43  -1.307  -0.452  -0.239
  321    H    GLU  44           H        GLU  44  -5.825  -3.775   0.438
  322    HA   GLU  44           HA       GLU  44  -5.384  -4.179   3.178
  323    HB2  GLU  44           2HB      GLU  44  -7.616  -3.753   2.365
  324    HB3  GLU  44           3HB      GLU  44  -7.600  -5.229   1.408
  325    HG2  GLU  44           2HG      GLU  44  -7.660  -6.593   3.359
  326    HG3  GLU  44           3HG      GLU  44  -7.368  -5.212   4.411
  327    H    GLN  45           H        GLN  45  -5.348  -6.498   0.505
  328    HA   GLN  45           HA       GLN  45  -5.304  -8.852   2.045
  329    HB2  GLN  45           2HB      GLN  45  -4.043  -8.402  -0.671
  330    HB3  GLN  45           3HB      GLN  45  -4.473  -9.956   0.032
  331    HG2  GLN  45           2HG      GLN  45  -6.843  -9.313  -0.012
  332    HG3  GLN  45           3HG      GLN  45  -6.401  -7.768  -0.738
  333   HE21  GLN  45          1HE2      GLN  45  -7.551  -8.125  -2.618
  334   HE22  GLN  45          2HE2      GLN  45  -7.080  -9.295  -3.797
  335    H    GLY  46           H        GLY  46  -2.537  -7.206   0.454
  336    HA2  GLY  46           2HA      GLY  46  -0.488  -8.697   1.631
  337    HA3  GLY  46           3HA      GLY  46  -0.322  -7.047   1.052
  338    H    ALA  47           H        ALA  47  -2.142  -5.808   2.865
  339    HA   ALA  47           HA       ALA  47  -0.536  -5.381   5.140
  340    HB1  ALA  47           3HB      ALA  47  -2.163  -3.738   4.309
  341    HB2  ALA  47           1HB      ALA  47  -2.417  -4.093   6.018
  342    HB3  ALA  47           2HB      ALA  47  -3.483  -4.797   4.802
  343    H    ASN  48           H        ASN  48  -3.579  -7.231   4.798
  344    HA   ASN  48           HA       ASN  48  -3.725  -8.181   7.439
  345    HB2  ASN  48           2HB      ASN  48  -4.829  -9.260   4.843
  346    HB3  ASN  48           3HB      ASN  48  -5.115 -10.068   6.379
  347   HD21  ASN  48          1HD2      ASN  48  -4.940  -6.581   6.009
  348   HD22  ASN  48          2HD2      ASN  48  -6.604  -6.287   6.350
  349    H    ALA  49           H        ALA  49  -2.081  -9.507   4.591
  350    HA   ALA  49           HA       ALA  49  -1.246 -11.957   5.671
  351    HB1  ALA  49           3HB      ALA  49  -1.089 -11.392   3.288
  352    HB2  ALA  49           1HB      ALA  49   0.456 -11.961   3.922
  353    HB3  ALA  49           2HB      ALA  49   0.194 -10.239   3.646
  354    H    HIS  50           H        HIS  50   0.205  -8.733   5.900
  355    HA   HIS  50           HA       HIS  50   2.423  -9.750   7.516
  356    HB2  HIS  50           2HB      HIS  50   1.756  -7.000   6.452
  357    HB3  HIS  50           3HB      HIS  50   3.108  -7.299   7.537
  358    HD1  HIS  50           HD1      HIS  50   5.220  -7.402   6.266
  359    HD2  HIS  50           HD2      HIS  50   2.062  -8.998   4.092
  360    HE1  HIS  50           HE1      HIS  50   6.216  -8.143   4.092
  361    HE2  HIS  50           HE2      HIS  50   4.336  -9.325   2.905
  362    H    GLY  51           H        GLY  51  -0.665  -9.239   8.248
  363    HA2  GLY  51           2HA      GLY  51  -1.823  -8.846  10.194
  364    HA3  GLY  51           3HA      GLY  51  -0.286  -8.969  11.034
  365    H    LEU  52           H        LEU  52  -1.724  -6.623   8.745
  366    HA   LEU  52           HA       LEU  52  -0.953  -4.456  10.608
  367    HB2  LEU  52           2HB      LEU  52  -0.946  -4.365   7.591
  368    HB3  LEU  52           3HB      LEU  52  -0.454  -3.070   8.667
  369    HG   LEU  52           HG       LEU  52   0.949  -5.742   8.521
  370   HD11  LEU  52          1HD1      LEU  52   2.664  -4.594   7.206
  371   HD12  LEU  52          2HD1      LEU  52   1.656  -3.148   7.150
  372   HD13  LEU  52          3HD1      LEU  52   1.115  -4.633   6.368
  373   HD21  LEU  52          3HD2      LEU  52   2.749  -4.584   9.687
  374   HD22  LEU  52          1HD2      LEU  52   1.257  -4.517  10.622
  375   HD23  LEU  52          2HD2      LEU  52   1.796  -3.099   9.721
  376    H    ASN  53           H        ASN  53  -2.301  -2.636  10.732
  377    HA   ASN  53           HA       ASN  53  -5.052  -2.978   9.901
  378    HB2  ASN  53           2HB      ASN  53  -4.617  -1.983  12.082
  379    HB3  ASN  53           3HB      ASN  53  -3.657  -0.705  11.344
  380   HD21  ASN  53          1HD2      ASN  53  -4.962   0.903  12.204
  381   HD22  ASN  53          2HD2      ASN  53  -6.558   1.214  11.617
  382    H    VAL  54           H        VAL  54  -5.354  -2.742   7.744
  383    HA   VAL  54           HA       VAL  54  -3.853  -1.166   5.999
  384    HB   VAL  54           HB       VAL  54  -5.287  -3.019   5.245
  385   HG11  VAL  54          1HG1      VAL  54  -7.225  -2.618   6.680
  386   HG12  VAL  54          2HG1      VAL  54  -7.701  -2.728   4.986
  387   HG13  VAL  54          3HG1      VAL  54  -7.605  -1.152   5.774
  388   HG21  VAL  54          3HG2      VAL  54  -5.955  -0.380   3.929
  389   HG22  VAL  54          1HG2      VAL  54  -6.126  -1.972   3.191
  390   HG23  VAL  54          2HG2      VAL  54  -4.526  -1.366   3.617
  391    H    GLU  55           H        GLU  55  -6.624  -0.297   7.963
  392    HA   GLU  55           HA       GLU  55  -7.487   2.018   6.657
  393    HB2  GLU  55           2HB      GLU  55  -7.467   1.459   9.633
  394    HB3  GLU  55           3HB      GLU  55  -8.435   2.690   8.832
  395    HG2  GLU  55           2HG      GLU  55  -8.669  -0.288   8.395
  396    HG3  GLU  55           3HG      GLU  55  -9.738   0.694   9.394
  397    H    ASP  56           H        ASP  56  -5.043   1.677   9.225
  398    HA   ASP  56           HA       ASP  56  -4.459   4.440   9.444
  399    HB2  ASP  56           2HB      ASP  56  -3.935   2.509  11.086
  400    HB3  ASP  56           3HB      ASP  56  -2.499   2.244  10.105
  401    H    ILE  57           H        ILE  57  -3.263   1.902   7.361
  402    HA   ILE  57           HA       ILE  57  -1.029   3.301   6.276
  403    HB   ILE  57           HB       ILE  57  -2.668   1.100   4.991
  404   HG12  ILE  57          2HG1      ILE  57  -0.170   0.907   6.706
  405   HG13  ILE  57          3HG1      ILE  57  -1.791   0.431   7.200
  406   HG21  ILE  57          1HG2      ILE  57   0.157   2.023   4.421
  407   HG22  ILE  57          2HG2      ILE  57  -1.250   2.295   3.393
  408   HG23  ILE  57          3HG2      ILE  57  -0.659   0.656   3.659
  409   HD11  ILE  57          3HD1      ILE  57  -1.809  -1.305   5.490
  410   HD12  ILE  57          1HD1      ILE  57  -0.437  -1.491   6.584
  411   HD13  ILE  57          2HD1      ILE  57  -0.195  -0.815   4.972
  412    H    LEU  58           H        LEU  58  -4.376   2.822   5.134
  413    HA   LEU  58           HA       LEU  58  -4.238   4.213   2.730
  414    HB2  LEU  58           2HB      LEU  58  -6.573   3.967   4.633
  415    HB3  LEU  58           3HB      LEU  58  -6.697   4.524   2.974
  416    HG   LEU  58           HG       LEU  58  -5.800   1.764   3.831
  417   HD11  LEU  58          1HD1      LEU  58  -8.179   2.119   4.232
  418   HD12  LEU  58          2HD1      LEU  58  -7.922   0.998   2.896
  419   HD13  LEU  58          3HD1      LEU  58  -8.389   2.667   2.568
  420   HD21  LEU  58          3HD2      LEU  58  -6.293   2.892   1.071
  421   HD22  LEU  58          1HD2      LEU  58  -5.913   1.210   1.452
  422   HD23  LEU  58          2HD2      LEU  58  -4.723   2.475   1.761
  423    H    ARG  59           H        ARG  59  -4.780   5.451   5.993
  424    HA   ARG  59           HA       ARG  59  -5.457   8.089   5.488
  425    HB2  ARG  59           2HB      ARG  59  -5.333   7.076   7.749
  426    HB3  ARG  59           3HB      ARG  59  -3.577   7.076   7.640
  427    HG2  ARG  59           2HG      ARG  59  -3.778   9.614   7.316
  428    HG3  ARG  59           3HG      ARG  59  -5.439   9.426   7.879
  429    HD2  ARG  59           2HD      ARG  59  -4.145  10.000   9.782
  430    HD3  ARG  59           3HD      ARG  59  -4.490   8.275   9.921
  431    HE   ARG  59           HE       ARG  59  -1.953   9.016   8.697
  432   HH11  ARG  59          1HH1      ARG  59  -3.614   7.946  11.522
  433   HH12  ARG  59          2HH1      ARG  59  -2.168   7.399  12.293
  434   HH21  ARG  59          1HH2      ARG  59  -0.106   8.325   9.710
  435   HH22  ARG  59          2HH2      ARG  59  -0.207   7.605  11.278
  436    H    ASP  60           H        ASP  60  -2.159   6.784   5.914
  437    HA   ASP  60           HA       ASP  60  -0.849   9.236   5.340
  438    HB2  ASP  60           2HB      ASP  60   0.067   7.271   6.673
  439    HB3  ASP  60           3HB      ASP  60   0.369   6.471   5.133
  440    H    LEU  61           H        LEU  61  -1.815   6.494   3.355
  441    HA   LEU  61           HA       LEU  61  -0.366   7.124   1.017
  442    HB2  LEU  61           2HB      LEU  61  -3.006   5.691   1.349
  443    HB3  LEU  61           3HB      LEU  61  -2.110   5.764  -0.157
  444    HG   LEU  61           HG       LEU  61  -1.145   4.469   2.401
  445   HD11  LEU  61          1HD1      LEU  61  -2.081   3.248  -0.196
  446   HD12  LEU  61          2HD1      LEU  61  -2.936   3.203   1.347
  447   HD13  LEU  61          3HD1      LEU  61  -1.392   2.369   1.170
  448   HD21  LEU  61          3HD2      LEU  61   0.717   5.389   1.147
  449   HD22  LEU  61          1HD2      LEU  61   0.130   4.625  -0.333
  450   HD23  LEU  61          2HD2      LEU  61   0.706   3.632   1.005
  451    H    ASN  62           H        ASN  62  -3.768   7.912   1.867
  452    HA   ASN  62           HA       ASN  62  -4.232   9.489  -0.445
  453    HB2  ASN  62           2HB      ASN  62  -5.632   9.348   2.227
  454    HB3  ASN  62           3HB      ASN  62  -6.161  10.445   0.955
  455   HD21  ASN  62          1HD2      ASN  62  -5.967   7.145   1.973
  456   HD22  ASN  62          2HD2      ASN  62  -6.957   6.489   0.718
  457    H    ALA  63           H        ALA  63  -2.859  10.243   2.690
  458    HA   ALA  63           HA       ALA  63  -2.909  13.040   2.584
  459    HB1  ALA  63           3HB      ALA  63  -1.043  12.975   4.164
  460    HB2  ALA  63           1HB      ALA  63  -0.792  11.266   3.805
  461    HB3  ALA  63           2HB      ALA  63  -2.281  11.792   4.588
  462    H    LEU  64           H        LEU  64  -0.823  10.748   0.937
  463    HA   LEU  64           HA       LEU  64   1.133  12.605   0.012
  464    HB2  LEU  64           2HB      LEU  64   0.257   9.976  -1.200
  465    HB3  LEU  64           3HB      LEU  64   1.716  10.854  -1.621
  466    HG   LEU  64           HG       LEU  64   1.136   9.649   1.091
  467   HD11  LEU  64          1HD1      LEU  64   2.872   8.022   0.491
  468   HD12  LEU  64          2HD1      LEU  64   2.957   8.717  -1.127
  469   HD13  LEU  64          3HD1      LEU  64   1.476   7.927  -0.582
  470   HD21  LEU  64          3HD2      LEU  64   2.570  11.626   1.231
  471   HD22  LEU  64          1HD2      LEU  64   3.644  10.942   0.009
  472   HD23  LEU  64          2HD2      LEU  64   3.481  10.156   1.580
  473    H    ALA  65           H        ALA  65  -2.025  11.657  -1.140
  474    HA   ALA  65           HA       ALA  65  -1.731  12.956  -3.715
  475    HB1  ALA  65           3HB      ALA  65  -4.176  11.770  -2.394
  476    HB2  ALA  65           1HB      ALA  65  -3.093  10.937  -3.510
  477    HB3  ALA  65           2HB      ALA  65  -4.061  12.298  -4.074
  478    H    LEU  66           H        LEU  66  -3.261  13.635  -0.614
  479    HA   LEU  66           HA       LEU  66  -4.582  16.027  -1.499
  480    HB2  LEU  66           2HB      LEU  66  -3.997  15.028   1.294
  481    HB3  LEU  66           3HB      LEU  66  -5.048  16.377   0.908
  482    HG   LEU  66           HG       LEU  66  -5.521  13.496   0.111
  483   HD11  LEU  66          1HD1      LEU  66  -6.894  15.213   2.183
  484   HD12  LEU  66          2HD1      LEU  66  -5.813  13.856   2.503
  485   HD13  LEU  66          3HD1      LEU  66  -7.365  13.577   1.714
  486   HD21  LEU  66          3HD2      LEU  66  -7.724  14.283  -0.634
  487   HD22  LEU  66          1HD2      LEU  66  -6.420  15.040  -1.546
  488   HD23  LEU  66          2HD2      LEU  66  -7.251  15.945  -0.282
  489    H    GLU  67           H        GLU  67  -1.675  15.366   0.447
  490    HA   GLU  67           HA       GLU  67   0.149  16.594   1.001
  491    HB2  GLU  67           2HB      GLU  67  -0.730  18.429  -1.233
  492    HB3  GLU  67           3HB      GLU  67   0.840  18.463  -0.445
  493    HG2  GLU  67           2HG      GLU  67   1.288  16.190  -1.271
  494    HG3  GLU  67           3HG      GLU  67  -0.271  16.199  -2.099
  495    H    HIS  68           H        HIS  68  -2.942  17.930   1.279
  496    HA   HIS  68           HA       HIS  68  -2.477  20.570   2.029
  497    HB2  HIS  68           2HB      HIS  68  -4.688  18.678   2.852
  498    HB3  HIS  68           3HB      HIS  68  -4.685  20.396   3.227
  499    HD1  HIS  68           HD1      HIS  68  -5.007  22.042   1.234
  500    HD2  HIS  68           HD2      HIS  68  -5.398  18.029   0.240
  501    HE1  HIS  68           HE1      HIS  68  -6.043  22.014  -1.050
  502    HE2  HIS  68           HE2      HIS  68  -6.240  19.579  -1.649
  503    H    HIS  69           H        HIS  69  -2.275  21.620   3.986
  504    HA   HIS  69           HA       HIS  69  -0.517  20.624   5.870
  505    HB2  HIS  69           2HB      HIS  69  -1.147  23.030   5.436
  506    HB3  HIS  69           3HB      HIS  69  -2.607  22.760   6.375
  507    HD1  HIS  69           HD1      HIS  69   0.994  23.492   6.690
  508    HD2  HIS  69           HD2      HIS  69  -2.145  22.389   9.179
  509    HE1  HIS  69           HE1      HIS  69   1.794  23.949   9.024
  510    HE2  HIS  69           HE2      HIS  69  -0.047  23.112  10.508
  511    H    HIS  70           H        HIS  70  -0.726  19.122   7.428
  512    HA   HIS  70           HA       HIS  70  -3.246  17.989   8.155
  513    HB2  HIS  70           2HB      HIS  70  -0.501  17.632   9.392
  514    HB3  HIS  70           3HB      HIS  70  -1.915  16.670   9.807
  515    HD1  HIS  70           HD1      HIS  70  -2.735  14.940   8.029
  516    HD2  HIS  70           HD2      HIS  70   0.755  16.942   6.989
  517    HE1  HIS  70           HE1      HIS  70  -1.754  13.634   6.129
  518    HE2  HIS  70           HE2      HIS  70   0.441  14.762   5.633
  519    H    HIS  71           H        HIS  71  -4.004  17.807  10.473
  520    HA   HIS  71           HA       HIS  71  -4.947  18.839  12.268
  521    HB2  HIS  71           2HB      HIS  71  -2.639  18.782  13.115
  522    HB3  HIS  71           3HB      HIS  71  -2.299  20.318  12.329
  523    HD1  HIS  71           HD1      HIS  71  -2.337  22.205  13.903
  524    HD2  HIS  71           HD2      HIS  71  -4.965  19.205  15.065
  525    HE1  HIS  71           HE1      HIS  71  -3.369  23.010  16.042
  526    HE2  HIS  71           HE2      HIS  71  -4.905  21.156  16.763
  527    H    HIS  72           H        HIS  72  -5.295  19.986   9.561
  528    HA   HIS  72           HA       HIS  72  -6.279  22.639  10.370
  529    HB2  HIS  72           2HB      HIS  72  -4.161  22.959   9.134
  530    HB3  HIS  72           3HB      HIS  72  -4.826  22.066   7.771
  531    HD1  HIS  72           HD1      HIS  72  -6.248  23.363   6.121
  532    HD2  HIS  72           HD2      HIS  72  -5.394  25.526   9.569
  533    HE1  HIS  72           HE1      HIS  72  -7.029  25.701   5.661
  534    HE2  HIS  72           HE2      HIS  72  -6.394  27.016   7.703
  535    H    HIS  73           H        HIS  73  -8.298  23.119   9.676
  536    HA   HIS  73           HA       HIS  73  -9.734  21.129   8.079
  537    HB2  HIS  73           2HB      HIS  73 -10.737  23.554   9.597
  538    HB3  HIS  73           3HB      HIS  73 -11.761  22.403   8.745
  539    HD1  HIS  73           HD1      HIS  73 -12.346  20.256   9.940
  540    HD2  HIS  73           HD2      HIS  73  -9.481  22.498  11.947
  541    HE1  HIS  73           HE1      HIS  73 -12.086  19.161  12.184
  542    HE2  HIS  73           HE2      HIS  73 -10.219  20.425  13.301
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1 -17.435  11.556  -1.624
    2    H2   MET   1           2H       MET   1 -17.846  12.184  -0.107
    3    H3   MET   1           3H       MET   1 -18.060  10.538  -0.426
    4    HA   MET   1           HA       MET   1 -15.453  11.938  -0.356
    5    HB2  MET   1           2HB      MET   1 -16.428  11.797   1.874
    6    HB3  MET   1           3HB      MET   1 -16.754  10.084   1.655
    7    HG2  MET   1           2HG      MET   1 -14.357   9.630   1.556
    8    HG3  MET   1           3HG      MET   1 -14.018  11.350   1.757
    9    HE1  MET   1           3HE      MET   1 -12.810   8.986   3.614
   10    HE2  MET   1           1HE      MET   1 -12.922   9.764   5.193
   11    HE3  MET   1           2HE      MET   1 -12.397  10.691   3.787
   12    H    THR   2           H        THR   2 -14.539  10.988  -2.149
   13    HA   THR   2           HA       THR   2 -14.438   8.030  -2.224
   14    HB   THR   2           HB       THR   2 -13.888  10.000  -4.466
   15    HG1  THR   2           HG1      THR   2 -15.851   9.393  -5.270
   16   HG21  THR   2          3HG2      THR   2 -12.512   7.989  -4.698
   17   HG22  THR   2          1HG2      THR   2 -13.788   8.006  -5.916
   18   HG23  THR   2          2HG2      THR   2 -13.940   6.972  -4.495
   19    H    GLN   3           H        GLN   3 -12.640   7.430  -1.071
   20    HA   GLN   3           HA       GLN   3 -10.192   8.915  -1.099
   21    HB2  GLN   3           2HB      GLN   3 -10.824   6.109  -0.163
   22    HB3  GLN   3           3HB      GLN   3  -9.236   6.854   0.004
   23    HG2  GLN   3           2HG      GLN   3 -10.282   8.658   1.349
   24    HG3  GLN   3           3HG      GLN   3 -11.814   7.793   1.257
   25   HE21  GLN   3          1HE2      GLN   3  -8.737   6.159   1.579
   26   HE22  GLN   3          2HE2      GLN   3  -8.981   5.619   3.198
   27    H    LYS   4           H        LYS   4  -8.966   9.093  -2.865
   28    HA   LYS   4           HA       LYS   4  -9.062   7.425  -5.113
   29    HB2  LYS   4           2HB      LYS   4  -6.792   9.226  -4.227
   30    HB3  LYS   4           3HB      LYS   4  -7.018   8.582  -5.851
   31    HG2  LYS   4           2HG      LYS   4  -9.194   9.802  -5.964
   32    HG3  LYS   4           3HG      LYS   4  -8.808  10.539  -4.407
   33    HD2  LYS   4           2HD      LYS   4  -7.175  10.797  -6.941
   34    HD3  LYS   4           3HD      LYS   4  -8.255  12.026  -6.281
   35    HE2  LYS   4           2HE      LYS   4  -6.862  12.196  -4.282
   36    HE3  LYS   4           3HE      LYS   4  -5.800  10.929  -4.902
   37    HZ1  LYS   4           3HZ      LYS   4  -6.259  13.585  -6.144
   38    HZ2  LYS   4           1HZ      LYS   4  -5.283  12.366  -6.791
   39    HZ3  LYS   4           2HZ      LYS   4  -4.863  13.100  -5.327
   40    H    PHE   5           H        PHE   5  -6.850   7.397  -2.343
   41    HA   PHE   5           HA       PHE   5  -5.727   4.834  -3.229
   42    HB2  PHE   5           2HB      PHE   5  -5.071   6.529  -0.799
   43    HB3  PHE   5           3HB      PHE   5  -4.236   5.052  -1.263
   44    HD1  PHE   5           HD2      PHE   5  -4.796   8.587  -2.104
   45    HD2  PHE   5           HD1      PHE   5  -2.637   5.039  -3.059
   46    HE1  PHE   5           HE2      PHE   5  -3.242   9.905  -3.481
   47    HE2  PHE   5           HE1      PHE   5  -1.080   6.355  -4.432
   48    HZ   PHE   5           HZ       PHE   5  -1.380   8.790  -4.646
   49    H    THR   6           H        THR   6  -7.073   3.165  -2.835
   50    HA   THR   6           HA       THR   6  -8.352   2.974  -0.176
   51    HB   THR   6           HB       THR   6 -10.147   3.563  -1.631
   52    HG1  THR   6           HG1      THR   6 -11.442   1.909  -1.115
   53   HG21  THR   6          3HG2      THR   6 -10.675   2.330  -3.684
   54   HG22  THR   6          1HG2      THR   6  -9.231   1.340  -3.467
   55   HG23  THR   6          2HG2      THR   6  -9.077   3.070  -3.779
   56    H    LYS   7           H        LYS   7  -9.115   0.729   0.334
   57    HA   LYS   7           HA       LYS   7  -6.951  -1.072   0.239
   58    HB2  LYS   7           2HB      LYS   7  -8.473  -2.675   1.303
   59    HB3  LYS   7           3HB      LYS   7  -8.600  -1.086   2.044
   60    HG2  LYS   7           2HG      LYS   7 -10.666  -0.653   0.834
   61    HG3  LYS   7           3HG      LYS   7 -10.524  -2.200  -0.001
   62    HD2  LYS   7           2HD      LYS   7 -12.113  -2.406   1.818
   63    HD3  LYS   7           3HD      LYS   7 -10.676  -3.364   2.178
   64    HE2  LYS   7           2HE      LYS   7  -9.854  -1.525   3.616
   65    HE3  LYS   7           3HE      LYS   7 -11.336  -0.631   3.284
   66    HZ1  LYS   7           3HZ      LYS   7 -11.456  -1.800   5.392
   67    HZ2  LYS   7           1HZ      LYS   7 -11.182  -3.279   4.619
   68    HZ3  LYS   7           2HZ      LYS   7 -12.600  -2.410   4.311
   69    H    ASP   8           H        ASP   8  -9.579  -0.580  -1.944
   70    HA   ASP   8           HA       ASP   8  -9.760  -3.135  -3.121
   71    HB2  ASP   8           2HB      ASP   8 -11.537  -1.572  -3.442
   72    HB3  ASP   8           3HB      ASP   8 -10.448  -0.371  -4.126
   73    H    MET   9           H        MET   9  -7.753  -0.321  -3.993
   74    HA   MET   9           HA       MET   9  -6.871  -1.443  -6.469
   75    HB2  MET   9           2HB      MET   9  -5.344   0.460  -6.575
   76    HB3  MET   9           3HB      MET   9  -6.961   0.974  -6.121
   77    HG2  MET   9           2HG      MET   9  -6.156   0.924  -3.723
   78    HG3  MET   9           3HG      MET   9  -4.528   0.753  -4.376
   79    HE1  MET   9           3HE      MET   9  -4.225   4.094  -6.474
   80    HE2  MET   9           1HE      MET   9  -4.917   2.590  -7.081
   81    HE3  MET   9           2HE      MET   9  -3.464   2.553  -6.083
   82    H    THR  10           H        THR  10  -4.777  -2.159  -7.055
   83    HA   THR  10           HA       THR  10  -3.544  -3.848  -5.072
   84    HB   THR  10           HB       THR  10  -2.054  -4.607  -6.868
   85    HG1  THR  10           HG1      THR  10  -2.793  -3.596  -9.053
   86   HG21  THR  10          3HG2      THR  10  -3.770  -5.489  -8.424
   87   HG22  THR  10          1HG2      THR  10  -4.949  -4.379  -7.726
   88   HG23  THR  10          2HG2      THR  10  -4.244  -5.656  -6.734
   89    H    PHE  11           H        PHE  11  -1.252  -3.901  -4.583
   90    HA   PHE  11           HA       PHE  11  -0.143  -1.511  -3.715
   91    HB2  PHE  11           2HB      PHE  11   1.207  -4.125  -4.416
   92    HB3  PHE  11           3HB      PHE  11   2.054  -2.782  -3.655
   93    HD1  PHE  11           HD2      PHE  11   1.501  -2.107  -1.351
   94    HD2  PHE  11           HD1      PHE  11  -0.303  -5.511  -3.168
   95    HE1  PHE  11           HE2      PHE  11   0.784  -2.907   0.862
   96    HE2  PHE  11           HE1      PHE  11  -1.024  -6.311  -0.959
   97    HZ   PHE  11           HZ       PHE  11  -0.480  -5.012   1.059
   98    H    ALA  12           H        ALA  12   0.542  -3.249  -6.751
   99    HA   ALA  12           HA       ALA  12   2.583  -1.598  -7.714
  100    HB1  ALA  12           3HB      ALA  12   2.011  -3.795  -8.658
  101    HB2  ALA  12           1HB      ALA  12   2.108  -2.542  -9.898
  102    HB3  ALA  12           2HB      ALA  12   0.534  -3.107  -9.335
  103    H    GLN  13           H        GLN  13  -0.932  -1.388  -8.317
  104    HA   GLN  13           HA       GLN  13  -0.847   0.876  -9.989
  105    HB2  GLN  13           2HB      GLN  13  -3.052  -0.149  -8.191
  106    HB3  GLN  13           3HB      GLN  13  -3.262   1.158  -9.352
  107    HG2  GLN  13           2HG      GLN  13  -2.717  -0.343 -11.183
  108    HG3  GLN  13           3HG      GLN  13  -2.416  -1.652 -10.043
  109   HE21  GLN  13          1HE2      GLN  13  -5.051   0.616  -9.653
  110   HE22  GLN  13          2HE2      GLN  13  -6.307  -0.518  -9.977
  111    H    ALA  14           H        ALA  14  -1.165   0.625  -6.453
  112    HA   ALA  14           HA       ALA  14  -1.497   3.345  -5.868
  113    HB1  ALA  14           3HB      ALA  14  -1.757   1.571  -4.199
  114    HB2  ALA  14           1HB      ALA  14  -0.630   2.811  -3.644
  115    HB3  ALA  14           2HB      ALA  14  -0.021   1.268  -4.246
  116    H    LEU  15           H        LEU  15   1.504   1.455  -6.207
  117    HA   LEU  15           HA       LEU  15   3.352   3.505  -5.733
  118    HB2  LEU  15           2HB      LEU  15   3.636   1.136  -7.591
  119    HB3  LEU  15           3HB      LEU  15   4.959   2.104  -6.967
  120    HG   LEU  15           HG       LEU  15   3.118   0.358  -5.317
  121   HD11  LEU  15          1HD1      LEU  15   4.652  -0.953  -6.673
  122   HD12  LEU  15          2HD1      LEU  15   5.108  -1.029  -4.971
  123   HD13  LEU  15          3HD1      LEU  15   6.016  -0.003  -6.082
  124   HD21  LEU  15          3HD2      LEU  15   4.638   0.859  -3.460
  125   HD22  LEU  15          1HD2      LEU  15   3.839   2.313  -4.060
  126   HD23  LEU  15          2HD2      LEU  15   5.519   1.990  -4.490
  127    H    GLN  16           H        GLN  16   1.766   2.509  -8.753
  128    HA   GLN  16           HA       GLN  16   3.194   4.315 -10.431
  129    HB2  GLN  16           2HB      GLN  16   0.526   2.950 -10.857
  130    HB3  GLN  16           3HB      GLN  16   1.416   3.820 -12.099
  131    HG2  GLN  16           2HG      GLN  16   2.307   1.321 -10.667
  132    HG3  GLN  16           3HG      GLN  16   1.768   1.445 -12.341
  133   HE21  GLN  16          1HE2      GLN  16   4.350   2.082 -10.112
  134   HE22  GLN  16          2HE2      GLN  16   5.556   2.438 -11.295
  135    H    THR  17           H        THR  17   0.344   4.653  -8.445
  136    HA   THR  17           HA       THR  17  -0.604   7.088  -9.617
  137    HB   THR  17           HB       THR  17  -1.121   6.048  -6.813
  138    HG1  THR  17           HG1      THR  17  -1.748   4.629  -8.626
  139   HG21  THR  17          3HG2      THR  17  -1.711   8.407  -7.066
  140   HG22  THR  17          1HG2      THR  17  -3.169   7.421  -6.951
  141   HG23  THR  17          2HG2      THR  17  -2.641   8.034  -8.519
  142    H    HIS  18           H        HIS  18   1.460   6.317  -6.833
  143    HA   HIS  18           HA       HIS  18   2.689   8.960  -6.977
  144    HB2  HIS  18           2HB      HIS  18   0.947   8.068  -4.738
  145    HB3  HIS  18           3HB      HIS  18   2.455   8.847  -4.278
  146    HD1  HIS  18           HD1      HIS  18  -0.515   9.617  -6.565
  147    HD2  HIS  18           HD2      HIS  18   2.259  11.528  -4.137
  148    HE1  HIS  18           HE1      HIS  18  -1.198  12.028  -6.534
  149    HE2  HIS  18           HE2      HIS  18   0.633  13.190  -5.262
  150    HA   PRO  19           HA       PRO  19   6.218   6.097  -6.415
  151    HB2  PRO  19           2HB      PRO  19   7.473   8.810  -6.165
  152    HB3  PRO  19           3HB      PRO  19   8.028   7.394  -7.069
  153    HG2  PRO  19           2HG      PRO  19   6.873   9.413  -8.347
  154    HG3  PRO  19           3HG      PRO  19   6.498   7.739  -8.800
  155    HD2  PRO  19           2HD      PRO  19   4.860   9.696  -7.241
  156    HD3  PRO  19           3HD      PRO  19   4.339   8.450  -8.395
  157    H    GLY  20           H        GLY  20   5.346   8.874  -4.394
  158    HA2  GLY  20           2HA      GLY  20   6.986   8.364  -2.169
  159    HA3  GLY  20           3HA      GLY  20   5.455   9.222  -2.123
  160    H    VAL  21           H        VAL  21   4.008   6.828  -3.173
  161    HA   VAL  21           HA       VAL  21   3.154   5.641  -0.800
  162    HB   VAL  21           HB       VAL  21   3.014   4.572  -3.631
  163   HG11  VAL  21          1HG1      VAL  21   2.753   2.727  -2.050
  164   HG12  VAL  21          2HG1      VAL  21   1.225   3.094  -2.851
  165   HG13  VAL  21          3HG1      VAL  21   1.502   3.628  -1.193
  166   HG21  VAL  21          3HG2      VAL  21   0.707   5.406  -3.567
  167   HG22  VAL  21          1HG2      VAL  21   1.873   6.704  -3.305
  168   HG23  VAL  21          2HG2      VAL  21   0.979   6.033  -1.941
  169    H    ALA  22           H        ALA  22   5.718   4.653  -3.022
  170    HA   ALA  22           HA       ALA  22   6.286   2.104  -2.065
  171    HB1  ALA  22           3HB      ALA  22   8.236   4.171  -3.085
  172    HB2  ALA  22           1HB      ALA  22   7.325   3.025  -4.067
  173    HB3  ALA  22           2HB      ALA  22   8.555   2.442  -2.945
  174    H    GLY  23           H        GLY  23   7.617   5.221  -0.931
  175    HA2  GLY  23           2HA      GLY  23   9.233   4.189   1.134
  176    HA3  GLY  23           3HA      GLY  23   8.605   5.826   1.056
  177    H    VAL  24           H        VAL  24   5.875   5.360   1.225
  178    HA   VAL  24           HA       VAL  24   5.429   5.076   3.979
  179    HB   VAL  24           HB       VAL  24   3.406   4.676   1.757
  180   HG11  VAL  24          1HG1      VAL  24   2.589   3.872   3.918
  181   HG12  VAL  24          2HG1      VAL  24   1.739   5.340   3.436
  182   HG13  VAL  24          3HG1      VAL  24   3.004   5.417   4.663
  183   HG21  VAL  24          3HG2      VAL  24   4.549   6.820   1.528
  184   HG22  VAL  24          1HG2      VAL  24   4.208   7.202   3.217
  185   HG23  VAL  24          2HG2      VAL  24   2.885   7.063   2.058
  186    H    LEU  25           H        LEU  25   4.699   2.759   1.352
  187    HA   LEU  25           HA       LEU  25   3.744   0.673   2.945
  188    HB2  LEU  25           2HB      LEU  25   5.223   0.490   0.315
  189    HB3  LEU  25           3HB      LEU  25   4.290  -0.805   1.041
  190    HG   LEU  25           HG       LEU  25   3.186   1.834   0.059
  191   HD11  LEU  25          1HD1      LEU  25   2.097   0.495  -1.664
  192   HD12  LEU  25          2HD1      LEU  25   2.894  -0.956  -1.052
  193   HD13  LEU  25          3HD1      LEU  25   3.852   0.348  -1.755
  194   HD21  LEU  25          3HD2      LEU  25   0.982   0.867   0.521
  195   HD22  LEU  25          1HD2      LEU  25   1.939   1.026   1.993
  196   HD23  LEU  25          2HD2      LEU  25   1.751  -0.553   1.230
  197    H    ARG  26           H        ARG  26   7.081   1.198   1.737
  198    HA   ARG  26           HA       ARG  26   8.216  -1.078   2.947
  199    HB2  ARG  26           2HB      ARG  26   9.524   1.563   2.249
  200    HB3  ARG  26           3HB      ARG  26  10.396   0.095   2.678
  201    HG2  ARG  26           2HG      ARG  26   9.350  -1.035   0.726
  202    HG3  ARG  26           3HG      ARG  26   8.626   0.508   0.270
  203    HD2  ARG  26           2HD      ARG  26  10.632   0.152  -1.020
  204    HD3  ARG  26           3HD      ARG  26  10.902   1.482   0.107
  205    HE   ARG  26           HE       ARG  26  11.941  -0.426   1.533
  206   HH11  ARG  26          1HH1      ARG  26  12.196  -0.046  -1.882
  207   HH12  ARG  26          2HH1      ARG  26  13.693  -0.904  -1.972
  208   HH21  ARG  26          1HH2      ARG  26  13.867  -1.503   1.407
  209   HH22  ARG  26          2HH2      ARG  26  14.634  -1.716  -0.129
  210    H    SER  27           H        SER  27   7.739   2.203   4.180
  211    HA   SER  27           HA       SER  27   9.060   1.899   6.657
  212    HB2  SER  27           2HB      SER  27   8.312   4.093   5.796
  213    HB3  SER  27           3HB      SER  27   6.632   3.613   6.024
  214    HG   SER  27           HG       SER  27   6.838   3.821   8.161
  215    H    TYR  28           H        TYR  28   5.777   1.088   5.636
  216    HA   TYR  28           HA       TYR  28   5.038   0.156   8.297
  217    HB2  TYR  28           2HB      TYR  28   3.578   0.507   5.697
  218    HB3  TYR  28           3HB      TYR  28   2.877  -0.491   6.968
  219    HD1  TYR  28           HD1      TYR  28   4.211   2.935   6.315
  220    HD2  TYR  28           HD2      TYR  28   1.671   0.505   8.717
  221    HE1  TYR  28           HE1      TYR  28   3.337   4.949   7.421
  222    HE2  TYR  28           HE2      TYR  28   0.788   2.513   9.824
  223    HH   TYR  28           HH       TYR  28   1.495   4.816  10.275
  224    H    ASN  29           H        ASN  29   7.180  -1.248   6.775
  225    HA   ASN  29           HA       ASN  29   7.961  -3.385   6.732
  226    HB2  ASN  29           2HB      ASN  29   6.796  -3.522   8.934
  227    HB3  ASN  29           3HB      ASN  29   5.359  -4.114   8.110
  228   HD21  ASN  29          1HD2      ASN  29   8.644  -4.860   9.021
  229   HD22  ASN  29          2HD2      ASN  29   8.520  -6.565   8.783
  230    H    LEU  30           H        LEU  30   5.880  -2.311   4.667
  231    HA   LEU  30           HA       LEU  30   5.053  -4.883   3.496
  232    HB2  LEU  30           2HB      LEU  30   4.305  -2.053   2.735
  233    HB3  LEU  30           3HB      LEU  30   3.677  -3.503   1.974
  234    HG   LEU  30           HG       LEU  30   3.255  -2.757   4.877
  235   HD11  LEU  30          1HD1      LEU  30   0.953  -2.276   4.232
  236   HD12  LEU  30          2HD1      LEU  30   1.345  -2.596   2.544
  237   HD13  LEU  30          3HD1      LEU  30   2.084  -1.227   3.376
  238   HD21  LEU  30          3HD2      LEU  30   1.622  -4.579   4.879
  239   HD22  LEU  30          1HD2      LEU  30   3.240  -5.172   4.507
  240   HD23  LEU  30          2HD2      LEU  30   2.053  -4.979   3.216
  241    H    GLY  31           H        GLY  31   7.855  -3.573   3.439
  242    HA2  GLY  31           2HA      GLY  31   8.435  -2.768   0.800
  243    HA3  GLY  31           3HA      GLY  31   9.604  -3.372   1.962
  244    H    CYS  32           H        CYS  32   8.135  -5.983   2.167
  245    HA   CYS  32           HA       CYS  32   9.617  -7.354   0.154
  246    HB2  CYS  32           2HB      CYS  32   9.297  -8.384   2.315
  247    HB3  CYS  32           3HB      CYS  32   7.549  -8.369   2.109
  248    HG   CYS  32           HG       CYS  32   9.778 -10.608   1.112
  249    H    ILE  33           H        ILE  33   6.584  -5.880  -0.047
  250    HA   ILE  33           HA       ILE  33   4.972  -7.645  -1.435
  251    HB   ILE  33           HB       ILE  33   3.909  -5.687  -2.528
  252   HG12  ILE  33          2HG1      ILE  33   6.104  -4.106  -1.148
  253   HG13  ILE  33          3HG1      ILE  33   5.951  -4.340  -2.885
  254   HG21  ILE  33          1HG2      ILE  33   4.471  -5.380   0.423
  255   HG22  ILE  33          2HG2      ILE  33   3.210  -6.373  -0.309
  256   HG23  ILE  33          3HG2      ILE  33   3.143  -4.618  -0.452
  257   HD11  ILE  33          3HD1      ILE  33   5.175  -2.144  -2.207
  258   HD12  ILE  33          1HD1      ILE  33   3.990  -2.880  -1.128
  259   HD13  ILE  33          2HD1      ILE  33   3.855  -3.102  -2.873
  260    H    GLY  34           H        GLY  34   7.731  -5.855  -2.675
  261    HA2  GLY  34           2HA      GLY  34   7.228  -6.308  -5.445
  262    HA3  GLY  34           3HA      GLY  34   8.764  -5.843  -4.733
  263    H    CYS  35           H        CYS  35   8.872  -8.179  -2.961
  264    HA   CYS  35           HA       CYS  35  10.004 -10.040  -4.893
  265    HB2  CYS  35           2HB      CYS  35  11.290  -9.412  -2.887
  266    HB3  CYS  35           3HB      CYS  35  10.040 -10.111  -1.865
  267    HG   CYS  35           HG       CYS  35  10.977 -12.496  -1.854
  268    H    MET  36           H        MET  36   7.583 -10.160  -2.274
  269    HA   MET  36           HA       MET  36   6.961 -12.927  -2.728
  270    HB2  MET  36           2HB      MET  36   5.238 -12.622  -1.018
  271    HB3  MET  36           3HB      MET  36   6.768 -11.928  -0.503
  272    HG2  MET  36           2HG      MET  36   5.945  -9.694  -1.096
  273    HG3  MET  36           3HG      MET  36   4.406 -10.400  -1.584
  274    HE1  MET  36           3HE      MET  36   2.752 -11.628   0.093
  275    HE2  MET  36           1HE      MET  36   3.028 -11.762   1.831
  276    HE3  MET  36           2HE      MET  36   4.039 -12.667   0.706
  277    H    GLY  37           H        GLY  37   6.361 -10.652  -4.842
  278    HA2  GLY  37           2HA      GLY  37   4.961 -10.627  -6.671
  279    HA3  GLY  37           3HA      GLY  37   4.202 -12.079  -6.047
  280    H    ALA  38           H        ALA  38   4.108  -9.660  -3.704
  281    HA   ALA  38           HA       ALA  38   1.277  -9.476  -3.820
  282    HB1  ALA  38           3HB      ALA  38   2.495  -9.337  -1.714
  283    HB2  ALA  38           1HB      ALA  38   1.483  -7.912  -1.952
  284    HB3  ALA  38           2HB      ALA  38   3.223  -7.814  -2.223
  285    H    GLN  39           H        GLN  39   3.569  -7.869  -5.673
  286    HA   GLN  39           HA       GLN  39   2.580  -5.302  -6.045
  287    HB2  GLN  39           2HB      GLN  39   3.662  -7.247  -8.099
  288    HB3  GLN  39           3HB      GLN  39   3.386  -5.539  -8.418
  289    HG2  GLN  39           2HG      GLN  39   5.281  -6.647  -6.348
  290    HG3  GLN  39           3HG      GLN  39   5.739  -6.048  -7.942
  291   HE21  GLN  39          1HE2      GLN  39   4.657  -5.181  -4.765
  292   HE22  GLN  39          2HE2      GLN  39   4.949  -3.489  -4.908
  293    H    ASN  40           H        ASN  40   1.321  -8.368  -7.230
  294    HA   ASN  40           HA       ASN  40  -0.775  -7.054  -8.798
  295    HB2  ASN  40           2HB      ASN  40  -0.271 -10.022  -8.441
  296    HB3  ASN  40           3HB      ASN  40  -1.267  -9.255  -9.675
  297   HD21  ASN  40          1HD2      ASN  40   1.917 -10.125  -8.719
  298   HD22  ASN  40          2HD2      ASN  40   2.715  -9.623 -10.169
  299    H    GLU  41           H        GLU  41  -0.583  -7.313  -5.688
  300    HA   GLU  41           HA       GLU  41  -3.236  -8.541  -5.247
  301    HB2  GLU  41           2HB      GLU  41  -1.343  -9.728  -4.176
  302    HB3  GLU  41           3HB      GLU  41  -0.942  -8.263  -3.290
  303    HG2  GLU  41           2HG      GLU  41  -2.986  -8.372  -2.051
  304    HG3  GLU  41           3HG      GLU  41  -3.579  -9.698  -3.050
  305    H    SER  42           H        SER  42  -4.669  -7.523  -3.755
  306    HA   SER  42           HA       SER  42  -4.649  -4.666  -3.914
  307    HB2  SER  42           2HB      SER  42  -6.515  -6.558  -2.464
  308    HB3  SER  42           3HB      SER  42  -6.772  -4.819  -2.597
  309    HG   SER  42           HG       SER  42  -7.340  -5.037  -4.628
  310    H    LEU  43           H        LEU  43  -4.763  -3.160  -2.166
  311    HA   LEU  43           HA       LEU  43  -2.583  -3.296  -0.482
  312    HB2  LEU  43           2HB      LEU  43  -5.060  -1.595  -0.209
  313    HB3  LEU  43           3HB      LEU  43  -3.587  -1.341   0.710
  314    HG   LEU  43           HG       LEU  43  -3.869  -1.115  -2.297
  315   HD11  LEU  43          1HD1      LEU  43  -3.421   0.993  -0.180
  316   HD12  LEU  43          2HD1      LEU  43  -4.900   0.741  -1.108
  317   HD13  LEU  43          3HD1      LEU  43  -3.427   1.265  -1.924
  318   HD21  LEU  43          3HD2      LEU  43  -1.456  -0.688  -0.527
  319   HD22  LEU  43          1HD2      LEU  43  -1.549  -0.283  -2.243
  320   HD23  LEU  43          2HD2      LEU  43  -1.669  -1.964  -1.727
  321    H    GLU  44           H        GLU  44  -5.989  -3.929   0.458
  322    HA   GLU  44           HA       GLU  44  -5.362  -4.198   3.220
  323    HB2  GLU  44           2HB      GLU  44  -7.611  -3.606   2.535
  324    HB3  GLU  44           3HB      GLU  44  -7.797  -5.140   1.694
  325    HG2  GLU  44           2HG      GLU  44  -7.781  -6.358   3.748
  326    HG3  GLU  44           3HG      GLU  44  -7.310  -4.925   4.659
  327    H    GLN  45           H        GLN  45  -5.769  -6.602   0.626
  328    HA   GLN  45           HA       GLN  45  -5.597  -8.931   2.148
  329    HB2  GLN  45           2HB      GLN  45  -4.404  -8.466  -0.599
  330    HB3  GLN  45           3HB      GLN  45  -4.764 -10.033   0.116
  331    HG2  GLN  45           2HG      GLN  45  -7.158  -9.447   0.151
  332    HG3  GLN  45           3HG      GLN  45  -6.777  -7.906  -0.614
  333   HE21  GLN  45          1HE2      GLN  45  -8.006  -8.340  -2.431
  334   HE22  GLN  45          2HE2      GLN  45  -7.542  -9.514  -3.610
  335    H    GLY  46           H        GLY  46  -2.918  -7.107   0.627
  336    HA2  GLY  46           2HA      GLY  46  -0.794  -8.573   1.755
  337    HA3  GLY  46           3HA      GLY  46  -0.698  -6.909   1.199
  338    H    ALA  47           H        ALA  47  -2.627  -5.821   3.041
  339    HA   ALA  47           HA       ALA  47  -1.052  -5.290   5.300
  340    HB1  ALA  47           3HB      ALA  47  -2.845  -3.801   4.554
  341    HB2  ALA  47           1HB      ALA  47  -3.047  -4.237   6.251
  342    HB3  ALA  47           2HB      ALA  47  -4.049  -5.003   5.018
  343    H    ASN  48           H        ASN  48  -3.894  -7.449   4.993
  344    HA   ASN  48           HA       ASN  48  -3.845  -8.508   7.586
  345    HB2  ASN  48           2HB      ASN  48  -4.799  -9.683   4.975
  346    HB3  ASN  48           3HB      ASN  48  -4.949 -10.552   6.496
  347   HD21  ASN  48          1HD2      ASN  48  -6.105  -7.912   4.590
  348   HD22  ASN  48          2HD2      ASN  48  -7.449  -7.512   5.595
  349    H    ALA  49           H        ALA  49  -2.028  -9.476   4.706
  350    HA   ALA  49           HA       ALA  49  -0.841 -11.812   5.717
  351    HB1  ALA  49           3HB      ALA  49   0.863 -11.500   3.994
  352    HB2  ALA  49           1HB      ALA  49   0.334  -9.832   3.759
  353    HB3  ALA  49           2HB      ALA  49  -0.746 -11.166   3.356
  354    H    HIS  50           H        HIS  50  -0.053  -8.432   6.250
  355    HA   HIS  50           HA       HIS  50   2.295  -9.209   7.859
  356    HB2  HIS  50           2HB      HIS  50   1.537  -6.559   6.609
  357    HB3  HIS  50           3HB      HIS  50   2.890  -6.756   7.719
  358    HD1  HIS  50           HD1      HIS  50   5.022  -6.904   6.482
  359    HD2  HIS  50           HD2      HIS  50   1.906  -8.671   4.378
  360    HE1  HIS  50           HE1      HIS  50   6.053  -7.797   4.380
  361    HE2  HIS  50           HE2      HIS  50   4.205  -9.089   3.276
  362    H    GLY  51           H        GLY  51  -0.828  -8.886   8.450
  363    HA2  GLY  51           2HA      GLY  51  -2.058  -8.541  10.360
  364    HA3  GLY  51           3HA      GLY  51  -0.536  -8.524  11.230
  365    H    LEU  52           H        LEU  52  -1.678  -6.262   8.747
  366    HA   LEU  52           HA       LEU  52  -1.449  -4.089  10.739
  367    HB2  LEU  52           2HB      LEU  52  -0.988  -3.967   7.753
  368    HB3  LEU  52           3HB      LEU  52  -0.840  -2.617   8.864
  369    HG   LEU  52           HG       LEU  52   0.905  -5.090   8.881
  370   HD11  LEU  52          1HD1      LEU  52   2.664  -3.592   8.074
  371   HD12  LEU  52          2HD1      LEU  52   1.494  -2.278   7.959
  372   HD13  LEU  52          3HD1      LEU  52   1.326  -3.701   6.930
  373   HD21  LEU  52          3HD2      LEU  52   1.099  -2.543  10.495
  374   HD22  LEU  52          1HD2      LEU  52   2.264  -3.868  10.505
  375   HD23  LEU  52          2HD2      LEU  52   0.629  -4.127  11.114
  376    H    ASN  53           H        ASN  53  -2.792  -2.184  10.339
  377    HA   ASN  53           HA       ASN  53  -5.449  -2.858   9.312
  378    HB2  ASN  53           2HB      ASN  53  -5.481  -1.839  11.487
  379    HB3  ASN  53           3HB      ASN  53  -4.421  -0.535  10.960
  380   HD21  ASN  53          1HD2      ASN  53  -5.955   0.973  11.688
  381   HD22  ASN  53          2HD2      ASN  53  -7.393   1.302  10.787
  382    H    VAL  54           H        VAL  54  -5.855  -2.449   7.233
  383    HA   VAL  54           HA       VAL  54  -4.176  -1.011   5.531
  384    HB   VAL  54           HB       VAL  54  -5.817  -2.712   4.766
  385   HG11  VAL  54          1HG1      VAL  54  -7.736  -2.006   6.112
  386   HG12  VAL  54          2HG1      VAL  54  -8.150  -2.094   4.400
  387   HG13  VAL  54          3HG1      VAL  54  -7.868  -0.526   5.160
  388   HG21  VAL  54          3HG2      VAL  54  -6.086  -0.034   3.385
  389   HG22  VAL  54          1HG2      VAL  54  -6.403  -1.614   2.666
  390   HG23  VAL  54          2HG2      VAL  54  -4.766  -1.183   3.161
  391    H    GLU  55           H        GLU  55  -6.946   0.100   7.412
  392    HA   GLU  55           HA       GLU  55  -7.372   2.532   6.023
  393    HB2  GLU  55           2HB      GLU  55  -8.074   1.751   8.859
  394    HB3  GLU  55           3HB      GLU  55  -8.647   3.210   8.056
  395    HG2  GLU  55           2HG      GLU  55  -9.783   1.867   6.376
  396    HG3  GLU  55           3HG      GLU  55  -9.172   0.391   7.122
  397    H    ASP  56           H        ASP  56  -5.201   1.684   8.670
  398    HA   ASP  56           HA       ASP  56  -4.435   4.373   9.290
  399    HB2  ASP  56           2HB      ASP  56  -4.109   2.351  10.795
  400    HB3  ASP  56           3HB      ASP  56  -2.789   1.862   9.735
  401    H    ILE  57           H        ILE  57  -3.269   1.900   7.065
  402    HA   ILE  57           HA       ILE  57  -1.006   3.333   6.100
  403    HB   ILE  57           HB       ILE  57  -2.622   1.217   4.652
  404   HG12  ILE  57          2HG1      ILE  57  -0.188   0.873   6.435
  405   HG13  ILE  57          3HG1      ILE  57  -1.840   0.476   6.899
  406   HG21  ILE  57          1HG2      ILE  57  -1.117   2.440   3.175
  407   HG22  ILE  57          2HG2      ILE  57  -0.536   0.794   3.419
  408   HG23  ILE  57          3HG2      ILE  57   0.233   2.134   4.268
  409   HD11  ILE  57          3HD1      ILE  57  -1.931  -1.216   5.148
  410   HD12  ILE  57          1HD1      ILE  57  -0.590  -1.506   6.258
  411   HD13  ILE  57          2HD1      ILE  57  -0.283  -0.812   4.667
  412    H    LEU  58           H        LEU  58  -4.306   2.909   4.785
  413    HA   LEU  58           HA       LEU  58  -4.125   4.505   2.521
  414    HB2  LEU  58           2HB      LEU  58  -6.513   4.135   4.342
  415    HB3  LEU  58           3HB      LEU  58  -6.579   4.801   2.720
  416    HG   LEU  58           HG       LEU  58  -5.804   1.973   3.455
  417   HD11  LEU  58          1HD1      LEU  58  -7.857   1.366   2.255
  418   HD12  LEU  58          2HD1      LEU  58  -8.234   3.076   2.045
  419   HD13  LEU  58          3HD1      LEU  58  -8.190   2.374   3.663
  420   HD21  LEU  58          3HD2      LEU  58  -5.753   1.573   1.029
  421   HD22  LEU  58          1HD2      LEU  58  -4.512   2.717   1.540
  422   HD23  LEU  58          2HD2      LEU  58  -5.976   3.299   0.749
  423    H    ARG  59           H        ARG  59  -4.649   5.417   5.869
  424    HA   ARG  59           HA       ARG  59  -5.332   8.082   5.708
  425    HB2  ARG  59           2HB      ARG  59  -5.079   6.841   7.822
  426    HB3  ARG  59           3HB      ARG  59  -3.340   6.772   7.584
  427    HG2  ARG  59           2HG      ARG  59  -3.661   9.433   7.514
  428    HG3  ARG  59           3HG      ARG  59  -5.047   9.009   8.521
  429    HD2  ARG  59           2HD      ARG  59  -3.216   9.424   9.991
  430    HD3  ARG  59           3HD      ARG  59  -3.462   7.675   9.960
  431    HE   ARG  59           HE       ARG  59  -1.347   9.061   8.435
  432   HH11  ARG  59          1HH1      ARG  59  -2.432   6.389  10.313
  433   HH12  ARG  59          2HH1      ARG  59  -0.951   5.521  10.138
  434   HH21  ARG  59          1HH2      ARG  59   0.568   7.952   8.239
  435   HH22  ARG  59          2HH2      ARG  59   0.732   6.403   8.990
  436    H    ASP  60           H        ASP  60  -2.034   6.719   5.705
  437    HA   ASP  60           HA       ASP  60  -0.786   9.256   5.294
  438    HB2  ASP  60           2HB      ASP  60   0.103   6.938   6.315
  439    HB3  ASP  60           3HB      ASP  60   0.700   6.745   4.670
  440    H    LEU  61           H        LEU  61  -1.625   6.536   3.188
  441    HA   LEU  61           HA       LEU  61  -0.291   7.315   0.862
  442    HB2  LEU  61           2HB      LEU  61  -2.944   5.882   1.090
  443    HB3  LEU  61           3HB      LEU  61  -1.945   5.940  -0.350
  444    HG   LEU  61           HG       LEU  61  -1.258   4.587   2.264
  445   HD11  LEU  61          1HD1      LEU  61  -2.880   3.370   0.904
  446   HD12  LEU  61          2HD1      LEU  61  -1.329   2.534   0.952
  447   HD13  LEU  61          3HD1      LEU  61  -1.791   3.453  -0.483
  448   HD21  LEU  61          3HD2      LEU  61   0.740   5.578   1.296
  449   HD22  LEU  61          1HD2      LEU  61   0.384   4.821  -0.257
  450   HD23  LEU  61          2HD2      LEU  61   0.779   3.822   1.144
  451    H    ASN  62           H        ASN  62  -3.692   8.060   1.772
  452    HA   ASN  62           HA       ASN  62  -4.059   9.868  -0.413
  453    HB2  ASN  62           2HB      ASN  62  -5.611   9.526   2.167
  454    HB3  ASN  62           3HB      ASN  62  -6.093  10.627   0.877
  455   HD21  ASN  62          1HD2      ASN  62  -5.850   7.329   1.877
  456   HD22  ASN  62          2HD2      ASN  62  -6.738   6.648   0.563
  457    H    ALA  63           H        ALA  63  -2.801  10.199   2.836
  458    HA   ALA  63           HA       ALA  63  -2.816  13.024   2.997
  459    HB1  ALA  63           3HB      ALA  63  -2.467  11.586   4.951
  460    HB2  ALA  63           1HB      ALA  63  -1.172  12.771   4.774
  461    HB3  ALA  63           2HB      ALA  63  -0.902  11.092   4.305
  462    H    LEU  64           H        LEU  64  -0.846  10.871   1.135
  463    HA   LEU  64           HA       LEU  64   1.331  12.645   0.643
  464    HB2  LEU  64           2HB      LEU  64   0.181  10.472  -1.121
  465    HB3  LEU  64           3HB      LEU  64   1.728  11.260  -1.370
  466    HG   LEU  64           HG       LEU  64   1.006   9.541   1.013
  467   HD11  LEU  64          1HD1      LEU  64   2.552   7.913   0.061
  468   HD12  LEU  64          2HD1      LEU  64   2.796   8.949  -1.345
  469   HD13  LEU  64          3HD1      LEU  64   1.211   8.236  -1.037
  470   HD21  LEU  64          3HD2      LEU  64   3.638  10.813   0.246
  471   HD22  LEU  64          1HD2      LEU  64   3.387   9.687   1.579
  472   HD23  LEU  64          2HD2      LEU  64   2.616  11.272   1.608
  473    H    ALA  65           H        ALA  65  -1.908  12.396  -0.620
  474    HA   ALA  65           HA       ALA  65  -1.396  14.264  -2.811
  475    HB1  ALA  65           3HB      ALA  65  -3.958  12.876  -2.013
  476    HB2  ALA  65           1HB      ALA  65  -2.806  12.295  -3.216
  477    HB3  ALA  65           2HB      ALA  65  -3.685  13.799  -3.491
  478    H    LEU  66           H        LEU  66  -3.041  14.166   0.303
  479    HA   LEU  66           HA       LEU  66  -4.086  16.882  -0.010
  480    HB2  LEU  66           2HB      LEU  66  -4.260  15.000   2.348
  481    HB3  LEU  66           3HB      LEU  66  -5.142  16.504   2.162
  482    HG   LEU  66           HG       LEU  66  -5.492  14.049   0.431
  483   HD11  LEU  66          1HD1      LEU  66  -7.241  15.179   2.616
  484   HD12  LEU  66          2HD1      LEU  66  -6.285  13.700   2.707
  485   HD13  LEU  66          3HD1      LEU  66  -7.637  13.806   1.579
  486   HD21  LEU  66          3HD2      LEU  66  -7.021  16.658   0.492
  487   HD22  LEU  66          1HD2      LEU  66  -7.461  15.232  -0.450
  488   HD23  LEU  66          2HD2      LEU  66  -5.964  16.093  -0.803
  489    H    GLU  67           H        GLU  67  -1.797  15.108   1.998
  490    HA   GLU  67           HA       GLU  67  -0.228  15.667   3.492
  491    HB2  GLU  67           2HB      GLU  67  -0.065  18.175   1.822
  492    HB3  GLU  67           3HB      GLU  67   1.105  17.729   3.060
  493    HG2  GLU  67           2HG      GLU  67   1.438  15.570   1.770
  494    HG3  GLU  67           3HG      GLU  67   0.511  16.314   0.471
  495    H    HIS  68           H        HIS  68  -1.081  19.090   3.260
  496    HA   HIS  68           HA       HIS  68  -1.695  20.598   4.839
  497    HB2  HIS  68           2HB      HIS  68  -3.228  18.228   5.909
  498    HB3  HIS  68           3HB      HIS  68  -3.333  19.833   6.624
  499    HD1  HIS  68           HD1      HIS  68  -4.734  21.571   5.422
  500    HD2  HIS  68           HD2      HIS  68  -4.414  18.004   3.320
  501    HE1  HIS  68           HE1      HIS  68  -6.411  21.735   3.568
  502    HE2  HIS  68           HE2      HIS  68  -6.089  19.641   2.222
  503    H    HIS  69           H        HIS  69  -0.435  17.589   6.218
  504    HA   HIS  69           HA       HIS  69   0.178  18.524   8.779
  505    HB2  HIS  69           2HB      HIS  69   1.618  16.363   7.222
  506    HB3  HIS  69           3HB      HIS  69   1.623  16.574   8.971
  507    HD1  HIS  69           HD1      HIS  69   0.057  14.603   6.478
  508    HD2  HIS  69           HD2      HIS  69  -1.248  16.416   9.980
  509    HE1  HIS  69           HE1      HIS  69  -2.074  13.429   7.086
  510    HE2  HIS  69           HE2      HIS  69  -2.718  14.396   9.317
  511    H    HIS  70           H        HIS  70   1.169  20.506   8.761
  512    HA   HIS  70           HA       HIS  70   3.461  21.124   7.182
  513    HB2  HIS  70           2HB      HIS  70   3.604  23.135   8.794
  514    HB3  HIS  70           3HB      HIS  70   2.187  22.993   7.762
  515    HD1  HIS  70           HD1      HIS  70   3.202  22.204  11.344
  516    HD2  HIS  70           HD2      HIS  70  -0.170  23.131   9.100
  517    HE1  HIS  70           HE1      HIS  70   1.328  22.426  13.000
  518    HE2  HIS  70           HE2      HIS  70  -0.725  22.807  11.601
  519    H    HIS  71           H        HIS  71   4.962  19.505   7.566
  520    HA   HIS  71           HA       HIS  71   6.698  20.005   9.864
  521    HB2  HIS  71           2HB      HIS  71   5.647  17.257   9.132
  522    HB3  HIS  71           3HB      HIS  71   7.031  17.518  10.182
  523    HD1  HIS  71           HD1      HIS  71   3.708  16.605  10.502
  524    HD2  HIS  71           HD2      HIS  71   6.024  19.496  12.389
  525    HE1  HIS  71           HE1      HIS  71   2.541  17.095  12.671
  526    HE2  HIS  71           HE2      HIS  71   4.095  18.654  13.888
  527    H    HIS  72           H        HIS  72   8.791  18.585   9.541
  528    HA   HIS  72           HA       HIS  72   9.405  18.295   6.666
  529    HB2  HIS  72           2HB      HIS  72  11.209  19.387   8.837
  530    HB3  HIS  72           3HB      HIS  72  11.767  18.948   7.225
  531    HD1  HIS  72           HD1      HIS  72  11.508  21.878   8.743
  532    HD2  HIS  72           HD2      HIS  72   9.387  20.416   5.491
  533    HE1  HIS  72           HE1      HIS  72  10.696  23.905   7.511
  534    HE2  HIS  72           HE2      HIS  72   9.598  22.989   5.441
  535    H    HIS  73           H        HIS  73  10.312  16.419   6.048
  536    HA   HIS  73           HA       HIS  73  10.230  14.147   7.633
  537    HB2  HIS  73           2HB      HIS  73  11.477  13.005   5.837
  538    HB3  HIS  73           3HB      HIS  73  10.182  14.014   5.211
  539    HD1  HIS  73           HD1      HIS  73  13.915  13.730   5.319
  540    HD2  HIS  73           HD2      HIS  73  11.013  16.160   3.602
  541    HE1  HIS  73           HE1      HIS  73  15.123  15.122   3.624
  542    HE2  HIS  73           HE2      HIS  73  13.370  16.621   2.633
  Start of MODEL   11
    1    H1   MET   1           1H       MET   1 -16.832  10.075   2.070
    2    H2   MET   1           2H       MET   1 -17.730  10.596   0.740
    3    H3   MET   1           3H       MET   1 -17.507  11.627   2.058
    4    HA   MET   1           HA       MET   1 -16.068  12.356   0.337
    5    HB2  MET   1           2HB      MET   1 -14.506  10.798   2.416
    6    HB3  MET   1           3HB      MET   1 -13.870  12.107   1.432
    7    HG2  MET   1           2HG      MET   1 -15.371  13.681   2.495
    8    HG3  MET   1           3HG      MET   1 -16.108  12.380   3.431
    9    HE1  MET   1           3HE      MET   1 -12.260  12.777   2.591
   10    HE2  MET   1           1HE      MET   1 -11.723  13.742   3.965
   11    HE3  MET   1           2HE      MET   1 -12.825  14.437   2.774
   12    H    THR   2           H        THR   2 -14.385  11.949  -1.212
   13    HA   THR   2           HA       THR   2 -14.094   9.103  -1.968
   14    HB   THR   2           HB       THR   2 -15.318  10.162  -3.721
   15    HG1  THR   2           HG1      THR   2 -14.078   9.238  -5.154
   16   HG21  THR   2          3HG2      THR   2 -14.808  12.506  -3.201
   17   HG22  THR   2          1HG2      THR   2 -14.538  12.158  -4.909
   18   HG23  THR   2          2HG2      THR   2 -13.165  12.289  -3.809
   19    H    GLN   3           H        GLN   3 -12.155   8.389  -1.374
   20    HA   GLN   3           HA       GLN   3  -9.858  10.185  -1.292
   21    HB2  GLN   3           2HB      GLN   3 -10.128   7.278  -0.493
   22    HB3  GLN   3           3HB      GLN   3  -8.692   8.262  -0.250
   23    HG2  GLN   3           2HG      GLN   3  -9.938   9.733   1.243
   24    HG3  GLN   3           3HG      GLN   3 -11.396   8.776   0.985
   25   HE21  GLN   3          1HE2      GLN   3  -9.911   6.239   1.004
   26   HE22  GLN   3          2HE2      GLN   3  -9.514   5.951   2.659
   27    H    LYS   4           H        LYS   4  -7.745   9.396  -2.152
   28    HA   LYS   4           HA       LYS   4  -8.039   8.558  -4.915
   29    HB2  LYS   4           2HB      LYS   4  -5.582   9.320  -3.311
   30    HB3  LYS   4           3HB      LYS   4  -5.587   8.984  -5.038
   31    HG2  LYS   4           2HG      LYS   4  -7.162  11.193  -3.716
   32    HG3  LYS   4           3HG      LYS   4  -5.591  11.401  -4.493
   33    HD2  LYS   4           2HD      LYS   4  -8.072  10.371  -5.883
   34    HD3  LYS   4           3HD      LYS   4  -7.509  12.042  -5.946
   35    HE2  LYS   4           2HE      LYS   4  -5.418  11.295  -6.984
   36    HE3  LYS   4           3HE      LYS   4  -5.971   9.622  -6.910
   37    HZ1  LYS   4           3HZ      LYS   4  -7.780  10.179  -8.392
   38    HZ2  LYS   4           1HZ      LYS   4  -6.303  10.596  -9.099
   39    HZ3  LYS   4           2HZ      LYS   4  -7.291  11.798  -8.440
   40    H    PHE   5           H        PHE   5  -6.385   7.353  -2.009
   41    HA   PHE   5           HA       PHE   5  -5.824   4.811  -3.363
   42    HB2  PHE   5           2HB      PHE   5  -4.854   5.860  -0.690
   43    HB3  PHE   5           3HB      PHE   5  -4.350   4.348  -1.438
   44    HD1  PHE   5           HD1      PHE   5  -2.880   4.341  -3.380
   45    HD2  PHE   5           HD2      PHE   5  -4.034   7.990  -1.505
   46    HE1  PHE   5           HE1      PHE   5  -1.091   5.524  -4.581
   47    HE2  PHE   5           HE2      PHE   5  -2.242   9.176  -2.705
   48    HZ   PHE   5           HZ       PHE   5  -0.770   7.941  -4.247
   49    H    THR   6           H        THR   6  -7.088   3.109  -3.053
   50    HA   THR   6           HA       THR   6  -8.874   3.032  -0.692
   51    HB   THR   6           HB       THR   6 -10.235   3.141  -2.648
   52    HG1  THR   6           HG1      THR   6 -11.415   1.629  -1.775
   53   HG21  THR   6          3HG2      THR   6  -8.560   2.491  -4.323
   54   HG22  THR   6          1HG2      THR   6 -10.051   1.568  -4.517
   55   HG23  THR   6          2HG2      THR   6  -8.645   0.823  -3.760
   56    H    LYS   7           H        LYS   7  -9.586   0.714  -0.163
   57    HA   LYS   7           HA       LYS   7  -7.181  -0.790   0.433
   58    HB2  LYS   7           2HB      LYS   7  -8.657  -2.156   1.844
   59    HB3  LYS   7           3HB      LYS   7  -8.839  -0.441   2.181
   60    HG2  LYS   7           2HG      LYS   7 -10.877  -0.439   0.731
   61    HG3  LYS   7           3HG      LYS   7 -10.719  -2.192   0.601
   62    HD2  LYS   7           2HD      LYS   7 -12.340  -1.564   2.337
   63    HD3  LYS   7           3HD      LYS   7 -10.952  -2.410   3.026
   64    HE2  LYS   7           2HE      LYS   7  -9.979  -0.277   3.711
   65    HE3  LYS   7           3HE      LYS   7 -11.334   0.584   2.983
   66    HZ1  LYS   7           3HZ      LYS   7 -12.814  -0.352   4.576
   67    HZ2  LYS   7           1HZ      LYS   7 -11.501   0.298   5.417
   68    HZ3  LYS   7           2HZ      LYS   7 -11.616  -1.373   5.196
   69    H    ASP   8           H        ASP   8  -9.473  -0.828  -2.038
   70    HA   ASP   8           HA       ASP   8  -9.344  -3.707  -2.522
   71    HB2  ASP   8           2HB      ASP   8 -11.492  -2.564  -2.777
   72    HB3  ASP   8           3HB      ASP   8 -10.799  -1.491  -3.987
   73    H    MET   9           H        MET   9  -7.863  -0.786  -3.698
   74    HA   MET   9           HA       MET   9  -7.047  -1.759  -6.251
   75    HB2  MET   9           2HB      MET   9  -5.628   0.211  -6.361
   76    HB3  MET   9           3HB      MET   9  -7.208   0.646  -5.726
   77    HG2  MET   9           2HG      MET   9  -6.201   0.504  -3.424
   78    HG3  MET   9           3HG      MET   9  -4.628   0.362  -4.204
   79    HE1  MET   9           3HE      MET   9  -5.088   2.313  -6.760
   80    HE2  MET   9           1HE      MET   9  -3.608   2.267  -5.801
   81    HE3  MET   9           2HE      MET   9  -4.407   3.806  -6.112
   82    H    THR  10           H        THR  10  -4.951  -2.397  -6.946
   83    HA   THR  10           HA       THR  10  -3.609  -4.135  -5.079
   84    HB   THR  10           HB       THR  10  -2.226  -4.842  -6.940
   85    HG1  THR  10           HG1      THR  10  -2.350  -3.773  -8.950
   86   HG21  THR  10          3HG2      THR  10  -3.948  -5.600  -8.508
   87   HG22  THR  10          1HG2      THR  10  -5.079  -4.414  -7.856
   88   HG23  THR  10          2HG2      THR  10  -4.512  -5.744  -6.844
   89    H    PHE  11           H        PHE  11  -1.305  -4.127  -4.652
   90    HA   PHE  11           HA       PHE  11  -0.184  -1.703  -3.857
   91    HB2  PHE  11           2HB      PHE  11   1.158  -4.323  -4.564
   92    HB3  PHE  11           3HB      PHE  11   2.023  -2.958  -3.868
   93    HD1  PHE  11           HD1      PHE  11   1.475  -2.185  -1.568
   94    HD2  PHE  11           HD2      PHE  11  -0.195  -5.749  -3.204
   95    HE1  PHE  11           HE1      PHE  11   0.872  -2.941   0.696
   96    HE2  PHE  11           HE2      PHE  11  -0.797  -6.505  -0.945
   97    HZ   PHE  11           HZ       PHE  11  -0.264  -5.103   1.009
   98    H    ALA  12           H        ALA  12   0.190  -3.455  -6.910
   99    HA   ALA  12           HA       ALA  12   2.150  -1.928  -8.142
  100    HB1  ALA  12           3HB      ALA  12   1.260  -4.015  -9.069
  101    HB2  ALA  12           1HB      ALA  12   1.228  -2.714 -10.260
  102    HB3  ALA  12           2HB      ALA  12  -0.259  -3.200  -9.444
  103    H    GLN  13           H        GLN  13  -1.382  -1.394  -8.184
  104    HA   GLN  13           HA       GLN  13  -1.431   0.901  -9.782
  105    HB2  GLN  13           2HB      GLN  13  -3.250   0.162  -7.476
  106    HB3  GLN  13           3HB      GLN  13  -3.595   1.409  -8.669
  107    HG2  GLN  13           2HG      GLN  13  -3.630  -0.278 -10.433
  108    HG3  GLN  13           3HG      GLN  13  -3.256  -1.532  -9.253
  109   HE21  GLN  13          1HE2      GLN  13  -5.447   1.148  -8.675
  110   HE22  GLN  13          2HE2      GLN  13  -6.881   0.192  -8.574
  111    H    ALA  14           H        ALA  14  -1.368   0.684  -6.219
  112    HA   ALA  14           HA       ALA  14  -1.342   3.401  -5.634
  113    HB1  ALA  14           3HB      ALA  14  -0.457   2.780  -3.450
  114    HB2  ALA  14           1HB      ALA  14  -0.014   1.188  -4.068
  115    HB3  ALA  14           2HB      ALA  14  -1.713   1.652  -3.961
  116    H    LEU  15           H        LEU  15   1.462   1.233  -6.045
  117    HA   LEU  15           HA       LEU  15   3.478   3.119  -5.552
  118    HB2  LEU  15           2HB      LEU  15   3.511   0.654  -7.303
  119    HB3  LEU  15           3HB      LEU  15   4.946   1.563  -6.862
  120    HG   LEU  15           HG       LEU  15   3.122   0.137  -4.914
  121   HD11  LEU  15          1HD1      LEU  15   4.380  -1.438  -6.273
  122   HD12  LEU  15          2HD1      LEU  15   4.998  -1.415  -4.622
  123   HD13  LEU  15          3HD1      LEU  15   5.882  -0.586  -5.906
  124   HD21  LEU  15          3HD2      LEU  15   4.140   2.103  -3.911
  125   HD22  LEU  15          1HD2      LEU  15   5.733   1.594  -4.475
  126   HD23  LEU  15          2HD2      LEU  15   4.877   0.638  -3.265
  127    H    GLN  16           H        GLN  16   1.637   2.493  -8.477
  128    HA   GLN  16           HA       GLN  16   3.350   4.202 -10.101
  129    HB2  GLN  16           2HB      GLN  16   0.770   2.768 -10.766
  130    HB3  GLN  16           3HB      GLN  16   1.736   3.679 -11.918
  131    HG2  GLN  16           2HG      GLN  16   2.607   1.204 -10.428
  132    HG3  GLN  16           3HG      GLN  16   2.157   1.300 -12.130
  133   HE21  GLN  16          1HE2      GLN  16   4.611   2.004  -9.777
  134   HE22  GLN  16          2HE2      GLN  16   5.858   2.403 -10.901
  135    H    THR  17           H        THR  17   0.514   4.549  -8.171
  136    HA   THR  17           HA       THR  17  -0.599   6.832  -9.508
  137    HB   THR  17           HB       THR  17  -0.996   5.969  -6.625
  138    HG1  THR  17           HG1      THR  17  -1.568   4.474  -8.497
  139   HG21  THR  17          3HG2      THR  17  -1.773   8.240  -6.954
  140   HG22  THR  17          1HG2      THR  17  -3.168   7.170  -6.847
  141   HG23  THR  17          2HG2      THR  17  -2.637   7.775  -8.417
  142    H    HIS  18           H        HIS  18   1.101   6.581  -6.356
  143    HA   HIS  18           HA       HIS  18   2.413   9.157  -6.950
  144    HB2  HIS  18           2HB      HIS  18   0.968   8.360  -4.440
  145    HB3  HIS  18           3HB      HIS  18   2.342   9.453  -4.334
  146    HD1  HIS  18           HD1      HIS  18   1.349  11.697  -3.946
  147    HD2  HIS  18           HD2      HIS  18  -0.668   9.616  -6.920
  148    HE1  HIS  18           HE1      HIS  18  -0.383  13.286  -4.825
  149    HE2  HIS  18           HE2      HIS  18  -1.659  11.969  -6.542
  150    HA   PRO  19           HA       PRO  19   6.097   6.653  -6.469
  151    HB2  PRO  19           2HB      PRO  19   7.318   9.322  -5.897
  152    HB3  PRO  19           3HB      PRO  19   7.821   8.077  -7.047
  153    HG2  PRO  19           2HG      PRO  19   6.590  10.276  -7.897
  154    HG3  PRO  19           3HG      PRO  19   6.227   8.698  -8.621
  155    HD2  PRO  19           2HD      PRO  19   4.627  10.301  -6.663
  156    HD3  PRO  19           3HD      PRO  19   4.075   9.299  -8.021
  157    H    GLY  20           H        GLY  20   5.143   9.096  -4.097
  158    HA2  GLY  20           2HA      GLY  20   6.953   8.435  -2.041
  159    HA3  GLY  20           3HA      GLY  20   5.409   9.236  -1.821
  160    H    VAL  21           H        VAL  21   4.038   6.822  -3.059
  161    HA   VAL  21           HA       VAL  21   3.232   5.522  -0.745
  162    HB   VAL  21           HB       VAL  21   3.208   4.448  -3.577
  163   HG11  VAL  21          1HG1      VAL  21   2.944   2.623  -1.971
  164   HG12  VAL  21          2HG1      VAL  21   1.433   2.932  -2.824
  165   HG13  VAL  21          3HG1      VAL  21   1.643   3.503  -1.169
  166   HG21  VAL  21          3HG2      VAL  21   1.081   5.888  -1.979
  167   HG22  VAL  21          1HG2      VAL  21   0.871   5.218  -3.596
  168   HG23  VAL  21          2HG2      VAL  21   1.992   6.552  -3.334
  169    H    ALA  22           H        ALA  22   5.895   4.696  -2.921
  170    HA   ALA  22           HA       ALA  22   6.547   2.169  -1.920
  171    HB1  ALA  22           3HB      ALA  22   8.775   2.545  -2.841
  172    HB2  ALA  22           1HB      ALA  22   8.434   4.272  -2.982
  173    HB3  ALA  22           2HB      ALA  22   7.530   3.112  -3.955
  174    H    GLY  23           H        GLY  23   7.695   5.383  -0.866
  175    HA2  GLY  23           2HA      GLY  23   9.378   4.501   1.220
  176    HA3  GLY  23           3HA      GLY  23   8.641   6.092   1.106
  177    H    VAL  24           H        VAL  24   5.960   5.492   1.273
  178    HA   VAL  24           HA       VAL  24   5.477   5.213   4.011
  179    HB   VAL  24           HB       VAL  24   3.535   4.643   1.755
  180   HG11  VAL  24          1HG1      VAL  24   2.730   3.811   3.902
  181   HG12  VAL  24          2HG1      VAL  24   1.791   5.209   3.381
  182   HG13  VAL  24          3HG1      VAL  24   3.016   5.389   4.637
  183   HG21  VAL  24          3HG2      VAL  24   4.128   7.236   3.198
  184   HG22  VAL  24          1HG2      VAL  24   2.844   6.991   2.013
  185   HG23  VAL  24          2HG2      VAL  24   4.532   6.858   1.522
  186    H    LEU  25           H        LEU  25   4.927   2.787   1.431
  187    HA   LEU  25           HA       LEU  25   4.078   0.694   3.058
  188    HB2  LEU  25           2HB      LEU  25   5.615   0.562   0.460
  189    HB3  LEU  25           3HB      LEU  25   4.819  -0.809   1.213
  190    HG   LEU  25           HG       LEU  25   3.459   1.672   0.134
  191   HD11  LEU  25          1HD1      LEU  25   3.410  -1.184  -0.837
  192   HD12  LEU  25          2HD1      LEU  25   4.272   0.152  -1.600
  193   HD13  LEU  25          3HD1      LEU  25   2.511   0.168  -1.525
  194   HD21  LEU  25          3HD2      LEU  25   2.262  -0.778   1.438
  195   HD22  LEU  25          1HD2      LEU  25   1.356   0.513   0.645
  196   HD23  LEU  25          2HD2      LEU  25   2.282   0.857   2.104
  197    H    ARG  26           H        ARG  26   7.417   1.491   2.049
  198    HA   ARG  26           HA       ARG  26   8.658  -0.684   3.360
  199    HB2  ARG  26           2HB      ARG  26   9.814   2.050   2.761
  200    HB3  ARG  26           3HB      ARG  26  10.744   0.625   3.208
  201    HG2  ARG  26           2HG      ARG  26   9.925  -0.504   1.158
  202    HG3  ARG  26           3HG      ARG  26   9.107   0.989   0.701
  203    HD2  ARG  26           2HD      ARG  26  11.160   0.977  -0.482
  204    HD3  ARG  26           3HD      ARG  26  11.372   2.125   0.840
  205    HE   ARG  26           HE       ARG  26  12.433  -0.632   0.853
  206   HH11  ARG  26          1HH1      ARG  26  12.692   2.693   1.748
  207   HH12  ARG  26          2HH1      ARG  26  14.256   2.492   2.450
  208   HH21  ARG  26          1HH2      ARG  26  14.446  -0.864   1.739
  209   HH22  ARG  26          2HH2      ARG  26  15.241   0.506   2.441
  210    H    SER  27           H        SER  27   7.588   2.449   4.542
  211    HA   SER  27           HA       SER  27   8.931   2.358   7.058
  212    HB2  SER  27           2HB      SER  27   8.067   4.471   6.161
  213    HB3  SER  27           3HB      SER  27   6.415   3.862   6.268
  214    HG   SER  27           HG       SER  27   6.839   5.113   8.076
  215    H    TYR  28           H        TYR  28   5.679   1.373   6.021
  216    HA   TYR  28           HA       TYR  28   4.942   0.444   8.667
  217    HB2  TYR  28           2HB      TYR  28   3.564   0.345   5.977
  218    HB3  TYR  28           3HB      TYR  28   2.884  -0.412   7.415
  219    HD1  TYR  28           HD2      TYR  28   4.296   2.908   6.370
  220    HD2  TYR  28           HD1      TYR  28   1.353   0.823   8.633
  221    HE1  TYR  28           HE2      TYR  28   3.280   5.052   7.015
  222    HE2  TYR  28           HE1      TYR  28   0.335   2.961   9.283
  223    HH   TYR  28           HH       TYR  28   0.787   5.239   9.442
  224    H    ASN  29           H        ASN  29   6.974  -0.820   6.470
  225    HA   ASN  29           HA       ASN  29   7.934  -2.836   6.145
  226    HB2  ASN  29           2HB      ASN  29   7.777  -3.141   8.578
  227    HB3  ASN  29           3HB      ASN  29   6.154  -3.797   8.400
  228   HD21  ASN  29          1HD2      ASN  29   6.789  -5.731   9.372
  229   HD22  ASN  29          2HD2      ASN  29   7.758  -6.896   8.541
  230    H    LEU  30           H        LEU  30   6.393  -2.317   4.226
  231    HA   LEU  30           HA       LEU  30   5.065  -4.870   3.573
  232    HB2  LEU  30           2HB      LEU  30   4.140  -2.079   2.863
  233    HB3  LEU  30           3HB      LEU  30   3.547  -3.517   2.054
  234    HG   LEU  30           HG       LEU  30   3.223  -2.923   5.005
  235   HD11  LEU  30          1HD1      LEU  30   1.884  -1.433   3.593
  236   HD12  LEU  30          2HD1      LEU  30   0.869  -2.575   4.473
  237   HD13  LEU  30          3HD1      LEU  30   1.202  -2.831   2.759
  238   HD21  LEU  30          3HD2      LEU  30   1.701  -4.857   4.976
  239   HD22  LEU  30          1HD2      LEU  30   3.354  -5.314   4.566
  240   HD23  LEU  30          2HD2      LEU  30   2.138  -5.169   3.296
  241    H    GLY  31           H        GLY  31   7.721  -3.152   3.010
  242    HA2  GLY  31           2HA      GLY  31   7.799  -2.722   0.209
  243    HA3  GLY  31           3HA      GLY  31   9.195  -2.862   1.265
  244    H    CYS  32           H        CYS  32   8.030  -5.612   2.035
  245    HA   CYS  32           HA       CYS  32   9.621  -7.193   0.317
  246    HB2  CYS  32           2HB      CYS  32   7.399  -8.101   2.164
  247    HB3  CYS  32           3HB      CYS  32   8.690  -9.107   1.516
  248    HG   CYS  32           HG       CYS  32  10.661  -8.229   3.077
  249    H    ILE  33           H        ILE  33   6.560  -5.882  -0.244
  250    HA   ILE  33           HA       ILE  33   5.085  -7.868  -1.470
  251    HB   ILE  33           HB       ILE  33   4.086  -6.033  -2.899
  252   HG12  ILE  33          2HG1      ILE  33   6.012  -4.314  -1.299
  253   HG13  ILE  33          3HG1      ILE  33   6.083  -4.590  -3.037
  254   HG21  ILE  33          1HG2      ILE  33   4.229  -5.609   0.090
  255   HG22  ILE  33          2HG2      ILE  33   3.119  -6.678  -0.765
  256   HG23  ILE  33          3HG2      ILE  33   2.999  -4.932  -0.979
  257   HD11  ILE  33          3HD1      ILE  33   3.937  -3.454  -3.299
  258   HD12  ILE  33          1HD1      ILE  33   5.138  -2.422  -2.522
  259   HD13  ILE  33          2HD1      ILE  33   3.872  -3.181  -1.558
  260    H    GLY  34           H        GLY  34   7.574  -5.816  -3.045
  261    HA2  GLY  34           2HA      GLY  34   7.302  -6.870  -5.638
  262    HA3  GLY  34           3HA      GLY  34   8.769  -6.159  -4.984
  263    H    CYS  35           H        CYS  35   9.429  -7.913  -2.990
  264    HA   CYS  35           HA       CYS  35  10.770  -9.953  -4.379
  265    HB2  CYS  35           2HB      CYS  35  10.209  -9.797  -1.409
  266    HB3  CYS  35           3HB      CYS  35  11.473 -10.751  -2.180
  267    HG   CYS  35           HG       CYS  35  12.229  -7.954  -3.319
  268    H    MET  36           H        MET  36   7.825 -10.085  -2.388
  269    HA   MET  36           HA       MET  36   7.552 -12.947  -2.840
  270    HB2  MET  36           2HB      MET  36   5.577 -12.794  -1.396
  271    HB3  MET  36           3HB      MET  36   6.985 -12.056  -0.644
  272    HG2  MET  36           2HG      MET  36   6.146  -9.838  -1.299
  273    HG3  MET  36           3HG      MET  36   4.718 -10.599  -1.996
  274    HE1  MET  36           3HE      MET  36   4.076 -12.907   0.077
  275    HE2  MET  36           1HE      MET  36   2.847 -11.826  -0.576
  276    HE3  MET  36           2HE      MET  36   2.952 -12.088   1.163
  277    H    GLY  37           H        GLY  37   6.902 -10.376  -4.759
  278    HA2  GLY  37           2HA      GLY  37   5.707 -10.188  -6.716
  279    HA3  GLY  37           3HA      GLY  37   5.271 -11.879  -6.540
  280    H    ALA  38           H        ALA  38   4.494  -9.474  -4.112
  281    HA   ALA  38           HA       ALA  38   1.676 -10.131  -4.362
  282    HB1  ALA  38           3HB      ALA  38   2.729 -10.074  -2.160
  283    HB2  ALA  38           1HB      ALA  38   1.415  -8.903  -2.270
  284    HB3  ALA  38           2HB      ALA  38   3.091  -8.361  -2.369
  285    H    GLN  39           H        GLN  39   3.276  -8.194  -6.257
  286    HA   GLN  39           HA       GLN  39   2.192  -5.615  -6.031
  287    HB2  GLN  39           2HB      GLN  39   2.985  -7.142  -8.521
  288    HB3  GLN  39           3HB      GLN  39   2.657  -5.416  -8.473
  289    HG2  GLN  39           2HG      GLN  39   4.850  -6.822  -6.959
  290    HG3  GLN  39           3HG      GLN  39   5.053  -5.918  -8.458
  291   HE21  GLN  39          1HE2      GLN  39   4.478  -5.698  -5.046
  292   HE22  GLN  39          2HE2      GLN  39   4.751  -4.002  -4.912
  293    H    ASN  40           H        ASN  40   0.873  -8.540  -7.439
  294    HA   ASN  40           HA       ASN  40  -1.388  -7.249  -8.679
  295    HB2  ASN  40           2HB      ASN  40  -0.771 -10.178  -8.200
  296    HB3  ASN  40           3HB      ASN  40  -2.083  -9.571  -9.206
  297   HD21  ASN  40          1HD2      ASN  40   0.351 -11.196  -9.823
  298   HD22  ASN  40          2HD2      ASN  40   1.119 -10.352 -11.119
  299    H    GLU  41           H        GLU  41  -0.705  -7.974  -5.516
  300    HA   GLU  41           HA       GLU  41  -3.394  -8.799  -4.727
  301    HB2  GLU  41           2HB      GLU  41  -1.452  -9.909  -3.728
  302    HB3  GLU  41           3HB      GLU  41  -0.862  -8.370  -3.125
  303    HG2  GLU  41           2HG      GLU  41  -2.639  -8.201  -1.558
  304    HG3  GLU  41           3HG      GLU  41  -3.504  -9.550  -2.296
  305    H    SER  42           H        SER  42  -4.704  -7.576  -3.271
  306    HA   SER  42           HA       SER  42  -4.544  -4.736  -3.715
  307    HB2  SER  42           2HB      SER  42  -6.694  -4.602  -2.588
  308    HB3  SER  42           3HB      SER  42  -6.709  -5.940  -3.733
  309    HG   SER  42           HG       SER  42  -7.589  -6.695  -1.854
  310    H    LEU  43           H        LEU  43  -4.606  -3.101  -2.073
  311    HA   LEU  43           HA       LEU  43  -2.547  -3.237  -0.235
  312    HB2  LEU  43           2HB      LEU  43  -4.971  -1.436  -0.193
  313    HB3  LEU  43           3HB      LEU  43  -3.538  -1.191   0.789
  314    HG   LEU  43           HG       LEU  43  -3.658  -1.094  -2.235
  315   HD11  LEU  43          1HD1      LEU  43  -3.209   1.095  -0.204
  316   HD12  LEU  43          2HD1      LEU  43  -4.667   0.855  -1.166
  317   HD13  LEU  43          3HD1      LEU  43  -3.149   1.279  -1.958
  318   HD21  LEU  43          3HD2      LEU  43  -1.315  -0.353  -2.102
  319   HD22  LEU  43          1HD2      LEU  43  -1.523  -2.000  -1.508
  320   HD23  LEU  43          2HD2      LEU  43  -1.320  -0.671  -0.367
  321    H    GLU  44           H        GLU  44  -6.026  -3.763   0.392
  322    HA   GLU  44           HA       GLU  44  -5.712  -4.037   3.208
  323    HB2  GLU  44           2HB      GLU  44  -7.872  -3.446   2.337
  324    HB3  GLU  44           3HB      GLU  44  -7.939  -4.912   1.363
  325    HG2  GLU  44           2HG      GLU  44  -8.153  -6.282   3.307
  326    HG3  GLU  44           3HG      GLU  44  -7.835  -4.916   4.375
  327    H    GLN  45           H        GLN  45  -6.094  -6.489   0.625
  328    HA   GLN  45           HA       GLN  45  -5.977  -8.732   2.333
  329    HB2  GLN  45           2HB      GLN  45  -5.209  -8.497  -0.587
  330    HB3  GLN  45           3HB      GLN  45  -5.411 -10.017   0.277
  331    HG2  GLN  45           2HG      GLN  45  -7.769  -9.458   0.689
  332    HG3  GLN  45           3HG      GLN  45  -7.558  -7.949  -0.197
  333   HE21  GLN  45          1HE2      GLN  45  -9.104  -8.500  -1.735
  334   HE22  GLN  45          2HE2      GLN  45  -8.820  -9.711  -2.932
  335    H    GLY  46           H        GLY  46  -3.432  -6.946   0.630
  336    HA2  GLY  46           2HA      GLY  46  -1.270  -8.580   1.467
  337    HA3  GLY  46           3HA      GLY  46  -1.151  -6.917   0.918
  338    H    ALA  47           H        ALA  47  -2.660  -5.613   2.862
  339    HA   ALA  47           HA       ALA  47  -0.881  -5.220   4.956
  340    HB1  ALA  47           3HB      ALA  47  -2.667  -3.636   4.339
  341    HB2  ALA  47           1HB      ALA  47  -2.656  -3.985   6.069
  342    HB3  ALA  47           2HB      ALA  47  -3.865  -4.736   5.025
  343    H    ASN  48           H        ASN  48  -4.001  -6.972   5.156
  344    HA   ASN  48           HA       ASN  48  -3.587  -8.013   7.735
  345    HB2  ASN  48           2HB      ASN  48  -5.322  -9.008   5.469
  346    HB3  ASN  48           3HB      ASN  48  -5.346  -9.705   7.087
  347   HD21  ASN  48          1HD2      ASN  48  -6.279  -7.034   5.123
  348   HD22  ASN  48          2HD2      ASN  48  -7.238  -6.236   6.316
  349    H    ALA  49           H        ALA  49  -2.677  -9.292   4.563
  350    HA   ALA  49           HA       ALA  49  -1.836 -11.849   5.318
  351    HB1  ALA  49           3HB      ALA  49  -0.430 -11.822   3.323
  352    HB2  ALA  49           1HB      ALA  49  -0.615 -10.071   3.200
  353    HB3  ALA  49           2HB      ALA  49  -2.013 -11.124   2.982
  354    H    HIS  50           H        HIS  50  -0.312  -8.747   5.837
  355    HA   HIS  50           HA       HIS  50   2.064 -10.070   6.985
  356    HB2  HIS  50           2HB      HIS  50   1.608  -7.183   6.189
  357    HB3  HIS  50           3HB      HIS  50   3.077  -7.782   6.953
  358    HD1  HIS  50           HD1      HIS  50   4.876  -8.161   5.303
  359    HD2  HIS  50           HD2      HIS  50   1.130  -8.867   3.655
  360    HE1  HIS  50           HE1      HIS  50   5.297  -8.753   2.902
  361    HE2  HIS  50           HE2      HIS  50   3.008  -9.048   1.895
  362    H    GLY  51           H        GLY  51  -0.878  -8.788   7.947
  363    HA2  GLY  51           2HA      GLY  51  -1.666  -8.800  10.163
  364    HA3  GLY  51           3HA      GLY  51  -0.010  -8.735  10.738
  365    H    LEU  52           H        LEU  52  -1.528  -6.527   8.415
  366    HA   LEU  52           HA       LEU  52  -1.239  -4.332  10.376
  367    HB2  LEU  52           2HB      LEU  52  -0.764  -4.185   7.390
  368    HB3  LEU  52           3HB      LEU  52  -0.631  -2.848   8.515
  369    HG   LEU  52           HG       LEU  52   1.159  -5.285   8.444
  370   HD11  LEU  52          1HD1      LEU  52   2.879  -3.742   7.698
  371   HD12  LEU  52          2HD1      LEU  52   1.729  -2.406   7.742
  372   HD13  LEU  52          3HD1      LEU  52   1.510  -3.719   6.584
  373   HD21  LEU  52          3HD2      LEU  52   1.269  -2.840  10.214
  374   HD22  LEU  52          1HD2      LEU  52   2.488  -4.112  10.138
  375   HD23  LEU  52          2HD2      LEU  52   0.868  -4.479  10.728
  376    H    ASN  53           H        ASN  53  -2.787  -2.648  10.292
  377    HA   ASN  53           HA       ASN  53  -5.304  -3.330   8.995
  378    HB2  ASN  53           2HB      ASN  53  -5.441  -2.554  11.283
  379    HB3  ASN  53           3HB      ASN  53  -4.564  -1.081  10.879
  380   HD21  ASN  53          1HD2      ASN  53  -6.277   0.177  11.645
  381   HD22  ASN  53          2HD2      ASN  53  -7.745   0.362  10.757
  382    H    VAL  54           H        VAL  54  -5.802  -2.633   7.026
  383    HA   VAL  54           HA       VAL  54  -4.149  -0.963   5.496
  384    HB   VAL  54           HB       VAL  54  -5.652  -2.677   4.534
  385   HG11  VAL  54          1HG1      VAL  54  -7.634  -2.302   5.889
  386   HG12  VAL  54          2HG1      VAL  54  -8.031  -2.164   4.176
  387   HG13  VAL  54          3HG1      VAL  54  -7.858  -0.711   5.161
  388   HG21  VAL  54          3HG2      VAL  54  -4.707  -0.911   3.112
  389   HG22  VAL  54          1HG2      VAL  54  -6.125   0.091   3.421
  390   HG23  VAL  54          2HG2      VAL  54  -6.293  -1.429   2.541
  391    H    GLU  55           H        GLU  55  -7.010  -0.205   7.413
  392    HA   GLU  55           HA       GLU  55  -7.722   2.282   6.394
  393    HB2  GLU  55           2HB      GLU  55  -7.762   1.376   9.285
  394    HB3  GLU  55           3HB      GLU  55  -8.659   2.744   8.640
  395    HG2  GLU  55           2HG      GLU  55  -9.033  -0.099   7.707
  396    HG3  GLU  55           3HG      GLU  55  -9.989   0.652   8.983
  397    H    ASP  56           H        ASP  56  -5.355   1.537   8.936
  398    HA   ASP  56           HA       ASP  56  -4.586   4.177   9.524
  399    HB2  ASP  56           2HB      ASP  56  -4.135   2.206  10.968
  400    HB3  ASP  56           3HB      ASP  56  -2.956   1.635   9.792
  401    H    ILE  57           H        ILE  57  -3.308   1.819   7.222
  402    HA   ILE  57           HA       ILE  57  -1.060   3.323   6.370
  403    HB   ILE  57           HB       ILE  57  -2.576   1.223   4.798
  404   HG12  ILE  57          2HG1      ILE  57  -0.236   0.861   6.695
  405   HG13  ILE  57          3HG1      ILE  57  -1.905   0.432   7.061
  406   HG21  ILE  57          1HG2      ILE  57  -0.995   2.525   3.447
  407   HG22  ILE  57          2HG2      ILE  57  -0.455   0.859   3.638
  408   HG23  ILE  57          3HG2      ILE  57   0.299   2.141   4.586
  409   HD11  ILE  57          3HD1      ILE  57  -1.883  -1.220   5.280
  410   HD12  ILE  57          1HD1      ILE  57  -0.582  -1.512   6.434
  411   HD13  ILE  57          2HD1      ILE  57  -0.225  -0.776   4.871
  412    H    LEU  58           H        LEU  58  -4.330   2.951   4.973
  413    HA   LEU  58           HA       LEU  58  -4.020   4.515   2.692
  414    HB2  LEU  58           2HB      LEU  58  -6.476   4.150   4.412
  415    HB3  LEU  58           3HB      LEU  58  -6.488   4.881   2.817
  416    HG   LEU  58           HG       LEU  58  -5.717   2.022   3.437
  417   HD11  LEU  58          1HD1      LEU  58  -8.168   3.170   2.100
  418   HD12  LEU  58          2HD1      LEU  58  -8.104   2.391   3.681
  419   HD13  LEU  58          3HD1      LEU  58  -7.777   1.454   2.224
  420   HD21  LEU  58          3HD2      LEU  58  -5.656   1.718   1.011
  421   HD22  LEU  58          1HD2      LEU  58  -4.454   2.893   1.538
  422   HD23  LEU  58          2HD2      LEU  58  -5.951   3.442   0.781
  423    H    ARG  59           H        ARG  59  -4.638   5.512   6.005
  424    HA   ARG  59           HA       ARG  59  -5.343   8.184   5.605
  425    HB2  ARG  59           2HB      ARG  59  -5.532   7.151   7.784
  426    HB3  ARG  59           3HB      ARG  59  -3.795   6.891   7.866
  427    HG2  ARG  59           2HG      ARG  59  -3.376   9.227   8.103
  428    HG3  ARG  59           3HG      ARG  59  -5.055   9.625   7.732
  429    HD2  ARG  59           2HD      ARG  59  -4.574   9.796  10.136
  430    HD3  ARG  59           3HD      ARG  59  -5.793   8.572   9.789
  431    HE   ARG  59           HE       ARG  59  -3.386   7.231   9.880
  432   HH11  ARG  59          1HH1      ARG  59  -5.259   9.165  12.038
  433   HH12  ARG  59          2HH1      ARG  59  -4.689   8.332  13.442
  434   HH21  ARG  59          1HH2      ARG  59  -2.679   6.167  11.712
  435   HH22  ARG  59          2HH2      ARG  59  -3.264   6.669  13.260
  436    H    ASP  60           H        ASP  60  -2.069   6.794   6.050
  437    HA   ASP  60           HA       ASP  60  -0.761   9.314   5.673
  438    HB2  ASP  60           2HB      ASP  60   0.135   7.296   6.964
  439    HB3  ASP  60           3HB      ASP  60   0.529   6.591   5.398
  440    H    LEU  61           H        LEU  61  -1.609   6.626   3.567
  441    HA   LEU  61           HA       LEU  61  -0.080   7.335   1.312
  442    HB2  LEU  61           2HB      LEU  61  -2.702   5.851   1.524
  443    HB3  LEU  61           3HB      LEU  61  -1.806   6.019   0.025
  444    HG   LEU  61           HG       LEU  61  -0.827   4.604   2.514
  445   HD11  LEU  61          1HD1      LEU  61  -2.578   3.360   1.376
  446   HD12  LEU  61          2HD1      LEU  61  -1.015   2.574   1.151
  447   HD13  LEU  61          3HD1      LEU  61  -1.721   3.522  -0.159
  448   HD21  LEU  61          3HD2      LEU  61   1.019   5.641   1.316
  449   HD22  LEU  61          1HD2      LEU  61   0.469   4.920  -0.198
  450   HD23  LEU  61          2HD2      LEU  61   1.057   3.892   1.109
  451    H    ASN  62           H        ASN  62  -3.506   8.108   2.047
  452    HA   ASN  62           HA       ASN  62  -3.882   9.659  -0.306
  453    HB2  ASN  62           2HB      ASN  62  -5.459   9.446   2.257
  454    HB3  ASN  62           3HB      ASN  62  -5.934  10.536   0.956
  455   HD21  ASN  62          1HD2      ASN  62  -5.750   7.248   1.990
  456   HD22  ASN  62          2HD2      ASN  62  -6.605   6.567   0.654
  457    H    ALA  63           H        ALA  63  -2.604  10.440   2.849
  458    HA   ALA  63           HA       ALA  63  -2.802  13.236   2.795
  459    HB1  ALA  63           3HB      ALA  63  -2.055  11.966   4.757
  460    HB2  ALA  63           1HB      ALA  63  -0.915  13.246   4.340
  461    HB3  ALA  63           2HB      ALA  63  -0.550  11.572   3.926
  462    H    LEU  64           H        LEU  64  -0.634  11.057   1.100
  463    HA   LEU  64           HA       LEU  64   1.229  12.979   0.144
  464    HB2  LEU  64           2HB      LEU  64   0.396  10.360  -1.119
  465    HB3  LEU  64           3HB      LEU  64   1.841  11.273  -1.513
  466    HG   LEU  64           HG       LEU  64   1.277   9.990   1.171
  467   HD11  LEU  64          1HD1      LEU  64   3.023   8.394   0.546
  468   HD12  LEU  64          2HD1      LEU  64   3.128   9.129  -1.053
  469   HD13  LEU  64          3HD1      LEU  64   1.647   8.313  -0.552
  470   HD21  LEU  64          3HD2      LEU  64   3.628  10.502   1.652
  471   HD22  LEU  64          1HD2      LEU  64   2.685  11.968   1.379
  472   HD23  LEU  64          2HD2      LEU  64   3.756  11.360   0.116
  473    H    ALA  65           H        ALA  65  -2.019  12.334  -0.722
  474    HA   ALA  65           HA       ALA  65  -1.770  13.688  -3.319
  475    HB1  ALA  65           3HB      ALA  65  -4.153  12.309  -2.075
  476    HB2  ALA  65           1HB      ALA  65  -3.049  11.600  -3.254
  477    HB3  ALA  65           2HB      ALA  65  -4.068  12.965  -3.711
  478    H    LEU  66           H        LEU  66  -3.131  14.096  -0.110
  479    HA   LEU  66           HA       LEU  66  -4.747  16.364  -0.632
  480    HB2  LEU  66           2HB      LEU  66  -3.397  15.519   1.942
  481    HB3  LEU  66           3HB      LEU  66  -4.673  16.719   1.814
  482    HG   LEU  66           HG       LEU  66  -4.947  13.772   1.177
  483   HD11  LEU  66          1HD1      LEU  66  -6.060  15.387   3.470
  484   HD12  LEU  66          2HD1      LEU  66  -4.739  14.222   3.571
  485   HD13  LEU  66          3HD1      LEU  66  -6.364  13.679   3.152
  486   HD21  LEU  66          3HD2      LEU  66  -7.011  15.979   1.135
  487   HD22  LEU  66          1HD2      LEU  66  -7.350  14.257   0.953
  488   HD23  LEU  66          2HD2      LEU  66  -6.390  15.100  -0.261
  489    H    GLU  67           H        GLU  67  -1.480  16.132   0.795
  490    HA   GLU  67           HA       GLU  67   0.265  17.587   0.929
  491    HB2  GLU  67           2HB      GLU  67  -0.940  18.568  -1.664
  492    HB3  GLU  67           3HB      GLU  67   0.664  18.998  -1.088
  493    HG2  GLU  67           2HG      GLU  67   1.295  16.608  -1.156
  494    HG3  GLU  67           3HG      GLU  67  -0.297  16.234  -1.820
  495    H    HIS  68           H        HIS  68  -2.339  18.526   2.161
  496    HA   HIS  68           HA       HIS  68  -2.361  21.389   1.779
  497    HB2  HIS  68           2HB      HIS  68  -3.943  19.501   3.494
  498    HB3  HIS  68           3HB      HIS  68  -4.009  21.234   3.801
  499    HD1  HIS  68           HD1      HIS  68  -5.306  22.680   2.143
  500    HD2  HIS  68           HD2      HIS  68  -5.101  18.683   1.035
  501    HE1  HIS  68           HE1      HIS  68  -6.937  22.420   0.257
  502    HE2  HIS  68           HE2      HIS  68  -6.673  20.042  -0.498
  503    H    HIS  69           H        HIS  69   0.156  20.776   2.538
  504    HA   HIS  69           HA       HIS  69   1.819  21.553   3.829
  505    HB2  HIS  69           2HB      HIS  69  -0.417  23.275   4.885
  506    HB3  HIS  69           3HB      HIS  69   1.256  23.467   5.402
  507    HD1  HIS  69           HD1      HIS  69  -1.006  24.003   2.473
  508    HD2  HIS  69           HD2      HIS  69   2.982  24.582   3.491
  509    HE1  HIS  69           HE1      HIS  69  -0.034  25.392   0.624
  510    HE2  HIS  69           HE2      HIS  69   2.412  25.563   1.166
  511    H    HIS  70           H        HIS  70   2.930  20.638   5.371
  512    HA   HIS  70           HA       HIS  70   1.824  18.864   7.259
  513    HB2  HIS  70           2HB      HIS  70   4.112  18.693   8.157
  514    HB3  HIS  70           3HB      HIS  70   4.094  18.594   6.400
  515    HD1  HIS  70           HD1      HIS  70   6.296  19.746   8.691
  516    HD2  HIS  70           HD2      HIS  70   4.351  21.720   5.596
  517    HE1  HIS  70           HE1      HIS  70   7.717  21.742   8.171
  518    HE2  HIS  70           HE2      HIS  70   6.449  22.994   6.403
  519    H    HIS  71           H        HIS  71   1.605  18.970   9.509
  520    HA   HIS  71           HA       HIS  71   1.502  21.709  10.626
  521    HB2  HIS  71           2HB      HIS  71  -0.156  19.302  11.437
  522    HB3  HIS  71           3HB      HIS  71  -0.297  20.931  12.090
  523    HD1  HIS  71           HD1      HIS  71  -1.581  22.668  10.689
  524    HD2  HIS  71           HD2      HIS  71  -1.257  18.949   8.857
  525    HE1  HIS  71           HE1      HIS  71  -3.142  22.744   8.725
  526    HE2  HIS  71           HE2      HIS  71  -2.935  20.485   7.634
  527    H    HIS  72           H        HIS  72   1.627  21.635  13.158
  528    HA   HIS  72           HA       HIS  72   3.390  19.570  14.200
  529    HB2  HIS  72           2HB      HIS  72   5.206  21.092  14.796
  530    HB3  HIS  72           3HB      HIS  72   4.964  21.085  13.054
  531    HD1  HIS  72           HD1      HIS  72   4.623  23.270  16.078
  532    HD2  HIS  72           HD2      HIS  72   4.082  23.526  11.961
  533    HE1  HIS  72           HE1      HIS  72   4.349  25.714  15.583
  534    HE2  HIS  72           HE2      HIS  72   4.011  25.849  13.098
  535    H    HIS  73           H        HIS  73   3.877  19.874  16.508
  536    HA   HIS  73           HA       HIS  73   1.700  20.898  18.026
  537    HB2  HIS  73           2HB      HIS  73   3.116  20.363  20.013
  538    HB3  HIS  73           3HB      HIS  73   2.931  19.022  18.892
  539    HD1  HIS  73           HD1      HIS  73   5.476  21.313  20.353
  540    HD2  HIS  73           HD2      HIS  73   5.296  18.265  17.532
  541    HE1  HIS  73           HE1      HIS  73   7.857  20.675  19.902
  542    HE2  HIS  73           HE2      HIS  73   7.733  18.860  18.168
  Start of MODEL   12
    1    H1   MET   1           1H       MET   1 -18.522  10.435  -1.773
    2    H2   MET   1           2H       MET   1 -18.599  11.619  -0.569
    3    H3   MET   1           3H       MET   1 -18.324  10.005  -0.150
    4    HA   MET   1           HA       MET   1 -16.500  11.731  -1.722
    5    HB2  MET   1           2HB      MET   1 -16.372  10.730   1.131
    6    HB3  MET   1           3HB      MET   1 -14.988  11.412   0.286
    7    HG2  MET   1           2HG      MET   1 -16.203  13.522   0.009
    8    HG3  MET   1           3HG      MET   1 -17.581  12.836   0.869
    9    HE1  MET   1           3HE      MET   1 -17.460  15.005   2.514
   10    HE2  MET   1           1HE      MET   1 -16.057  15.577   1.609
   11    HE3  MET   1           2HE      MET   1 -15.988  15.468   3.367
   12    H    THR   2           H        THR   2 -14.558  10.779  -2.404
   13    HA   THR   2           HA       THR   2 -14.315   7.853  -2.137
   14    HB   THR   2           HB       THR   2 -15.375   8.285  -4.324
   15    HG1  THR   2           HG1      THR   2 -14.041   6.513  -4.334
   16   HG21  THR   2          3HG2      THR   2 -14.463  10.545  -4.723
   17   HG22  THR   2          1HG2      THR   2 -14.167   9.466  -6.088
   18   HG23  THR   2          2HG2      THR   2 -12.862   9.843  -4.965
   19    H    GLN   3           H        GLN   3 -12.156   7.036  -2.534
   20    HA   GLN   3           HA       GLN   3 -10.063   9.081  -2.075
   21    HB2  GLN   3           2HB      GLN   3  -9.986   6.186  -1.181
   22    HB3  GLN   3           3HB      GLN   3  -8.824   7.441  -0.791
   23    HG2  GLN   3           2HG      GLN   3 -10.097   7.186   1.148
   24    HG3  GLN   3           3HG      GLN   3 -10.726   8.643   0.387
   25   HE21  GLN   3          1HE2      GLN   3 -11.496   5.405  -0.729
   26   HE22  GLN   3          2HE2      GLN   3 -13.150   5.436  -0.245
   27    H    LYS   4           H        LYS   4  -8.203   9.019  -3.325
   28    HA   LYS   4           HA       LYS   4  -8.137   7.355  -5.661
   29    HB2  LYS   4           2HB      LYS   4  -6.007   9.145  -4.459
   30    HB3  LYS   4           3HB      LYS   4  -5.851   8.324  -6.006
   31    HG2  LYS   4           2HG      LYS   4  -7.866  10.451  -5.289
   32    HG3  LYS   4           3HG      LYS   4  -6.481  10.623  -6.366
   33    HD2  LYS   4           2HD      LYS   4  -8.842   8.788  -6.827
   34    HD3  LYS   4           3HD      LYS   4  -8.607  10.357  -7.597
   35    HE2  LYS   4           2HE      LYS   4  -6.732   8.002  -7.859
   36    HE3  LYS   4           3HE      LYS   4  -7.963   8.443  -9.039
   37    HZ1  LYS   4           3HZ      LYS   4  -5.663  10.136  -8.227
   38    HZ2  LYS   4           1HZ      LYS   4  -6.846  10.562  -9.356
   39    HZ3  LYS   4           2HZ      LYS   4  -5.796   9.277  -9.675
   40    H    PHE   5           H        PHE   5  -6.779   7.163  -2.459
   41    HA   PHE   5           HA       PHE   5  -5.497   4.594  -3.151
   42    HB2  PHE   5           2HB      PHE   5  -5.048   6.345  -0.716
   43    HB3  PHE   5           3HB      PHE   5  -4.177   4.864  -1.102
   44    HD1  PHE   5           HD2      PHE   5  -4.634   8.403  -1.953
   45    HD2  PHE   5           HD1      PHE   5  -2.467   4.834  -2.817
   46    HE1  PHE   5           HE2      PHE   5  -2.981   9.712  -3.218
   47    HE2  PHE   5           HE1      PHE   5  -0.816   6.142  -4.081
   48    HZ   PHE   5           HZ       PHE   5  -1.066   8.581  -4.284
   49    H    THR   6           H        THR   6  -6.912   2.994  -2.832
   50    HA   THR   6           HA       THR   6  -8.562   2.998  -0.370
   51    HB   THR   6           HB       THR   6 -10.084   3.359  -2.191
   52    HG1  THR   6           HG1      THR   6 -11.420   1.648  -1.810
   53   HG21  THR   6          3HG2      THR   6 -10.236   1.854  -4.122
   54   HG22  THR   6          1HG2      THR   6  -8.846   0.942  -3.531
   55   HG23  THR   6          2HG2      THR   6  -8.648   2.618  -4.043
   56    H    LYS   7           H        LYS   7  -9.233   0.849   0.375
   57    HA   LYS   7           HA       LYS   7  -7.063  -0.936   0.645
   58    HB2  LYS   7           2HB      LYS   7  -8.696  -2.421   1.750
   59    HB3  LYS   7           3HB      LYS   7  -8.810  -0.763   2.327
   60    HG2  LYS   7           2HG      LYS   7 -10.787  -0.384   0.986
   61    HG3  LYS   7           3HG      LYS   7 -10.641  -1.984   0.258
   62    HD2  LYS   7           2HD      LYS   7 -12.345  -1.990   1.992
   63    HD3  LYS   7           3HD      LYS   7 -10.987  -3.012   2.461
   64    HE2  LYS   7           2HE      LYS   7 -10.115  -1.095   3.818
   65    HE3  LYS   7           3HE      LYS   7 -11.606  -0.225   3.448
   66    HZ1  LYS   7           3HZ      LYS   7 -11.413  -2.824   4.872
   67    HZ2  LYS   7           1HZ      LYS   7 -12.853  -2.020   4.498
   68    HZ3  LYS   7           2HZ      LYS   7 -11.759  -1.326   5.583
   69    H    ASP   8           H        ASP   8  -9.532  -0.710  -1.759
   70    HA   ASP   8           HA       ASP   8  -9.502  -3.491  -2.527
   71    HB2  ASP   8           2HB      ASP   8 -11.538  -2.095  -2.654
   72    HB3  ASP   8           3HB      ASP   8 -10.772  -1.107  -3.893
   73    H    MET   9           H        MET   9  -7.742  -0.647  -3.520
   74    HA   MET   9           HA       MET   9  -7.132  -1.613  -6.173
   75    HB2  MET   9           2HB      MET   9  -5.721   0.349  -6.386
   76    HB3  MET   9           3HB      MET   9  -7.265   0.803  -5.680
   77    HG2  MET   9           2HG      MET   9  -6.154   0.708  -3.432
   78    HG3  MET   9           3HG      MET   9  -4.620   0.513  -4.275
   79    HE1  MET   9           3HE      MET   9  -4.350   3.894  -6.243
   80    HE2  MET   9           1HE      MET   9  -5.036   2.379  -6.830
   81    HE3  MET   9           2HE      MET   9  -3.558   2.365  -5.866
   82    H    THR  10           H        THR  10  -5.038  -2.220  -6.954
   83    HA   THR  10           HA       THR  10  -3.635  -3.989  -5.179
   84    HB   THR  10           HB       THR  10  -2.227  -4.554  -7.083
   85    HG1  THR  10           HG1      THR  10  -2.835  -3.355  -9.132
   86   HG21  THR  10          3HG2      THR  10  -3.939  -5.296  -8.671
   87   HG22  THR  10          1HG2      THR  10  -5.107  -4.200  -7.935
   88   HG23  THR  10          2HG2      THR  10  -4.465  -5.558  -7.009
   89    H    PHE  11           H        PHE  11  -1.385  -3.964  -4.672
   90    HA   PHE  11           HA       PHE  11  -0.268  -1.566  -3.799
   91    HB2  PHE  11           2HB      PHE  11   1.060  -4.188  -4.514
   92    HB3  PHE  11           3HB      PHE  11   1.925  -2.848  -3.771
   93    HD1  PHE  11           HD2      PHE  11   1.482  -2.196  -1.466
   94    HD2  PHE  11           HD1      PHE  11  -0.513  -5.515  -3.239
   95    HE1  PHE  11           HE2      PHE  11   0.798  -2.973   0.765
   96    HE2  PHE  11           HE1      PHE  11  -1.200  -6.295  -1.010
   97    HZ   PHE  11           HZ       PHE  11  -0.543  -5.025   0.996
   98    H    ALA  12           H        ALA  12   0.212  -3.268  -6.868
   99    HA   ALA  12           HA       ALA  12   2.240  -1.705  -7.965
  100    HB1  ALA  12           3HB      ALA  12   1.487  -2.508 -10.139
  101    HB2  ALA  12           1HB      ALA  12  -0.046  -3.024  -9.433
  102    HB3  ALA  12           2HB      ALA  12   1.458  -3.808  -8.949
  103    H    GLN  13           H        GLN  13  -1.301  -1.231  -8.191
  104    HA   GLN  13           HA       GLN  13  -1.237   1.089  -9.784
  105    HB2  GLN  13           2HB      GLN  13  -3.271   0.159  -7.749
  106    HB3  GLN  13           3HB      GLN  13  -3.515   1.553  -8.791
  107    HG2  GLN  13           2HG      GLN  13  -3.281   0.087 -10.762
  108    HG3  GLN  13           3HG      GLN  13  -3.126  -1.298  -9.682
  109   HE21  GLN  13          1HE2      GLN  13  -5.284   1.386  -9.064
  110   HE22  GLN  13          2HE2      GLN  13  -6.746   0.503  -9.310
  111    H    ALA  14           H        ALA  14  -1.212   0.720  -6.251
  112    HA   ALA  14           HA       ALA  14  -1.299   3.416  -5.523
  113    HB1  ALA  14           3HB      ALA  14  -1.533   1.578  -3.927
  114    HB2  ALA  14           1HB      ALA  14  -0.286   2.715  -3.410
  115    HB3  ALA  14           2HB      ALA  14   0.171   1.171  -4.133
  116    H    LEU  15           H        LEU  15   1.575   1.378  -6.137
  117    HA   LEU  15           HA       LEU  15   3.524   3.355  -5.701
  118    HB2  LEU  15           2HB      LEU  15   3.635   0.933  -7.509
  119    HB3  LEU  15           3HB      LEU  15   5.026   1.884  -7.019
  120    HG   LEU  15           HG       LEU  15   3.250   0.279  -5.167
  121   HD11  LEU  15          1HD1      LEU  15   4.627  -1.145  -6.583
  122   HD12  LEU  15          2HD1      LEU  15   5.191  -1.188  -4.913
  123   HD13  LEU  15          3HD1      LEU  15   6.069  -0.240  -6.116
  124   HD21  LEU  15          3HD2      LEU  15   4.148   2.259  -4.058
  125   HD22  LEU  15          1HD2      LEU  15   5.777   1.837  -4.587
  126   HD23  LEU  15          2HD2      LEU  15   4.921   0.797  -3.446
  127    H    GLN  16           H        GLN  16   1.692   2.542  -8.609
  128    HA   GLN  16           HA       GLN  16   3.119   4.299 -10.360
  129    HB2  GLN  16           2HB      GLN  16   0.374   3.040 -10.566
  130    HB3  GLN  16           3HB      GLN  16   1.107   3.989 -11.852
  131    HG2  GLN  16           2HG      GLN  16   2.303   1.474 -10.693
  132    HG3  GLN  16           3HG      GLN  16   1.317   1.538 -12.154
  133   HE21  GLN  16          1HE2      GLN  16   4.397   2.337 -10.748
  134   HE22  GLN  16          2HE2      GLN  16   5.203   2.695 -12.233
  135    H    THR  17           H        THR  17   0.312   4.660  -8.277
  136    HA   THR  17           HA       THR  17  -0.592   7.133  -9.342
  137    HB   THR  17           HB       THR  17  -1.088   5.973  -6.585
  138    HG1  THR  17           HG1      THR  17  -1.965   4.578  -8.076
  139   HG21  THR  17          3HG2      THR  17  -1.594   8.362  -6.643
  140   HG22  THR  17          1HG2      THR  17  -3.086   7.422  -6.581
  141   HG23  THR  17          2HG2      THR  17  -2.558   8.138  -8.105
  142    H    HIS  18           H        HIS  18   1.520   6.359  -6.574
  143    HA   HIS  18           HA       HIS  18   2.803   8.946  -6.846
  144    HB2  HIS  18           2HB      HIS  18   1.018   8.298  -4.550
  145    HB3  HIS  18           3HB      HIS  18   2.538   9.097  -4.166
  146    HD1  HIS  18           HD1      HIS  18  -0.818   9.733  -5.627
  147    HD2  HIS  18           HD2      HIS  18   2.808  11.719  -5.225
  148    HE1  HIS  18           HE1      HIS  18  -1.310  12.139  -6.119
  149    HE2  HIS  18           HE2      HIS  18   0.847  13.340  -5.665
  150    HA   PRO  19           HA       PRO  19   6.284   6.207  -5.969
  151    HB2  PRO  19           2HB      PRO  19   7.610   8.852  -5.572
  152    HB3  PRO  19           3HB      PRO  19   8.115   7.478  -6.562
  153    HG2  PRO  19           2HG      PRO  19   7.075   9.638  -7.709
  154    HG3  PRO  19           3HG      PRO  19   6.647   8.017  -8.292
  155    HD2  PRO  19           2HD      PRO  19   5.060   9.897  -6.579
  156    HD3  PRO  19           3HD      PRO  19   4.513   8.829  -7.890
  157    H    GLY  20           H        GLY  20   5.430   9.006  -3.954
  158    HA2  GLY  20           2HA      GLY  20   6.926   8.458  -1.670
  159    HA3  GLY  20           3HA      GLY  20   5.381   9.288  -1.673
  160    H    VAL  21           H        VAL  21   4.151   6.759  -2.872
  161    HA   VAL  21           HA       VAL  21   3.210   5.557  -0.513
  162    HB   VAL  21           HB       VAL  21   3.216   4.488  -3.349
  163   HG11  VAL  21          1HG1      VAL  21   2.907   2.642  -1.792
  164   HG12  VAL  21          2HG1      VAL  21   1.392   2.999  -2.619
  165   HG13  VAL  21          3HG1      VAL  21   1.636   3.531  -0.955
  166   HG21  VAL  21          3HG2      VAL  21   0.891   5.282  -3.396
  167   HG22  VAL  21          1HG2      VAL  21   2.026   6.602  -3.105
  168   HG23  VAL  21          2HG2      VAL  21   1.084   5.936  -1.769
  169    H    ALA  22           H        ALA  22   5.908   4.729  -2.635
  170    HA   ALA  22           HA       ALA  22   6.524   2.174  -1.697
  171    HB1  ALA  22           3HB      ALA  22   8.470   4.302  -2.604
  172    HB2  ALA  22           1HB      ALA  22   7.594   3.190  -3.658
  173    HB3  ALA  22           2HB      ALA  22   8.788   2.568  -2.519
  174    H    GLY  23           H        GLY  23   7.649   5.332  -0.463
  175    HA2  GLY  23           2HA      GLY  23   9.252   4.357   1.642
  176    HA3  GLY  23           3HA      GLY  23   8.513   5.948   1.580
  177    H    VAL  24           H        VAL  24   5.812   5.241   1.586
  178    HA   VAL  24           HA       VAL  24   5.253   4.840   4.312
  179    HB   VAL  24           HB       VAL  24   3.358   4.365   1.997
  180   HG11  VAL  24          1HG1      VAL  24   2.502   3.525   4.119
  181   HG12  VAL  24          2HG1      VAL  24   1.595   4.947   3.601
  182   HG13  VAL  24          3HG1      VAL  24   2.803   5.089   4.880
  183   HG21  VAL  24          3HG2      VAL  24   4.377   6.557   1.776
  184   HG22  VAL  24          1HG2      VAL  24   3.985   6.937   3.454
  185   HG23  VAL  24          2HG2      VAL  24   2.694   6.720   2.273
  186    H    LEU  25           H        LEU  25   4.784   2.607   1.559
  187    HA   LEU  25           HA       LEU  25   3.914   0.387   3.006
  188    HB2  LEU  25           2HB      LEU  25   5.516   0.457   0.441
  189    HB3  LEU  25           3HB      LEU  25   4.679  -0.956   1.060
  190    HG   LEU  25           HG       LEU  25   3.385   1.622   0.141
  191   HD11  LEU  25          1HD1      LEU  25   3.349  -1.146  -1.059
  192   HD12  LEU  25          2HD1      LEU  25   4.219   0.250  -1.695
  193   HD13  LEU  25          3HD1      LEU  25   2.456   0.255  -1.653
  194   HD21  LEU  25          3HD2      LEU  25   2.135  -0.904   1.230
  195   HD22  LEU  25          1HD2      LEU  25   1.255   0.424   0.474
  196   HD23  LEU  25          2HD2      LEU  25   2.121   0.691   1.985
  197    H    ARG  26           H        ARG  26   7.265   1.161   1.978
  198    HA   ARG  26           HA       ARG  26   8.520  -1.056   3.129
  199    HB2  ARG  26           2HB      ARG  26   9.575   1.742   2.688
  200    HB3  ARG  26           3HB      ARG  26  10.582   0.388   3.189
  201    HG2  ARG  26           2HG      ARG  26   9.959  -0.802   1.109
  202    HG3  ARG  26           3HG      ARG  26   9.038   0.616   0.604
  203    HD2  ARG  26           2HD      ARG  26  11.257   0.580  -0.433
  204    HD3  ARG  26           3HD      ARG  26  11.075   1.970   0.643
  205    HE   ARG  26           HE       ARG  26  12.255  -0.282   1.956
  206   HH11  ARG  26          1HH1      ARG  26  12.949   2.384  -0.115
  207   HH12  ARG  26          2HH1      ARG  26  14.612   2.446   0.351
  208   HH21  ARG  26          1HH2      ARG  26  14.374  -0.190   2.542
  209   HH22  ARG  26          2HH2      ARG  26  15.410   1.010   1.845
  210    H    SER  27           H        SER  27   7.875   2.135   4.589
  211    HA   SER  27           HA       SER  27   9.065   1.673   7.085
  212    HB2  SER  27           2HB      SER  27   8.300   3.903   6.352
  213    HB3  SER  27           3HB      SER  27   6.623   3.371   6.471
  214    HG   SER  27           HG       SER  27   7.933   4.506   8.346
  215    H    TYR  28           H        TYR  28   5.905   0.748   5.852
  216    HA   TYR  28           HA       TYR  28   5.046  -0.304   8.432
  217    HB2  TYR  28           2HB      TYR  28   3.711   0.015   5.752
  218    HB3  TYR  28           3HB      TYR  28   2.986  -0.978   7.012
  219    HD1  TYR  28           HD1      TYR  28   4.615   2.415   6.883
  220    HD2  TYR  28           HD2      TYR  28   1.275   0.081   8.140
  221    HE1  TYR  28           HE1      TYR  28   3.594   4.416   7.883
  222    HE2  TYR  28           HE2      TYR  28   0.254   2.081   9.141
  223    HH   TYR  28           HH       TYR  28   0.752   4.218   9.890
  224    H    ASN  29           H        ASN  29   7.207  -1.512   6.453
  225    HA   ASN  29           HA       ASN  29   8.091  -3.600   6.175
  226    HB2  ASN  29           2HB      ASN  29   7.107  -3.879   8.541
  227    HB3  ASN  29           3HB      ASN  29   5.795  -4.755   7.765
  228   HD21  ASN  29          1HD2      ASN  29   7.659  -5.738   9.695
  229   HD22  ASN  29          2HD2      ASN  29   8.491  -7.055   8.951
  230    H    LEU  30           H        LEU  30   5.816  -2.475   4.495
  231    HA   LEU  30           HA       LEU  30   4.872  -4.949   3.219
  232    HB2  LEU  30           2HB      LEU  30   4.036  -2.068   2.891
  233    HB3  LEU  30           3HB      LEU  30   3.465  -3.351   1.842
  234    HG   LEU  30           HG       LEU  30   3.006  -3.206   4.828
  235   HD11  LEU  30          1HD1      LEU  30   0.682  -2.740   4.241
  236   HD12  LEU  30          2HD1      LEU  30   1.106  -2.735   2.528
  237   HD13  LEU  30          3HD1      LEU  30   1.760  -1.499   3.601
  238   HD21  LEU  30          3HD2      LEU  30   1.483  -5.093   4.461
  239   HD22  LEU  30          1HD2      LEU  30   3.141  -5.509   4.027
  240   HD23  LEU  30          2HD2      LEU  30   1.960  -5.155   2.764
  241    H    GLY  31           H        GLY  31   7.499  -2.961   2.948
  242    HA2  GLY  31           2HA      GLY  31   7.701  -2.379   0.205
  243    HA3  GLY  31           3HA      GLY  31   9.060  -2.591   1.296
  244    H    CYS  32           H        CYS  32   8.108  -5.387   1.882
  245    HA   CYS  32           HA       CYS  32   9.653  -6.732  -0.101
  246    HB2  CYS  32           2HB      CYS  32   9.608  -7.483   2.222
  247    HB3  CYS  32           3HB      CYS  32   7.893  -7.848   2.092
  248    HG   CYS  32           HG       CYS  32  10.401  -9.814   1.563
  249    H    ILE  33           H        ILE  33   6.531  -5.631  -0.354
  250    HA   ILE  33           HA       ILE  33   4.990  -7.666  -1.397
  251    HB   ILE  33           HB       ILE  33   3.956  -5.910  -2.921
  252   HG12  ILE  33          2HG1      ILE  33   5.902  -4.103  -1.453
  253   HG13  ILE  33          3HG1      ILE  33   5.964  -4.496  -3.168
  254   HG21  ILE  33          1HG2      ILE  33   4.148  -5.306   0.028
  255   HG22  ILE  33          2HG2      ILE  33   3.052  -6.459  -0.731
  256   HG23  ILE  33          3HG2      ILE  33   2.886  -4.735  -1.063
  257   HD11  ILE  33          3HD1      ILE  33   5.020  -2.293  -2.779
  258   HD12  ILE  33          1HD1      ILE  33   3.747  -3.002  -1.784
  259   HD13  ILE  33          2HD1      ILE  33   3.832  -3.372  -3.507
  260    H    GLY  34           H        GLY  34   7.519  -5.830  -3.087
  261    HA2  GLY  34           2HA      GLY  34   7.142  -6.982  -5.642
  262    HA3  GLY  34           3HA      GLY  34   8.631  -6.259  -5.052
  263    H    CYS  35           H        CYS  35   9.289  -7.915  -2.963
  264    HA   CYS  35           HA       CYS  35  10.554 -10.042  -4.332
  265    HB2  CYS  35           2HB      CYS  35  10.266  -9.605  -1.353
  266    HB3  CYS  35           3HB      CYS  35  11.421 -10.685  -2.130
  267    HG   CYS  35           HG       CYS  35  12.974  -8.597  -1.402
  268    H    MET  36           H        MET  36   7.674  -9.947  -2.263
  269    HA   MET  36           HA       MET  36   7.362 -12.841  -2.434
  270    HB2  MET  36           2HB      MET  36   5.398 -12.543  -1.001
  271    HB3  MET  36           3HB      MET  36   6.808 -11.746  -0.321
  272    HG2  MET  36           2HG      MET  36   5.947  -9.594  -1.256
  273    HG3  MET  36           3HG      MET  36   4.477 -10.451  -1.718
  274    HE1  MET  36           3HE      MET  36   4.171 -12.495   0.750
  275    HE2  MET  36           1HE      MET  36   2.816 -11.597   0.064
  276    HE3  MET  36           2HE      MET  36   3.098 -11.574   1.804
  277    H    GLY  37           H        GLY  37   6.617 -10.258  -4.412
  278    HA2  GLY  37           2HA      GLY  37   5.569 -10.282  -6.469
  279    HA3  GLY  37           3HA      GLY  37   5.090 -11.942  -6.169
  280    H    ALA  38           H        ALA  38   4.215  -9.479  -3.867
  281    HA   ALA  38           HA       ALA  38   1.407 -10.024  -4.294
  282    HB1  ALA  38           3HB      ALA  38   2.353  -9.828  -2.034
  283    HB2  ALA  38           1HB      ALA  38   1.050  -8.669  -2.306
  284    HB3  ALA  38           2HB      ALA  38   2.730  -8.134  -2.347
  285    H    GLN  39           H        GLN  39   2.936  -8.478  -6.380
  286    HA   GLN  39           HA       GLN  39   2.292  -5.739  -6.302
  287    HB2  GLN  39           2HB      GLN  39   2.726  -7.483  -8.740
  288    HB3  GLN  39           3HB      GLN  39   2.807  -5.727  -8.703
  289    HG2  GLN  39           2HG      GLN  39   4.653  -7.617  -7.247
  290    HG3  GLN  39           3HG      GLN  39   5.029  -6.725  -8.719
  291   HE21  GLN  39          1HE2      GLN  39   4.555  -6.509  -5.288
  292   HE22  GLN  39          2HE2      GLN  39   5.210  -4.923  -5.094
  293    H    ASN  40           H        ASN  40   0.526  -8.483  -7.727
  294    HA   ASN  40           HA       ASN  40  -1.551  -6.701  -8.750
  295    HB2  ASN  40           2HB      ASN  40  -1.377  -9.720  -8.953
  296    HB3  ASN  40           3HB      ASN  40  -2.437  -8.661  -9.880
  297   HD21  ASN  40          1HD2      ASN  40   0.762  -9.897  -9.522
  298   HD22  ASN  40          2HD2      ASN  40   1.402  -9.244 -10.986
  299    H    GLU  41           H        GLU  41  -1.056  -7.561  -5.767
  300    HA   GLU  41           HA       GLU  41  -3.781  -8.514  -5.189
  301    HB2  GLU  41           2HB      GLU  41  -1.915  -9.831  -4.246
  302    HB3  GLU  41           3HB      GLU  41  -1.353  -8.407  -3.380
  303    HG2  GLU  41           2HG      GLU  41  -3.218  -8.403  -1.946
  304    HG3  GLU  41           3HG      GLU  41  -4.112  -9.527  -2.966
  305    H    SER  42           H        SER  42  -5.129  -7.418  -3.751
  306    HA   SER  42           HA       SER  42  -4.946  -4.585  -3.801
  307    HB2  SER  42           2HB      SER  42  -7.012  -4.651  -2.411
  308    HB3  SER  42           3HB      SER  42  -7.113  -5.665  -3.850
  309    HG   SER  42           HG       SER  42  -7.047  -7.444  -2.639
  310    H    LEU  43           H        LEU  43  -4.846  -3.102  -2.066
  311    HA   LEU  43           HA       LEU  43  -2.669  -3.390  -0.404
  312    HB2  LEU  43           2HB      LEU  43  -5.035  -1.548  -0.055
  313    HB3  LEU  43           3HB      LEU  43  -3.506  -1.377   0.787
  314    HG   LEU  43           HG       LEU  43  -3.924  -1.137  -2.200
  315   HD11  LEU  43          1HD1      LEU  43  -3.251   0.950  -0.128
  316   HD12  LEU  43          2HD1      LEU  43  -4.794   0.772  -0.964
  317   HD13  LEU  43          3HD1      LEU  43  -3.348   1.214  -1.870
  318   HD21  LEU  43          3HD2      LEU  43  -1.571  -0.441  -2.283
  319   HD22  LEU  43          1HD2      LEU  43  -1.744  -2.104  -1.722
  320   HD23  LEU  43          2HD2      LEU  43  -1.403  -0.815  -0.566
  321    H    GLU  44           H        GLU  44  -6.099  -3.864   0.507
  322    HA   GLU  44           HA       GLU  44  -5.598  -4.151   3.275
  323    HB2  GLU  44           2HB      GLU  44  -7.837  -3.673   2.360
  324    HB3  GLU  44           3HB      GLU  44  -7.905  -5.301   1.692
  325    HG2  GLU  44           2HG      GLU  44  -7.837  -6.256   3.920
  326    HG3  GLU  44           3HG      GLU  44  -7.648  -4.654   4.629
  327    H    GLN  45           H        GLN  45  -5.862  -6.613   0.712
  328    HA   GLN  45           HA       GLN  45  -5.666  -8.878   2.366
  329    HB2  GLN  45           2HB      GLN  45  -4.823  -8.472  -0.509
  330    HB3  GLN  45           3HB      GLN  45  -4.860 -10.041   0.288
  331    HG2  GLN  45           2HG      GLN  45  -7.245  -9.880   0.604
  332    HG3  GLN  45           3HG      GLN  45  -7.252  -8.235  -0.034
  333   HE21  GLN  45          1HE2      GLN  45  -8.700  -8.760  -1.650
  334   HE22  GLN  45          2HE2      GLN  45  -8.249  -9.702  -3.028
  335    H    GLY  46           H        GLY  46  -3.083  -7.177   0.561
  336    HA2  GLY  46           2HA      GLY  46  -0.923  -8.687   1.576
  337    HA3  GLY  46           3HA      GLY  46  -0.811  -7.067   0.910
  338    H    ALA  47           H        ALA  47  -2.492  -5.766   2.818
  339    HA   ALA  47           HA       ALA  47  -0.698  -5.163   4.891
  340    HB1  ALA  47           3HB      ALA  47  -2.457  -3.625   4.181
  341    HB2  ALA  47           1HB      ALA  47  -2.553  -3.932   5.917
  342    HB3  ALA  47           2HB      ALA  47  -3.685  -4.719   4.816
  343    H    ASN  48           H        ASN  48  -3.744  -7.059   5.073
  344    HA   ASN  48           HA       ASN  48  -3.341  -7.934   7.727
  345    HB2  ASN  48           2HB      ASN  48  -5.019  -9.049   5.480
  346    HB3  ASN  48           3HB      ASN  48  -4.981  -9.788   7.080
  347   HD21  ASN  48          1HD2      ASN  48  -6.166  -7.188   5.182
  348   HD22  ASN  48          2HD2      ASN  48  -7.126  -6.455   6.420
  349    H    ALA  49           H        ALA  49  -2.274  -9.289   4.641
  350    HA   ALA  49           HA       ALA  49  -1.280 -11.745   5.562
  351    HB1  ALA  49           3HB      ALA  49   0.130 -11.746   3.577
  352    HB2  ALA  49           1HB      ALA  49  -0.147 -10.017   3.357
  353    HB3  ALA  49           2HB      ALA  49  -1.484 -11.153   3.182
  354    H    HIS  50           H        HIS  50   0.030  -8.506   5.831
  355    HA   HIS  50           HA       HIS  50   2.445  -9.553   7.160
  356    HB2  HIS  50           2HB      HIS  50   1.778  -6.863   5.964
  357    HB3  HIS  50           3HB      HIS  50   3.148  -7.076   7.048
  358    HD1  HIS  50           HD1      HIS  50   5.208  -7.167   5.692
  359    HD2  HIS  50           HD2      HIS  50   2.076  -9.188   3.845
  360    HE1  HIS  50           HE1      HIS  50   6.180  -8.145   3.598
  361    HE2  HIS  50           HE2      HIS  50   4.321  -9.504   2.595
  362    H    GLY  51           H        GLY  51  -0.601  -8.639   8.009
  363    HA2  GLY  51           2HA      GLY  51  -1.541  -8.369  10.100
  364    HA3  GLY  51           3HA      GLY  51   0.069  -8.426  10.791
  365    H    LEU  52           H        LEU  52  -1.732  -6.190   8.650
  366    HA   LEU  52           HA       LEU  52  -1.024  -3.977  10.478
  367    HB2  LEU  52           2HB      LEU  52  -0.995  -3.833   7.458
  368    HB3  LEU  52           3HB      LEU  52  -0.592  -2.534   8.566
  369    HG   LEU  52           HG       LEU  52   0.985  -5.099   8.264
  370   HD11  LEU  52          1HD1      LEU  52   2.645  -3.726   7.136
  371   HD12  LEU  52          2HD1      LEU  52   1.586  -2.321   7.254
  372   HD13  LEU  52          3HD1      LEU  52   1.114  -3.704   6.265
  373   HD21  LEU  52          3HD2      LEU  52   1.588  -2.571   9.807
  374   HD22  LEU  52          1HD2      LEU  52   2.680  -3.943   9.605
  375   HD23  LEU  52          2HD2      LEU  52   1.173  -4.140  10.499
  376    H    ASN  53           H        ASN  53  -2.403  -2.031  10.185
  377    HA   ASN  53           HA       ASN  53  -5.156  -2.700   9.422
  378    HB2  ASN  53           2HB      ASN  53  -4.768  -1.543  11.589
  379    HB3  ASN  53           3HB      ASN  53  -4.055  -0.185  10.724
  380   HD21  ASN  53          1HD2      ASN  53  -6.303  -0.045  12.450
  381   HD22  ASN  53          2HD2      ASN  53  -7.654   0.469  11.506
  382    H    VAL  54           H        VAL  54  -5.661  -2.390   7.335
  383    HA   VAL  54           HA       VAL  54  -4.125  -0.947   5.495
  384    HB   VAL  54           HB       VAL  54  -5.684  -2.732   4.834
  385   HG11  VAL  54          1HG1      VAL  54  -7.552  -2.216   6.313
  386   HG12  VAL  54          2HG1      VAL  54  -8.092  -2.283   4.635
  387   HG13  VAL  54          3HG1      VAL  54  -7.865  -0.723   5.426
  388   HG21  VAL  54          3HG2      VAL  54  -4.890  -1.154   3.143
  389   HG22  VAL  54          1HG2      VAL  54  -6.248  -0.081   3.487
  390   HG23  VAL  54          2HG2      VAL  54  -6.536  -1.675   2.787
  391    H    GLU  55           H        GLU  55  -6.878   0.083   7.457
  392    HA   GLU  55           HA       GLU  55  -7.481   2.486   6.119
  393    HB2  GLU  55           2HB      GLU  55  -7.788   1.833   9.062
  394    HB3  GLU  55           3HB      GLU  55  -8.565   3.174   8.235
  395    HG2  GLU  55           2HG      GLU  55  -9.646   1.429   6.733
  396    HG3  GLU  55           3HG      GLU  55  -9.074   0.231   7.893
  397    H    ASP  56           H        ASP  56  -5.262   1.851   8.830
  398    HA   ASP  56           HA       ASP  56  -4.465   4.519   9.262
  399    HB2  ASP  56           2HB      ASP  56  -4.069   2.610  10.835
  400    HB3  ASP  56           3HB      ASP  56  -2.816   2.023   9.744
  401    H    ILE  57           H        ILE  57  -3.269   2.023   7.080
  402    HA   ILE  57           HA       ILE  57  -1.017   3.436   6.081
  403    HB   ILE  57           HB       ILE  57  -2.685   1.343   4.656
  404   HG12  ILE  57          2HG1      ILE  57  -0.214   0.978   6.376
  405   HG13  ILE  57          3HG1      ILE  57  -1.855   0.596   6.884
  406   HG21  ILE  57          1HG2      ILE  57  -1.192   2.565   3.153
  407   HG22  ILE  57          2HG2      ILE  57  -0.646   0.903   3.363
  408   HG23  ILE  57          3HG2      ILE  57   0.176   2.214   4.209
  409   HD11  ILE  57          3HD1      ILE  57  -1.999  -1.081   5.103
  410   HD12  ILE  57          1HD1      ILE  57  -0.675  -1.403   6.221
  411   HD13  ILE  57          2HD1      ILE  57  -0.340  -0.710   4.634
  412    H    LEU  58           H        LEU  58  -4.320   3.029   4.778
  413    HA   LEU  58           HA       LEU  58  -4.111   4.660   2.527
  414    HB2  LEU  58           2HB      LEU  58  -6.533   4.224   4.288
  415    HB3  LEU  58           3HB      LEU  58  -6.571   4.887   2.664
  416    HG   LEU  58           HG       LEU  58  -5.718   2.083   3.413
  417   HD11  LEU  58          1HD1      LEU  58  -8.183   3.068   1.974
  418   HD12  LEU  58          2HD1      LEU  58  -8.125   2.422   3.614
  419   HD13  LEU  58          3HD1      LEU  58  -7.742   1.381   2.245
  420   HD21  LEU  58          3HD2      LEU  58  -5.619   1.678   0.995
  421   HD22  LEU  58          1HD2      LEU  58  -4.451   2.899   1.501
  422   HD23  LEU  58          2HD2      LEU  58  -5.944   3.386   0.697
  423    H    ARG  59           H        ARG  59  -4.718   5.522   5.885
  424    HA   ARG  59           HA       ARG  59  -5.382   8.192   5.716
  425    HB2  ARG  59           2HB      ARG  59  -5.306   7.156   7.853
  426    HB3  ARG  59           3HB      ARG  59  -3.621   6.699   7.657
  427    HG2  ARG  59           2HG      ARG  59  -3.112   9.204   7.658
  428    HG3  ARG  59           3HG      ARG  59  -4.765   9.418   8.244
  429    HD2  ARG  59           2HD      ARG  59  -3.052   9.321  10.058
  430    HD3  ARG  59           3HD      ARG  59  -4.310   8.091  10.196
  431    HE   ARG  59           HE       ARG  59  -2.688   6.496   9.269
  432   HH11  ARG  59          1HH1      ARG  59  -1.439   9.418  10.623
  433   HH12  ARG  59          2HH1      ARG  59   0.116   8.725  10.928
  434   HH21  ARG  59          1HH2      ARG  59  -0.697   5.636   9.680
  435   HH22  ARG  59          2HH2      ARG  59   0.531   6.630  10.387
  436    H    ASP  60           H        ASP  60  -2.064   6.864   5.819
  437    HA   ASP  60           HA       ASP  60  -0.809   9.397   5.432
  438    HB2  ASP  60           2HB      ASP  60   0.161   7.282   6.530
  439    HB3  ASP  60           3HB      ASP  60   0.465   6.708   4.894
  440    H    LEU  61           H        LEU  61  -1.544   6.663   3.284
  441    HA   LEU  61           HA       LEU  61  -0.230   7.513   0.977
  442    HB2  LEU  61           2HB      LEU  61  -2.829   5.981   1.170
  443    HB3  LEU  61           3HB      LEU  61  -1.831   6.101  -0.267
  444    HG   LEU  61           HG       LEU  61  -1.080   4.743   2.327
  445   HD11  LEU  61          1HD1      LEU  61  -2.673   3.477   0.994
  446   HD12  LEU  61          2HD1      LEU  61  -1.089   2.704   0.969
  447   HD13  LEU  61          3HD1      LEU  61  -1.637   3.634  -0.427
  448   HD21  LEU  61          3HD2      LEU  61   0.877   5.809   1.339
  449   HD22  LEU  61          1HD2      LEU  61   0.525   5.048  -0.214
  450   HD23  LEU  61          2HD2      LEU  61   0.969   4.057   1.176
  451    H    ASN  62           H        ASN  62  -3.659   8.127   1.857
  452    HA   ASN  62           HA       ASN  62  -4.106   9.831  -0.393
  453    HB2  ASN  62           2HB      ASN  62  -5.667   9.462   2.171
  454    HB3  ASN  62           3HB      ASN  62  -6.182  10.543   0.879
  455   HD21  ASN  62          1HD2      ASN  62  -5.909   7.274   1.912
  456   HD22  ASN  62          2HD2      ASN  62  -6.730   6.561   0.574
  457    H    ALA  63           H        ALA  63  -2.852  10.363   2.822
  458    HA   ALA  63           HA       ALA  63  -3.038  13.186   2.894
  459    HB1  ALA  63           3HB      ALA  63  -2.519  11.831   4.878
  460    HB2  ALA  63           1HB      ALA  63  -1.315  13.094   4.616
  461    HB3  ALA  63           2HB      ALA  63  -0.951  11.424   4.182
  462    H    LEU  64           H        LEU  64  -0.786  11.005   1.309
  463    HA   LEU  64           HA       LEU  64   1.213  12.867   0.582
  464    HB2  LEU  64           2HB      LEU  64   0.250  10.406  -0.892
  465    HB3  LEU  64           3HB      LEU  64   1.729  11.274  -1.259
  466    HG   LEU  64           HG       LEU  64   1.173   9.898   1.376
  467   HD11  LEU  64          1HD1      LEU  64   2.719   8.168   0.615
  468   HD12  LEU  64          2HD1      LEU  64   2.840   8.958  -0.959
  469   HD13  LEU  64          3HD1      LEU  64   1.303   8.268  -0.432
  470   HD21  LEU  64          3HD2      LEU  64   3.710  11.086   0.235
  471   HD22  LEU  64          1HD2      LEU  64   3.582  10.192   1.752
  472   HD23  LEU  64          2HD2      LEU  64   2.759  11.740   1.570
  473    H    ALA  65           H        ALA  65  -1.971  12.234  -0.702
  474    HA   ALA  65           HA       ALA  65  -1.542  13.832  -3.101
  475    HB1  ALA  65           3HB      ALA  65  -4.058  12.520  -2.058
  476    HB2  ALA  65           1HB      ALA  65  -2.933  11.818  -3.222
  477    HB3  ALA  65           2HB      ALA  65  -3.855  13.261  -3.646
  478    H    LEU  66           H        LEU  66  -3.530  14.015  -0.155
  479    HA   LEU  66           HA       LEU  66  -4.638  16.578  -0.728
  480    HB2  LEU  66           2HB      LEU  66  -4.412  15.097   1.901
  481    HB3  LEU  66           3HB      LEU  66  -5.408  16.513   1.620
  482    HG   LEU  66           HG       LEU  66  -5.768  13.826   0.277
  483   HD11  LEU  66          1HD1      LEU  66  -7.391  15.182   2.432
  484   HD12  LEU  66          2HD1      LEU  66  -6.376  13.752   2.631
  485   HD13  LEU  66          3HD1      LEU  66  -7.816  13.678   1.615
  486   HD21  LEU  66          3HD2      LEU  66  -7.428  16.345   0.108
  487   HD22  LEU  66          1HD2      LEU  66  -7.856  14.782  -0.588
  488   HD23  LEU  66          2HD2      LEU  66  -6.444  15.655  -1.183
  489    H    GLU  67           H        GLU  67  -1.817  15.509   1.067
  490    HA   GLU  67           HA       GLU  67  -0.069  16.559   2.039
  491    HB2  GLU  67           2HB      GLU  67  -0.696  18.563  -0.131
  492    HB3  GLU  67           3HB      GLU  67   0.768  18.597   0.845
  493    HG2  GLU  67           2HG      GLU  67   1.232  16.255   0.033
  494    HG3  GLU  67           3HG      GLU  67  -0.093  16.475  -1.108
  495    H    HIS  68           H        HIS  68  -2.576  17.129   3.389
  496    HA   HIS  68           HA       HIS  68  -2.363  19.871   4.299
  497    HB2  HIS  68           2HB      HIS  68  -4.043  17.530   5.217
  498    HB3  HIS  68           3HB      HIS  68  -4.031  19.067   6.075
  499    HD1  HIS  68           HD1      HIS  68  -5.521  20.871   5.194
  500    HD2  HIS  68           HD2      HIS  68  -5.073  17.739   2.505
  501    HE1  HIS  68           HE1      HIS  68  -7.164  21.328   3.354
  502    HE2  HIS  68           HE2      HIS  68  -6.812  19.470   1.692
  503    H    HIS  69           H        HIS  69  -0.219  20.024   5.030
  504    HA   HIS  69           HA       HIS  69   0.367  18.561   7.538
  505    HB2  HIS  69           2HB      HIS  69   2.340  19.562   5.466
  506    HB3  HIS  69           3HB      HIS  69   2.761  18.764   6.978
  507    HD1  HIS  69           HD1      HIS  69   2.410  18.036   3.527
  508    HD2  HIS  69           HD2      HIS  69   1.463  16.021   7.029
  509    HE1  HIS  69           HE1      HIS  69   2.187  15.626   2.872
  510    HE2  HIS  69           HE2      HIS  69   1.907  14.413   5.052
  511    H    HIS  70           H        HIS  70   0.160  19.902   9.232
  512    HA   HIS  70           HA       HIS  70   1.388  22.567   9.087
  513    HB2  HIS  70           2HB      HIS  70  -1.483  21.987   9.753
  514    HB3  HIS  70           3HB      HIS  70  -0.679  23.397  10.440
  515    HD1  HIS  70           HD1      HIS  70  -2.255  22.163   7.345
  516    HD2  HIS  70           HD2      HIS  70   0.197  25.314   8.488
  517    HE1  HIS  70           HE1      HIS  70  -2.326  23.793   5.442
  518    HE2  HIS  70           HE2      HIS  70  -0.969  25.760   6.225
  519    H    HIS  71           H        HIS  71   2.162  20.065  10.395
  520    HA   HIS  71           HA       HIS  71   2.749  21.335  12.972
  521    HB2  HIS  71           2HB      HIS  71   1.685  18.551  12.595
  522    HB3  HIS  71           3HB      HIS  71   2.758  18.906  13.943
  523    HD1  HIS  71           HD1      HIS  71  -0.424  18.186  13.946
  524    HD2  HIS  71           HD2      HIS  71   1.383  21.846  14.728
  525    HE1  HIS  71           HE1      HIS  71  -2.063  19.459  15.353
  526    HE2  HIS  71           HE2      HIS  71  -0.949  21.664  15.824
  527    H    HIS  72           H        HIS  72   4.854  21.386  13.415
  528    HA   HIS  72           HA       HIS  72   6.745  20.291  11.564
  529    HB2  HIS  72           2HB      HIS  72   7.113  22.456  12.679
  530    HB3  HIS  72           3HB      HIS  72   7.194  21.644  14.240
  531    HD1  HIS  72           HD1      HIS  72   9.092  21.952  10.993
  532    HD2  HIS  72           HD2      HIS  72   9.678  20.625  14.888
  533    HE1  HIS  72           HE1      HIS  72  11.552  21.497  11.186
  534    HE2  HIS  72           HE2      HIS  72  11.904  20.902  13.601
  535    H    HIS  73           H        HIS  73   6.839  18.090  11.576
  536    HA   HIS  73           HA       HIS  73   6.695  16.480  13.919
  537    HB2  HIS  73           2HB      HIS  73   6.064  15.730  11.603
  538    HB3  HIS  73           3HB      HIS  73   7.779  15.667  11.208
  539    HD1  HIS  73           HD1      HIS  73   9.203  13.815  12.478
  540    HD2  HIS  73           HD2      HIS  73   5.088  13.561  13.001
  541    HE1  HIS  73           HE1      HIS  73   8.783  11.527  13.416
  542    HE2  HIS  73           HE2      HIS  73   6.282  11.346  13.592
  Start of MODEL   13
    1    H1   MET   1           1H       MET   1 -17.667  10.081  -5.270
    2    H2   MET   1           2H       MET   1 -18.238  11.307  -4.256
    3    H3   MET   1           3H       MET   1 -18.024   9.739  -3.651
    4    HA   MET   1           HA       MET   1 -15.871  11.526  -4.632
    5    HB2  MET   1           2HB      MET   1 -16.805  12.292  -2.503
    6    HB3  MET   1           3HB      MET   1 -16.610  10.687  -1.815
    7    HG2  MET   1           2HG      MET   1 -14.873  12.274  -1.088
    8    HG3  MET   1           3HG      MET   1 -14.214  10.870  -1.926
    9    HE1  MET   1           3HE      MET   1 -14.594  15.070  -3.827
   10    HE2  MET   1           1HE      MET   1 -15.093  14.689  -2.180
   11    HE3  MET   1           2HE      MET   1 -15.993  14.035  -3.548
   12    H    THR   2           H        THR   2 -13.946  10.570  -5.021
   13    HA   THR   2           HA       THR   2 -13.627   7.727  -4.259
   14    HB   THR   2           HB       THR   2 -14.059   7.711  -6.604
   15    HG1  THR   2           HG1      THR   2 -12.464   6.289  -6.463
   16   HG21  THR   2          3HG2      THR   2 -11.906   9.815  -6.913
   17   HG22  THR   2          1HG2      THR   2 -13.640  10.077  -7.102
   18   HG23  THR   2          2HG2      THR   2 -12.778   9.029  -8.230
   19    H    GLN   3           H        GLN   3 -11.937   7.372  -2.990
   20    HA   GLN   3           HA       GLN   3  -9.947   9.369  -2.485
   21    HB2  GLN   3           2HB      GLN   3 -10.006   6.466  -1.607
   22    HB3  GLN   3           3HB      GLN   3  -8.932   7.706  -0.978
   23    HG2  GLN   3           2HG      GLN   3 -10.640   7.418   0.620
   24    HG3  GLN   3           3HG      GLN   3 -10.975   8.942  -0.195
   25   HE21  GLN   3          1HE2      GLN   3 -11.645   5.787  -1.584
   26   HE22  GLN   3          2HE2      GLN   3 -13.363   5.935  -1.540
   27    H    LYS   4           H        LYS   4  -7.825   9.468  -3.151
   28    HA   LYS   4           HA       LYS   4  -7.068   8.267  -5.578
   29    HB2  LYS   4           2HB      LYS   4  -5.400   9.595  -3.437
   30    HB3  LYS   4           3HB      LYS   4  -4.751   9.087  -4.988
   31    HG2  LYS   4           2HG      LYS   4  -6.951  11.120  -4.593
   32    HG3  LYS   4           3HG      LYS   4  -5.258  11.487  -4.921
   33    HD2  LYS   4           2HD      LYS   4  -6.095  11.626  -7.053
   34    HD3  LYS   4           3HD      LYS   4  -5.683   9.913  -7.015
   35    HE2  LYS   4           2HE      LYS   4  -8.098   9.520  -6.266
   36    HE3  LYS   4           3HE      LYS   4  -8.396  11.191  -6.729
   37    HZ1  LYS   4           3HZ      LYS   4  -7.727  10.684  -8.967
   38    HZ2  LYS   4           1HZ      LYS   4  -8.937   9.605  -8.489
   39    HZ3  LYS   4           2HZ      LYS   4  -7.327   9.097  -8.538
   40    H    PHE   5           H        PHE   5  -6.591   7.222  -2.265
   41    HA   PHE   5           HA       PHE   5  -5.453   4.705  -3.299
   42    HB2  PHE   5           2HB      PHE   5  -4.542   6.145  -0.791
   43    HB3  PHE   5           3HB      PHE   5  -3.960   4.577  -1.345
   44    HD1  PHE   5           HD1      PHE   5  -2.829   4.477  -3.640
   45    HD2  PHE   5           HD2      PHE   5  -3.506   8.111  -1.524
   46    HE1  PHE   5           HE1      PHE   5  -1.117   5.589  -5.007
   47    HE2  PHE   5           HE2      PHE   5  -1.789   9.227  -2.890
   48    HZ   PHE   5           HZ       PHE   5  -0.595   7.966  -4.636
   49    H    THR   6           H        THR   6  -6.591   2.986  -2.735
   50    HA   THR   6           HA       THR   6  -8.023   2.925  -0.166
   51    HB   THR   6           HB       THR   6  -9.753   3.590  -1.737
   52    HG1  THR   6           HG1      THR   6 -11.024   2.223  -0.736
   53   HG21  THR   6          3HG2      THR   6 -10.356   2.163  -3.660
   54   HG22  THR   6          1HG2      THR   6  -8.953   1.145  -3.335
   55   HG23  THR   6          2HG2      THR   6  -8.730   2.826  -3.818
   56    H    LYS   7           H        LYS   7  -8.834   0.703   0.345
   57    HA   LYS   7           HA       LYS   7  -6.719  -1.170   0.161
   58    HB2  LYS   7           2HB      LYS   7  -8.279  -2.708   1.308
   59    HB3  LYS   7           3HB      LYS   7  -8.198  -1.128   2.076
   60    HG2  LYS   7           2HG      LYS   7 -10.304  -0.493   0.988
   61    HG3  LYS   7           3HG      LYS   7 -10.388  -2.086   0.231
   62    HD2  LYS   7           2HD      LYS   7 -11.806  -1.976   2.224
   63    HD3  LYS   7           3HD      LYS   7 -10.496  -3.136   2.439
   64    HE2  LYS   7           2HE      LYS   7  -9.228  -1.426   3.699
   65    HE3  LYS   7           3HE      LYS   7 -10.595  -0.321   3.533
   66    HZ1  LYS   7           3HZ      LYS   7 -10.639  -2.947   4.922
   67    HZ2  LYS   7           1HZ      LYS   7 -11.957  -1.896   4.760
   68    HZ3  LYS   7           2HZ      LYS   7 -10.613  -1.424   5.671
   69    H    ASP   8           H        ASP   8  -9.488  -0.597  -1.825
   70    HA   ASP   8           HA       ASP   8  -9.812  -3.147  -2.992
   71    HB2  ASP   8           2HB      ASP   8 -11.509  -1.357  -3.072
   72    HB3  ASP   8           3HB      ASP   8 -10.459  -0.414  -4.125
   73    H    MET   9           H        MET   9  -7.860  -0.343  -3.976
   74    HA   MET   9           HA       MET   9  -7.055  -1.499  -6.475
   75    HB2  MET   9           2HB      MET   9  -5.568   0.453  -6.656
   76    HB3  MET   9           3HB      MET   9  -7.206   0.916  -6.220
   77    HG2  MET   9           2HG      MET   9  -6.397   0.954  -3.817
   78    HG3  MET   9           3HG      MET   9  -4.766   0.855  -4.475
   79    HE1  MET   9           3HE      MET   9  -3.710   2.692  -6.072
   80    HE2  MET   9           1HE      MET   9  -4.526   4.182  -6.542
   81    HE3  MET   9           2HE      MET   9  -5.086   2.635  -7.174
   82    H    THR  10           H        THR  10  -4.880  -2.084  -7.086
   83    HA   THR  10           HA       THR  10  -3.629  -3.740  -5.066
   84    HB   THR  10           HB       THR  10  -2.265  -4.647  -6.842
   85    HG1  THR  10           HG1      THR  10  -2.446  -3.734  -8.977
   86   HG21  THR  10          3HG2      THR  10  -5.081  -4.181  -7.841
   87   HG22  THR  10          1HG2      THR  10  -4.582  -5.460  -6.734
   88   HG23  THR  10          2HG2      THR  10  -3.988  -5.449  -8.395
   89    H    PHE  11           H        PHE  11  -1.278  -3.794  -4.740
   90    HA   PHE  11           HA       PHE  11  -0.141  -1.377  -3.977
   91    HB2  PHE  11           2HB      PHE  11   1.171  -4.003  -4.699
   92    HB3  PHE  11           3HB      PHE  11   2.064  -2.639  -4.041
   93    HD1  PHE  11           HD1      PHE  11  -0.445  -5.229  -3.296
   94    HD2  PHE  11           HD2      PHE  11   1.866  -2.014  -1.725
   95    HE1  PHE  11           HE1      PHE  11  -1.006  -5.946  -1.011
   96    HE2  PHE  11           HE2      PHE  11   1.308  -2.732   0.559
   97    HZ   PHE  11           HZ       PHE  11  -0.131  -4.696   0.921
   98    H    ALA  12           H        ALA  12   0.297  -3.146  -7.039
   99    HA   ALA  12           HA       ALA  12   2.220  -1.506  -8.225
  100    HB1  ALA  12           3HB      ALA  12   1.456  -2.399 -10.361
  101    HB2  ALA  12           1HB      ALA  12  -0.033  -2.972  -9.607
  102    HB3  ALA  12           2HB      ALA  12   1.517  -3.675  -9.145
  103    H    GLN  13           H        GLN  13  -1.338  -1.258  -8.399
  104    HA   GLN  13           HA       GLN  13  -1.500   1.010 -10.029
  105    HB2  GLN  13           2HB      GLN  13  -3.366   0.178  -7.792
  106    HB3  GLN  13           3HB      GLN  13  -3.747   1.353  -9.044
  107    HG2  GLN  13           2HG      GLN  13  -3.532  -0.389 -10.747
  108    HG3  GLN  13           3HG      GLN  13  -3.146  -1.567  -9.495
  109   HE21  GLN  13          1HE2      GLN  13  -5.548   0.972  -9.176
  110   HE22  GLN  13          2HE2      GLN  13  -6.917  -0.079  -9.130
  111    H    ALA  14           H        ALA  14  -1.356   0.795  -6.475
  112    HA   ALA  14           HA       ALA  14  -1.515   3.525  -5.888
  113    HB1  ALA  14           3HB      ALA  14  -1.698   1.752  -4.204
  114    HB2  ALA  14           1HB      ALA  14  -0.498   2.960  -3.746
  115    HB3  ALA  14           2HB      ALA  14   0.021   1.401  -4.388
  116    H    LEU  15           H        LEU  15   1.388   1.515  -6.406
  117    HA   LEU  15           HA       LEU  15   3.309   3.546  -6.079
  118    HB2  LEU  15           2HB      LEU  15   3.446   1.009  -7.722
  119    HB3  LEU  15           3HB      LEU  15   4.829   2.011  -7.319
  120    HG   LEU  15           HG       LEU  15   3.094   0.564  -5.307
  121   HD11  LEU  15          1HD1      LEU  15   4.401  -1.000  -6.647
  122   HD12  LEU  15          2HD1      LEU  15   5.008  -0.918  -4.994
  123   HD13  LEU  15          3HD1      LEU  15   5.872  -0.094  -6.293
  124   HD21  LEU  15          3HD2      LEU  15   4.058   2.603  -4.395
  125   HD22  LEU  15          1HD2      LEU  15   5.660   2.117  -4.951
  126   HD23  LEU  15          2HD2      LEU  15   4.839   1.184  -3.698
  127    H    GLN  16           H        GLN  16   1.508   2.504  -8.941
  128    HA   GLN  16           HA       GLN  16   2.932   4.216 -10.758
  129    HB2  GLN  16           2HB      GLN  16   0.331   2.704 -10.992
  130    HB3  GLN  16           3HB      GLN  16   0.990   3.678 -12.301
  131    HG2  GLN  16           2HG      GLN  16   2.377   1.324 -11.018
  132    HG3  GLN  16           3HG      GLN  16   1.492   1.282 -12.542
  133   HE21  GLN  16          1HE2      GLN  16   4.389   2.336 -10.944
  134   HE22  GLN  16          2HE2      GLN  16   5.261   2.754 -12.374
  135    H    THR  17           H        THR  17   0.201   4.635  -8.642
  136    HA   THR  17           HA       THR  17  -0.842   6.981  -9.917
  137    HB   THR  17           HB       THR  17  -1.229   6.018  -7.066
  138    HG1  THR  17           HG1      THR  17  -2.079   4.586  -8.631
  139   HG21  THR  17          3HG2      THR  17  -1.714   8.416  -7.263
  140   HG22  THR  17          1HG2      THR  17  -3.201   7.492  -7.041
  141   HG23  THR  17          2HG2      THR  17  -2.769   8.098  -8.640
  142    H    HIS  18           H        HIS  18   1.101   6.519  -6.936
  143    HA   HIS  18           HA       HIS  18   2.529   8.997  -7.548
  144    HB2  HIS  18           2HB      HIS  18   1.093   8.559  -4.918
  145    HB3  HIS  18           3HB      HIS  18   2.328   9.790  -5.168
  146    HD1  HIS  18           HD1      HIS  18   1.363  10.829  -7.951
  147    HD2  HIS  18           HD2      HIS  18  -1.090  10.164  -4.673
  148    HE1  HIS  18           HE1      HIS  18  -0.644  12.291  -8.303
  149    HE2  HIS  18           HE2      HIS  18  -2.008  12.024  -6.213
  150    HA   PRO  19           HA       PRO  19   5.968   6.424  -6.475
  151    HB2  PRO  19           2HB      PRO  19   7.373   8.971  -5.862
  152    HB3  PRO  19           3HB      PRO  19   7.790   7.705  -7.023
  153    HG2  PRO  19           2HG      PRO  19   6.813  10.043  -7.855
  154    HG3  PRO  19           3HG      PRO  19   6.338   8.524  -8.642
  155    HD2  PRO  19           2HD      PRO  19   4.818  10.178  -6.643
  156    HD3  PRO  19           3HD      PRO  19   4.232   9.365  -8.110
  157    H    GLY  20           H        GLY  20   5.072   9.051  -4.268
  158    HA2  GLY  20           2HA      GLY  20   6.688   8.460  -2.084
  159    HA3  GLY  20           3HA      GLY  20   5.117   9.233  -1.979
  160    H    VAL  21           H        VAL  21   3.902   6.713  -3.195
  161    HA   VAL  21           HA       VAL  21   2.997   5.493  -0.867
  162    HB   VAL  21           HB       VAL  21   3.151   4.306  -3.649
  163   HG11  VAL  21          1HG1      VAL  21   2.790   2.552  -1.992
  164   HG12  VAL  21          2HG1      VAL  21   1.325   2.826  -2.935
  165   HG13  VAL  21          3HG1      VAL  21   1.451   3.466  -1.296
  166   HG21  VAL  21          3HG2      VAL  21   0.842   5.078  -3.873
  167   HG22  VAL  21          1HG2      VAL  21   1.936   6.425  -3.560
  168   HG23  VAL  21          2HG2      VAL  21   0.918   5.797  -2.263
  169    H    ALA  22           H        ALA  22   5.768   4.656  -2.893
  170    HA   ALA  22           HA       ALA  22   6.406   2.150  -1.840
  171    HB1  ALA  22           3HB      ALA  22   8.665   2.537  -2.669
  172    HB2  ALA  22           1HB      ALA  22   8.328   4.261  -2.826
  173    HB3  ALA  22           2HB      ALA  22   7.470   3.099  -3.838
  174    H    GLY  23           H        GLY  23   7.297   5.381  -0.674
  175    HA2  GLY  23           2HA      GLY  23   9.005   4.553   1.428
  176    HA3  GLY  23           3HA      GLY  23   8.181   6.102   1.321
  177    H    VAL  24           H        VAL  24   5.529   5.325   1.391
  178    HA   VAL  24           HA       VAL  24   5.028   4.939   4.135
  179    HB   VAL  24           HB       VAL  24   3.112   4.450   1.839
  180   HG11  VAL  24          1HG1      VAL  24   2.291   3.552   3.959
  181   HG12  VAL  24          2HG1      VAL  24   1.361   4.974   3.486
  182   HG13  VAL  24          3HG1      VAL  24   2.589   5.103   4.746
  183   HG21  VAL  24          3HG2      VAL  24   4.112   6.679   1.691
  184   HG22  VAL  24          1HG2      VAL  24   3.676   6.996   3.372
  185   HG23  VAL  24          2HG2      VAL  24   2.415   6.784   2.159
  186    H    LEU  25           H        LEU  25   4.749   2.665   1.399
  187    HA   LEU  25           HA       LEU  25   3.853   0.423   2.805
  188    HB2  LEU  25           2HB      LEU  25   5.657   0.526   0.378
  189    HB3  LEU  25           3HB      LEU  25   4.813  -0.906   0.943
  190    HG   LEU  25           HG       LEU  25   3.508   1.625  -0.087
  191   HD11  LEU  25          1HD1      LEU  25   2.804   0.241  -1.973
  192   HD12  LEU  25          2HD1      LEU  25   3.710  -1.125  -1.319
  193   HD13  LEU  25          3HD1      LEU  25   4.562   0.324  -1.859
  194   HD21  LEU  25          3HD2      LEU  25   2.255  -0.975   0.808
  195   HD22  LEU  25          1HD2      LEU  25   1.407   0.384   0.068
  196   HD23  LEU  25          2HD2      LEU  25   2.157   0.570   1.653
  197    H    ARG  26           H        ARG  26   7.230   1.271   1.950
  198    HA   ARG  26           HA       ARG  26   8.495  -0.787   3.361
  199    HB2  ARG  26           2HB      ARG  26   9.446   2.024   2.759
  200    HB3  ARG  26           3HB      ARG  26  10.483   0.760   3.412
  201    HG2  ARG  26           2HG      ARG  26  10.101  -0.595   1.410
  202    HG3  ARG  26           3HG      ARG  26   9.049   0.664   0.758
  203    HD2  ARG  26           2HD      ARG  26  11.301   0.775  -0.204
  204    HD3  ARG  26           3HD      ARG  26  10.911   2.230   0.713
  205    HE   ARG  26           HE       ARG  26  12.290   0.310   2.308
  206   HH11  ARG  26          1HH1      ARG  26  12.757   2.728  -0.098
  207   HH12  ARG  26          2HH1      ARG  26  14.380   3.065   0.392
  208   HH21  ARG  26          1HH2      ARG  26  14.372   0.758   2.945
  209   HH22  ARG  26          2HH2      ARG  26  15.288   1.953   2.097
  210    H    SER  27           H        SER  27   7.424   2.398   4.466
  211    HA   SER  27           HA       SER  27   8.510   2.346   7.057
  212    HB2  SER  27           2HB      SER  27   7.546   4.374   6.018
  213    HB3  SER  27           3HB      SER  27   5.936   3.669   6.139
  214    HG   SER  27           HG       SER  27   5.916   4.613   8.023
  215    H    TYR  28           H        TYR  28   5.646   0.812   5.745
  216    HA   TYR  28           HA       TYR  28   4.886  -0.129   8.437
  217    HB2  TYR  28           2HB      TYR  28   3.307   0.273   5.908
  218    HB3  TYR  28           3HB      TYR  28   2.711  -0.798   7.172
  219    HD1  TYR  28           HD1      TYR  28   2.253   0.134   9.453
  220    HD2  TYR  28           HD2      TYR  28   3.108   2.647   6.120
  221    HE1  TYR  28           HE1      TYR  28   1.289   2.047  10.654
  222    HE2  TYR  28           HE2      TYR  28   2.149   4.569   7.324
  223    HH   TYR  28           HH       TYR  28   0.339   4.804   9.277
  224    H    ASN  29           H        ASN  29   7.077  -1.372   6.958
  225    HA   ASN  29           HA       ASN  29   7.910  -3.488   6.787
  226    HB2  ASN  29           2HB      ASN  29   6.706  -3.866   8.892
  227    HB3  ASN  29           3HB      ASN  29   5.249  -4.277   8.007
  228   HD21  ASN  29          1HD2      ASN  29   8.496  -5.306   8.785
  229   HD22  ASN  29          2HD2      ASN  29   8.251  -6.975   8.428
  230    H    LEU  30           H        LEU  30   5.730  -2.326   4.772
  231    HA   LEU  30           HA       LEU  30   5.149  -4.790   3.296
  232    HB2  LEU  30           2HB      LEU  30   4.304  -1.923   2.856
  233    HB3  LEU  30           3HB      LEU  30   3.860  -3.244   1.790
  234    HG   LEU  30           HG       LEU  30   3.126  -3.118   4.722
  235   HD11  LEU  30          1HD1      LEU  30   0.883  -2.523   4.003
  236   HD12  LEU  30          2HD1      LEU  30   1.409  -2.490   2.321
  237   HD13  LEU  30          3HD1      LEU  30   2.044  -1.309   3.464
  238   HD21  LEU  30          3HD2      LEU  30   3.243  -5.387   3.804
  239   HD22  LEU  30          1HD2      LEU  30   2.151  -4.920   2.499
  240   HD23  LEU  30          2HD2      LEU  30   1.581  -4.925   4.168
  241    H    GLY  31           H        GLY  31   7.906  -3.561   3.548
  242    HA2  GLY  31           2HA      GLY  31   8.566  -2.628   0.894
  243    HA3  GLY  31           3HA      GLY  31   9.701  -3.000   2.182
  244    H    CYS  32           H        CYS  32   7.900  -5.673   2.080
  245    HA   CYS  32           HA       CYS  32   9.731  -7.041   0.227
  246    HB2  CYS  32           2HB      CYS  32   9.575  -7.846   2.581
  247    HB3  CYS  32           3HB      CYS  32   7.882  -8.241   2.304
  248    HG   CYS  32           HG       CYS  32   8.231 -10.471   0.977
  249    H    ILE  33           H        ILE  33   7.045  -5.540  -0.336
  250    HA   ILE  33           HA       ILE  33   5.107  -7.349  -1.202
  251    HB   ILE  33           HB       ILE  33   4.383  -5.549  -2.810
  252   HG12  ILE  33          2HG1      ILE  33   6.698  -4.032  -1.566
  253   HG13  ILE  33          3HG1      ILE  33   6.616  -4.576  -3.237
  254   HG21  ILE  33          1HG2      ILE  33   3.482  -5.700  -0.563
  255   HG22  ILE  33          2HG2      ILE  33   3.660  -4.013  -1.041
  256   HG23  ILE  33          3HG2      ILE  33   4.824  -4.745   0.064
  257   HD11  ILE  33          3HD1      ILE  33   6.116  -2.204  -3.029
  258   HD12  ILE  33          1HD1      ILE  33   4.769  -2.576  -1.953
  259   HD13  ILE  33          2HD1      ILE  33   4.725  -3.102  -3.638
  260    H    GLY  34           H        GLY  34   8.012  -6.224  -2.873
  261    HA2  GLY  34           2HA      GLY  34   7.409  -7.334  -5.417
  262    HA3  GLY  34           3HA      GLY  34   9.011  -6.919  -4.830
  263    H    CYS  35           H        CYS  35   8.915  -8.723  -2.543
  264    HA   CYS  35           HA       CYS  35   9.768 -11.128  -3.874
  265    HB2  CYS  35           2HB      CYS  35  10.950 -10.290  -1.899
  266    HB3  CYS  35           3HB      CYS  35   9.505 -10.521  -0.922
  267    HG   CYS  35           HG       CYS  35  11.392 -12.986  -2.367
  268    H    MET  36           H        MET  36   6.918 -10.180  -2.022
  269    HA   MET  36           HA       MET  36   5.890 -12.918  -2.041
  270    HB2  MET  36           2HB      MET  36   4.014 -12.017  -0.724
  271    HB3  MET  36           3HB      MET  36   5.571 -11.624  -0.008
  272    HG2  MET  36           2HG      MET  36   5.430  -9.365  -0.894
  273    HG3  MET  36           3HG      MET  36   3.897  -9.751  -1.672
  274    HE1  MET  36           3HE      MET  36   2.417 -11.519   0.524
  275    HE2  MET  36           1HE      MET  36   1.644 -10.213  -0.376
  276    HE3  MET  36           2HE      MET  36   1.515 -10.273   1.383
  277    H    GLY  37           H        GLY  37   6.035 -10.709  -4.383
  278    HA2  GLY  37           2HA      GLY  37   4.900 -10.418  -6.365
  279    HA3  GLY  37           3HA      GLY  37   3.989 -11.862  -5.962
  280    H    ALA  38           H        ALA  38   3.974  -9.032  -3.897
  281    HA   ALA  38           HA       ALA  38   1.107  -8.983  -3.958
  282    HB1  ALA  38           3HB      ALA  38   2.324  -8.607  -1.888
  283    HB2  ALA  38           1HB      ALA  38   1.298  -7.226  -2.272
  284    HB3  ALA  38           2HB      ALA  38   3.038  -7.140  -2.556
  285    H    GLN  39           H        GLN  39   3.183  -7.725  -6.166
  286    HA   GLN  39           HA       GLN  39   2.375  -5.082  -6.567
  287    HB2  GLN  39           2HB      GLN  39   3.155  -7.156  -8.624
  288    HB3  GLN  39           3HB      GLN  39   3.030  -5.432  -8.945
  289    HG2  GLN  39           2HG      GLN  39   4.932  -6.715  -6.983
  290    HG3  GLN  39           3HG      GLN  39   5.347  -6.152  -8.601
  291   HE21  GLN  39          1HE2      GLN  39   4.515  -5.187  -5.362
  292   HE22  GLN  39          2HE2      GLN  39   4.982  -3.535  -5.528
  293    H    ASN  40           H        ASN  40   0.925  -8.075  -7.808
  294    HA   ASN  40           HA       ASN  40  -1.310  -6.607  -9.004
  295    HB2  ASN  40           2HB      ASN  40  -0.760  -9.587  -8.951
  296    HB3  ASN  40           3HB      ASN  40  -1.955  -8.761  -9.950
  297   HD21  ASN  40          1HD2      ASN  40   0.421 -10.428 -10.601
  298   HD22  ASN  40          2HD2      ASN  40   1.334  -9.468 -11.707
  299    H    GLU  41           H        GLU  41  -0.818  -6.979  -6.011
  300    HA   GLU  41           HA       GLU  41  -3.320  -8.366  -5.270
  301    HB2  GLU  41           2HB      GLU  41  -1.263  -9.450  -4.462
  302    HB3  GLU  41           3HB      GLU  41  -0.780  -7.957  -3.672
  303    HG2  GLU  41           2HG      GLU  41  -2.585  -8.123  -2.107
  304    HG3  GLU  41           3HG      GLU  41  -3.278  -9.489  -2.982
  305    H    SER  42           H        SER  42  -4.731  -7.373  -3.816
  306    HA   SER  42           HA       SER  42  -4.764  -4.522  -3.844
  307    HB2  SER  42           2HB      SER  42  -6.487  -6.483  -2.301
  308    HB3  SER  42           3HB      SER  42  -6.794  -4.750  -2.406
  309    HG   SER  42           HG       SER  42  -7.522  -4.984  -4.374
  310    H    LEU  43           H        LEU  43  -4.686  -3.057  -2.100
  311    HA   LEU  43           HA       LEU  43  -2.472  -3.288  -0.459
  312    HB2  LEU  43           2HB      LEU  43  -4.892  -1.519  -0.119
  313    HB3  LEU  43           3HB      LEU  43  -3.400  -1.325   0.786
  314    HG   LEU  43           HG       LEU  43  -3.678  -1.069  -2.220
  315   HD11  LEU  43          1HD1      LEU  43  -3.237   1.037  -0.102
  316   HD12  LEU  43          2HD1      LEU  43  -4.714   0.791  -1.033
  317   HD13  LEU  43          3HD1      LEU  43  -3.238   1.305  -1.847
  318   HD21  LEU  43          3HD2      LEU  43  -1.365  -0.271  -2.154
  319   HD22  LEU  43          1HD2      LEU  43  -1.486  -1.934  -1.581
  320   HD23  LEU  43          2HD2      LEU  43  -1.290  -0.615  -0.425
  321    H    GLU  44           H        GLU  44  -5.872  -3.911   0.454
  322    HA   GLU  44           HA       GLU  44  -5.373  -4.274   3.212
  323    HB2  GLU  44           2HB      GLU  44  -7.629  -3.886   2.271
  324    HB3  GLU  44           3HB      GLU  44  -7.599  -5.497   1.564
  325    HG2  GLU  44           2HG      GLU  44  -7.434  -6.472   3.813
  326    HG3  GLU  44           3HG      GLU  44  -7.484  -4.853   4.508
  327    H    GLN  45           H        GLN  45  -5.643  -6.675   0.586
  328    HA   GLN  45           HA       GLN  45  -5.324  -8.973   2.136
  329    HB2  GLN  45           2HB      GLN  45  -4.578  -8.458  -0.752
  330    HB3  GLN  45           3HB      GLN  45  -4.550 -10.051  -0.004
  331    HG2  GLN  45           2HG      GLN  45  -6.940  -9.905   0.451
  332    HG3  GLN  45           3HG      GLN  45  -6.985  -8.288  -0.247
  333   HE21  GLN  45          1HE2      GLN  45  -6.949  -8.057  -2.460
  334   HE22  GLN  45          2HE2      GLN  45  -7.139  -9.380  -3.549
  335    H    GLY  46           H        GLY  46  -2.842  -6.930   0.613
  336    HA2  GLY  46           2HA      GLY  46  -0.614  -8.466   1.522
  337    HA3  GLY  46           3HA      GLY  46  -0.568  -6.797   0.973
  338    H    ALA  47           H        ALA  47  -2.317  -5.654   2.864
  339    HA   ALA  47           HA       ALA  47  -0.642  -5.075   5.009
  340    HB1  ALA  47           3HB      ALA  47  -2.494  -3.635   4.328
  341    HB2  ALA  47           1HB      ALA  47  -2.589  -4.016   6.048
  342    HB3  ALA  47           2HB      ALA  47  -3.650  -4.838   4.903
  343    H    ASN  48           H        ASN  48  -3.558  -7.162   5.069
  344    HA   ASN  48           HA       ASN  48  -3.208  -8.032   7.724
  345    HB2  ASN  48           2HB      ASN  48  -4.667  -9.384   5.441
  346    HB3  ASN  48           3HB      ASN  48  -4.792  -9.861   7.134
  347   HD21  ASN  48          1HD2      ASN  48  -5.791  -7.613   4.738
  348   HD22  ASN  48          2HD2      ASN  48  -6.868  -6.711   5.741
  349    H    ALA  49           H        ALA  49  -1.870  -9.270   4.704
  350    HA   ALA  49           HA       ALA  49  -0.825 -11.703   5.666
  351    HB1  ALA  49           3HB      ALA  49   0.718 -11.602   3.774
  352    HB2  ALA  49           1HB      ALA  49   0.310  -9.905   3.519
  353    HB3  ALA  49           2HB      ALA  49  -0.915 -11.153   3.285
  354    H    HIS  50           H        HIS  50   0.261  -8.409   6.040
  355    HA   HIS  50           HA       HIS  50   2.675  -9.323   7.471
  356    HB2  HIS  50           2HB      HIS  50   1.950  -6.608   6.337
  357    HB3  HIS  50           3HB      HIS  50   3.393  -6.919   7.298
  358    HD1  HIS  50           HD1      HIS  50   5.374  -7.148   5.850
  359    HD2  HIS  50           HD2      HIS  50   1.971  -8.673   4.018
  360    HE1  HIS  50           HE1      HIS  50   6.142  -8.016   3.629
  361    HE2  HIS  50           HE2      HIS  50   4.116  -9.147   2.655
  362    H    GLY  51           H        GLY  51  -0.290  -9.091   8.369
  363    HA2  GLY  51           2HA      GLY  51  -1.382  -8.709  10.352
  364    HA3  GLY  51           3HA      GLY  51   0.207  -8.634  11.091
  365    H    LEU  52           H        LEU  52  -1.203  -6.444   8.675
  366    HA   LEU  52           HA       LEU  52  -0.663  -4.201  10.512
  367    HB2  LEU  52           2HB      LEU  52  -0.997  -4.182   7.511
  368    HB3  LEU  52           3HB      LEU  52  -0.537  -2.815   8.509
  369    HG   LEU  52           HG       LEU  52   1.117  -5.326   8.192
  370   HD11  LEU  52          1HD1      LEU  52   2.568  -3.958   6.775
  371   HD12  LEU  52          2HD1      LEU  52   1.416  -2.626   6.880
  372   HD13  LEU  52          3HD1      LEU  52   0.956  -4.133   6.084
  373   HD21  LEU  52          3HD2      LEU  52   1.745  -2.649   9.453
  374   HD22  LEU  52          1HD2      LEU  52   2.891  -3.973   9.227
  375   HD23  LEU  52          2HD2      LEU  52   1.512  -4.176  10.306
  376    H    ASN  53           H        ASN  53  -2.055  -2.268  10.221
  377    HA   ASN  53           HA       ASN  53  -4.892  -2.986   9.921
  378    HB2  ASN  53           2HB      ASN  53  -4.364  -1.991  12.054
  379    HB3  ASN  53           3HB      ASN  53  -3.507  -0.662  11.283
  380   HD21  ASN  53          1HD2      ASN  53  -4.815   0.810  12.401
  381   HD22  ASN  53          2HD2      ASN  53  -6.446   1.121  11.914
  382    H    VAL  54           H        VAL  54  -5.465  -2.752   7.821
  383    HA   VAL  54           HA       VAL  54  -4.234  -1.136   5.922
  384    HB   VAL  54           HB       VAL  54  -5.666  -3.035   5.335
  385   HG11  VAL  54          1HG1      VAL  54  -8.118  -2.817   5.336
  386   HG12  VAL  54          2HG1      VAL  54  -7.971  -1.272   6.177
  387   HG13  VAL  54          3HG1      VAL  54  -7.444  -2.758   6.966
  388   HG21  VAL  54          3HG2      VAL  54  -5.186  -1.356   3.626
  389   HG22  VAL  54          1HG2      VAL  54  -6.616  -0.442   4.108
  390   HG23  VAL  54          2HG2      VAL  54  -6.792  -2.046   3.398
  391    H    GLU  55           H        GLU  55  -6.892  -0.336   8.103
  392    HA   GLU  55           HA       GLU  55  -7.870   1.939   6.783
  393    HB2  GLU  55           2HB      GLU  55  -7.822   1.325   9.747
  394    HB3  GLU  55           3HB      GLU  55  -8.780   2.598   9.002
  395    HG2  GLU  55           2HG      GLU  55  -9.057  -0.366   8.505
  396    HG3  GLU  55           3HG      GLU  55 -10.143   0.641   9.462
  397    H    ASP  56           H        ASP  56  -5.188   1.603   9.078
  398    HA   ASP  56           HA       ASP  56  -4.684   4.421   9.261
  399    HB2  ASP  56           2HB      ASP  56  -3.997   2.661  10.972
  400    HB3  ASP  56           3HB      ASP  56  -2.711   2.207   9.858
  401    H    ILE  57           H        ILE  57  -3.313   1.739   7.380
  402    HA   ILE  57           HA       ILE  57  -1.240   3.080   6.083
  403    HB   ILE  57           HB       ILE  57  -3.013   0.907   4.940
  404   HG12  ILE  57          2HG1      ILE  57  -0.383   0.734   6.440
  405   HG13  ILE  57          3HG1      ILE  57  -1.961   0.259   7.065
  406   HG21  ILE  57          1HG2      ILE  57  -1.758   2.023   3.178
  407   HG22  ILE  57          2HG2      ILE  57  -1.113   0.405   3.455
  408   HG23  ILE  57          3HG2      ILE  57  -0.259   1.814   4.086
  409   HD11  ILE  57          3HD1      ILE  57  -0.509  -1.019   4.755
  410   HD12  ILE  57          1HD1      ILE  57  -2.102  -1.482   5.355
  411   HD13  ILE  57          2HD1      ILE  57  -0.683  -1.677   6.383
  412    H    LEU  58           H        LEU  58  -4.645   2.735   5.036
  413    HA   LEU  58           HA       LEU  58  -4.486   4.264   2.692
  414    HB2  LEU  58           2HB      LEU  58  -6.849   3.993   4.564
  415    HB3  LEU  58           3HB      LEU  58  -6.921   4.531   2.896
  416    HG   LEU  58           HG       LEU  58  -6.196   1.763   3.871
  417   HD11  LEU  58          1HD1      LEU  58  -8.559   2.782   2.291
  418   HD12  LEU  58          2HD1      LEU  58  -8.576   2.219   3.963
  419   HD13  LEU  58          3HD1      LEU  58  -8.223   1.089   2.658
  420   HD21  LEU  58          3HD2      LEU  58  -6.041   1.147   1.500
  421   HD22  LEU  58          1HD2      LEU  58  -4.818   2.335   1.952
  422   HD23  LEU  58          2HD2      LEU  58  -6.247   2.841   1.050
  423    H    ARG  59           H        ARG  59  -5.038   5.248   6.043
  424    HA   ARG  59           HA       ARG  59  -5.622   7.950   5.699
  425    HB2  ARG  59           2HB      ARG  59  -5.770   6.874   7.871
  426    HB3  ARG  59           3HB      ARG  59  -4.038   6.570   7.882
  427    HG2  ARG  59           2HG      ARG  59  -3.704   9.066   7.873
  428    HG3  ARG  59           3HG      ARG  59  -5.444   9.225   8.123
  429    HD2  ARG  59           2HD      ARG  59  -4.254   9.364  10.247
  430    HD3  ARG  59           3HD      ARG  59  -5.263   7.919  10.194
  431    HE   ARG  59           HE       ARG  59  -3.198   6.652   9.726
  432   HH11  ARG  59          1HH1      ARG  59  -2.927   9.757  11.212
  433   HH12  ARG  59          2HH1      ARG  59  -1.366   9.418  11.876
  434   HH21  ARG  59          1HH2      ARG  59  -1.219   6.222  10.620
  435   HH22  ARG  59          2HH2      ARG  59  -0.424   7.436  11.563
  436    H    ASP  60           H        ASP  60  -2.421   6.419   6.094
  437    HA   ASP  60           HA       ASP  60  -0.978   8.868   5.840
  438    HB2  ASP  60           2HB      ASP  60  -0.272   6.678   7.014
  439    HB3  ASP  60           3HB      ASP  60   0.197   6.124   5.410
  440    H    LEU  61           H        LEU  61  -1.962   6.365   3.571
  441    HA   LEU  61           HA       LEU  61  -0.290   7.105   1.410
  442    HB2  LEU  61           2HB      LEU  61  -2.922   5.640   1.499
  443    HB3  LEU  61           3HB      LEU  61  -2.031   5.896   0.010
  444    HG   LEU  61           HG       LEU  61  -1.028   4.352   2.412
  445   HD11  LEU  61          1HD1      LEU  61  -2.788   3.147   1.256
  446   HD12  LEU  61          2HD1      LEU  61  -1.227   2.395   0.931
  447   HD13  LEU  61          3HD1      LEU  61  -1.987   3.412  -0.293
  448   HD21  LEU  61          3HD2      LEU  61   0.776   5.476   1.199
  449   HD22  LEU  61          1HD2      LEU  61   0.211   4.761  -0.311
  450   HD23  LEU  61          2HD2      LEU  61   0.843   3.729   0.973
  451    H    ASN  62           H        ASN  62  -3.748   7.922   1.999
  452    HA   ASN  62           HA       ASN  62  -3.940   9.608  -0.277
  453    HB2  ASN  62           2HB      ASN  62  -5.639   9.444   2.218
  454    HB3  ASN  62           3HB      ASN  62  -6.009  10.522   0.874
  455   HD21  ASN  62          1HD2      ASN  62  -5.944   7.239   1.962
  456   HD22  ASN  62          2HD2      ASN  62  -6.770   6.564   0.606
  457    H    ALA  63           H        ALA  63  -2.749  10.153   2.938
  458    HA   ALA  63           HA       ALA  63  -2.757  12.955   3.030
  459    HB1  ALA  63           3HB      ALA  63  -2.204  11.498   4.944
  460    HB2  ALA  63           1HB      ALA  63  -0.998  12.760   4.684
  461    HB3  ALA  63           2HB      ALA  63  -0.664  11.103   4.176
  462    H    LEU  64           H        LEU  64  -0.762  10.751   1.199
  463    HA   LEU  64           HA       LEU  64   1.374  12.482   0.535
  464    HB2  LEU  64           2HB      LEU  64   0.155  10.203  -1.034
  465    HB3  LEU  64           3HB      LEU  64   1.676  10.978  -1.433
  466    HG   LEU  64           HG       LEU  64   1.160   9.530   1.171
  467   HD11  LEU  64          1HD1      LEU  64   2.517   7.713   0.228
  468   HD12  LEU  64          2HD1      LEU  64   2.551   8.550  -1.324
  469   HD13  LEU  64          3HD1      LEU  64   1.022   7.953  -0.676
  470   HD21  LEU  64          3HD2      LEU  64   3.576   9.626   1.436
  471   HD22  LEU  64          1HD2      LEU  64   2.922  11.253   1.250
  472   HD23  LEU  64          2HD2      LEU  64   3.735  10.469  -0.104
  473    H    ALA  65           H        ALA  65  -1.872  12.172  -0.741
  474    HA   ALA  65           HA       ALA  65  -1.359  13.899  -3.024
  475    HB1  ALA  65           3HB      ALA  65  -2.904  12.012  -3.244
  476    HB2  ALA  65           1HB      ALA  65  -3.719  13.544  -3.556
  477    HB3  ALA  65           2HB      ALA  65  -3.951  12.719  -2.013
  478    H    LEU  66           H        LEU  66  -3.247  14.041  -0.007
  479    HA   LEU  66           HA       LEU  66  -4.214  16.695  -0.447
  480    HB2  LEU  66           2HB      LEU  66  -4.049  15.110   2.122
  481    HB3  LEU  66           3HB      LEU  66  -5.001  16.563   1.878
  482    HG   LEU  66           HG       LEU  66  -5.444  13.917   0.478
  483   HD11  LEU  66          1HD1      LEU  66  -7.018  15.275   2.665
  484   HD12  LEU  66          2HD1      LEU  66  -6.041  13.815   2.833
  485   HD13  LEU  66          3HD1      LEU  66  -7.487  13.797   1.822
  486   HD21  LEU  66          3HD2      LEU  66  -6.072  15.800  -0.938
  487   HD22  LEU  66          1HD2      LEU  66  -7.040  16.481   0.369
  488   HD23  LEU  66          2HD2      LEU  66  -7.503  14.946  -0.367
  489    H    GLU  67           H        GLU  67  -1.487  15.355   1.355
  490    HA   GLU  67           HA       GLU  67   0.229  16.242   2.523
  491    HB2  GLU  67           2HB      GLU  67  -0.275  18.566   0.660
  492    HB3  GLU  67           3HB      GLU  67   1.104  18.478   1.749
  493    HG2  GLU  67           2HG      GLU  67   1.826  16.401   0.631
  494    HG3  GLU  67           3HG      GLU  67   0.473  16.553  -0.489
  495    H    HIS  68           H        HIS  68  -1.477  19.321   2.101
  496    HA   HIS  68           HA       HIS  68  -1.900  20.982   3.588
  497    HB2  HIS  68           2HB      HIS  68  -3.807  20.539   5.008
  498    HB3  HIS  68           3HB      HIS  68  -4.001  19.735   3.460
  499    HD1  HIS  68           HD1      HIS  68  -3.949  19.133   7.081
  500    HD2  HIS  68           HD2      HIS  68  -3.760  16.855   3.610
  501    HE1  HIS  68           HE1      HIS  68  -4.440  16.781   7.795
  502    HE2  HIS  68           HE2      HIS  68  -4.480  15.454   5.666
  503    H    HIS  69           H        HIS  69  -0.551  21.940   4.877
  504    HA   HIS  69           HA       HIS  69   1.455  21.215   6.377
  505    HB2  HIS  69           2HB      HIS  69   0.848  23.140   8.015
  506    HB3  HIS  69           3HB      HIS  69   1.094  23.503   6.311
  507    HD1  HIS  69           HD1      HIS  69  -0.765  24.654   5.120
  508    HD2  HIS  69           HD2      HIS  69  -1.997  23.060   8.757
  509    HE1  HIS  69           HE1      HIS  69  -3.096  25.503   5.469
  510    HE2  HIS  69           HE2      HIS  69  -3.856  24.469   7.628
  511    H    HIS  70           H        HIS  70   1.936  19.848   7.942
  512    HA   HIS  70           HA       HIS  70  -0.193  18.427   9.288
  513    HB2  HIS  70           2HB      HIS  70   1.913  17.443   8.168
  514    HB3  HIS  70           3HB      HIS  70   2.776  17.956   9.611
  515    HD1  HIS  70           HD1      HIS  70   0.131  15.538   8.466
  516    HD2  HIS  70           HD2      HIS  70   2.472  16.288  11.812
  517    HE1  HIS  70           HE1      HIS  70  -0.180  13.550   9.956
  518    HE2  HIS  70           HE2      HIS  70   1.408  13.928  11.867
  519    H    HIS  71           H        HIS  71   0.082  21.127  10.237
  520    HA   HIS  71           HA       HIS  71   1.403  20.959  12.835
  521    HB2  HIS  71           2HB      HIS  71  -0.148  23.224  11.554
  522    HB3  HIS  71           3HB      HIS  71   0.698  23.323  13.092
  523    HD1  HIS  71           HD1      HIS  71   1.136  24.484   9.892
  524    HD2  HIS  71           HD2      HIS  71   3.626  22.363  12.442
  525    HE1  HIS  71           HE1      HIS  71   3.460  24.916   9.064
  526    HE2  HIS  71           HE2      HIS  71   4.946  23.839  10.777
  527    H    HIS  72           H        HIS  72   0.218  19.543  14.076
  528    HA   HIS  72           HA       HIS  72  -2.607  20.237  14.611
  529    HB2  HIS  72           2HB      HIS  72  -2.427  18.001  13.708
  530    HB3  HIS  72           3HB      HIS  72  -1.149  17.590  14.844
  531    HD1  HIS  72           HD1      HIS  72  -4.867  18.100  14.648
  532    HD2  HIS  72           HD2      HIS  72  -2.019  16.770  17.369
  533    HE1  HIS  72           HE1      HIS  72  -6.164  17.063  16.525
  534    HE2  HIS  72           HE2      HIS  72  -4.423  16.108  18.063
  535    H    HIS  73           H        HIS  73  -2.663  21.513  16.386
  536    HA   HIS  73           HA       HIS  73  -0.761  21.215  18.536
  537    HB2  HIS  73           2HB      HIS  73  -1.933  23.093  19.604
  538    HB3  HIS  73           3HB      HIS  73  -1.534  23.452  17.931
  539    HD1  HIS  73           HD1      HIS  73  -3.527  23.685  16.263
  540    HD2  HIS  73           HD2      HIS  73  -4.657  23.034  20.208
  541    HE1  HIS  73           HE1      HIS  73  -5.973  24.225  16.361
  542    HE2  HIS  73           HE2      HIS  73  -6.595  23.975  18.782
  Start of MODEL   14
    1    H1   MET   1           1H       MET   1 -18.306  10.847   0.553
    2    H2   MET   1           2H       MET   1 -18.230  11.794   1.951
    3    H3   MET   1           3H       MET   1 -18.162  10.108   2.069
    4    HA   MET   1           HA       MET   1 -16.135  11.854   0.789
    5    HB2  MET   1           2HB      MET   1 -16.039  10.253   3.362
    6    HB3  MET   1           3HB      MET   1 -14.678  11.114   2.660
    7    HG2  MET   1           2HG      MET   1 -15.769  13.228   3.003
    8    HG3  MET   1           3HG      MET   1 -17.238  12.422   3.556
    9    HE1  MET   1           3HE      MET   1 -15.994  10.766   6.907
   10    HE2  MET   1           1HE      MET   1 -15.971  10.037   5.302
   11    HE3  MET   1           2HE      MET   1 -17.366  10.983   5.823
   12    H    THR   2           H        THR   2 -14.227  10.745   0.050
   13    HA   THR   2           HA       THR   2 -14.328   7.821  -0.103
   14    HB   THR   2           HB       THR   2 -15.446   8.567  -2.180
   15    HG1  THR   2           HG1      THR   2 -13.508   7.605  -3.567
   16   HG21  THR   2          3HG2      THR   2 -14.146   9.731  -3.918
   17   HG22  THR   2          1HG2      THR   2 -12.809   9.924  -2.784
   18   HG23  THR   2          2HG2      THR   2 -14.348  10.733  -2.482
   19    H    GLN   3           H        GLN   3 -12.239   7.087  -1.414
   20    HA   GLN   3           HA       GLN   3  -9.945   8.792  -0.688
   21    HB2  GLN   3           2HB      GLN   3 -10.225   5.846  -0.013
   22    HB3  GLN   3           3HB      GLN   3  -8.754   6.791   0.188
   23    HG2  GLN   3           2HG      GLN   3  -9.847   8.195   1.839
   24    HG3  GLN   3           3HG      GLN   3 -11.364   7.331   1.597
   25   HE21  GLN   3          1HE2      GLN   3  -8.250   5.726   1.676
   26   HE22  GLN   3          2HE2      GLN   3  -8.506   4.915   3.175
   27    H    LYS   4           H        LYS   4  -8.524   8.961  -2.347
   28    HA   LYS   4           HA       LYS   4  -8.887   7.528  -4.780
   29    HB2  LYS   4           2HB      LYS   4  -6.502   9.157  -3.859
   30    HB3  LYS   4           3HB      LYS   4  -6.764   8.581  -5.501
   31    HG2  LYS   4           2HG      LYS   4  -8.930   9.896  -5.482
   32    HG3  LYS   4           3HG      LYS   4  -8.362  10.627  -3.980
   33    HD2  LYS   4           2HD      LYS   4  -7.829  12.084  -5.841
   34    HD3  LYS   4           3HD      LYS   4  -6.337  11.422  -5.169
   35    HE2  LYS   4           2HE      LYS   4  -6.206   9.796  -6.963
   36    HE3  LYS   4           3HE      LYS   4  -7.758  10.328  -7.605
   37    HZ1  LYS   4           3HZ      LYS   4  -5.335  12.035  -7.420
   38    HZ2  LYS   4           1HZ      LYS   4  -6.806  12.447  -8.151
   39    HZ3  LYS   4           2HZ      LYS   4  -5.841  11.231  -8.818
   40    H    PHE   5           H        PHE   5  -6.606   7.214  -2.100
   41    HA   PHE   5           HA       PHE   5  -5.683   4.631  -3.127
   42    HB2  PHE   5           2HB      PHE   5  -4.906   6.175  -0.634
   43    HB3  PHE   5           3HB      PHE   5  -4.211   4.630  -1.110
   44    HD1  PHE   5           HD2      PHE   5  -4.440   8.209  -1.944
   45    HD2  PHE   5           HD1      PHE   5  -2.574   4.491  -2.858
   46    HE1  PHE   5           HE2      PHE   5  -2.754   9.389  -3.294
   47    HE2  PHE   5           HE1      PHE   5  -0.890   5.666  -4.211
   48    HZ   PHE   5           HZ       PHE   5  -0.978   8.118  -4.431
   49    H    THR   6           H        THR   6  -7.192   3.097  -2.870
   50    HA   THR   6           HA       THR   6  -8.700   2.970  -0.325
   51    HB   THR   6           HB       THR   6 -10.236   3.384  -2.121
   52    HG1  THR   6           HG1      THR   6 -11.597   1.696  -1.751
   53   HG21  THR   6          3HG2      THR   6  -8.831   2.664  -4.002
   54   HG22  THR   6          1HG2      THR   6 -10.434   1.935  -4.081
   55   HG23  THR   6          2HG2      THR   6  -9.058   0.979  -3.530
   56    H    LYS   7           H        LYS   7  -9.604   0.664   0.053
   57    HA   LYS   7           HA       LYS   7  -7.378  -1.091   0.434
   58    HB2  LYS   7           2HB      LYS   7  -9.060  -2.641   1.386
   59    HB3  LYS   7           3HB      LYS   7  -9.176  -1.023   2.063
   60    HG2  LYS   7           2HG      LYS   7 -11.133  -0.535   0.795
   61    HG3  LYS   7           3HG      LYS   7 -10.940  -1.990  -0.183
   62    HD2  LYS   7           2HD      LYS   7 -12.703  -2.294   1.468
   63    HD3  LYS   7           3HD      LYS   7 -11.350  -3.375   1.804
   64    HE2  LYS   7           2HE      LYS   7 -10.545  -1.686   3.486
   65    HE3  LYS   7           3HE      LYS   7 -12.056  -0.809   3.234
   66    HZ1  LYS   7           3HZ      LYS   7 -11.780  -3.594   4.228
   67    HZ2  LYS   7           1HZ      LYS   7 -13.252  -2.818   3.924
   68    HZ3  LYS   7           2HZ      LYS   7 -12.234  -2.245   5.143
   69    H    ASP   8           H        ASP   8  -9.816  -0.755  -1.986
   70    HA   ASP   8           HA       ASP   8  -9.756  -3.436  -2.972
   71    HB2  ASP   8           2HB      ASP   8 -11.742  -2.032  -3.187
   72    HB3  ASP   8           3HB      ASP   8 -10.850  -0.887  -4.187
   73    H    MET   9           H        MET   9  -8.028  -0.478  -3.807
   74    HA   MET   9           HA       MET   9  -7.123  -1.382  -6.363
   75    HB2  MET   9           2HB      MET   9  -5.679   0.575  -6.359
   76    HB3  MET   9           3HB      MET   9  -7.292   1.007  -5.804
   77    HG2  MET   9           2HG      MET   9  -6.438   0.842  -3.461
   78    HG3  MET   9           3HG      MET   9  -4.818   0.647  -4.130
   79    HE1  MET   9           3HE      MET   9  -4.328   4.076  -5.994
   80    HE2  MET   9           1HE      MET   9  -5.041   2.626  -6.707
   81    HE3  MET   9           2HE      MET   9  -3.635   2.491  -5.651
   82    H    THR  10           H        THR  10  -4.953  -1.921  -6.977
   83    HA   THR  10           HA       THR  10  -3.717  -3.741  -5.079
   84    HB   THR  10           HB       THR  10  -2.363  -4.499  -6.985
   85    HG1  THR  10           HG1      THR  10  -3.596  -3.182  -8.981
   86   HG21  THR  10          3HG2      THR  10  -4.175  -5.367  -8.398
   87   HG22  THR  10          1HG2      THR  10  -5.293  -4.201  -7.689
   88   HG23  THR  10          2HG2      THR  10  -4.595  -5.476  -6.689
   89    H    PHE  11           H        PHE  11  -1.366  -3.855  -4.819
   90    HA   PHE  11           HA       PHE  11  -0.176  -1.468  -3.982
   91    HB2  PHE  11           2HB      PHE  11   1.043  -4.139  -4.716
   92    HB3  PHE  11           3HB      PHE  11   1.995  -2.810  -4.061
   93    HD1  PHE  11           HD2      PHE  11   1.733  -2.107  -1.757
   94    HD2  PHE  11           HD1      PHE  11  -0.526  -5.361  -3.317
   95    HE1  PHE  11           HE2      PHE  11   1.143  -2.788   0.530
   96    HE2  PHE  11           HE1      PHE  11  -1.122  -6.046  -1.031
   97    HZ   PHE  11           HZ       PHE  11  -0.284  -4.758   0.897
   98    H    ALA  12           H        ALA  12   0.145  -3.189  -7.076
   99    HA   ALA  12           HA       ALA  12   2.098  -1.612  -8.288
  100    HB1  ALA  12           3HB      ALA  12  -0.291  -2.924  -9.597
  101    HB2  ALA  12           1HB      ALA  12   1.254  -3.702  -9.245
  102    HB3  ALA  12           2HB      ALA  12   1.176  -2.387 -10.419
  103    H    GLN  13           H        GLN  13  -1.449  -1.157  -8.324
  104    HA   GLN  13           HA       GLN  13  -1.549   1.230  -9.784
  105    HB2  GLN  13           2HB      GLN  13  -3.340   0.195  -7.578
  106    HB3  GLN  13           3HB      GLN  13  -3.706   1.637  -8.514
  107    HG2  GLN  13           2HG      GLN  13  -3.843   0.342 -10.546
  108    HG3  GLN  13           3HG      GLN  13  -3.331  -1.112  -9.690
  109   HE21  GLN  13          1HE2      GLN  13  -5.942   1.161 -10.152
  110   HE22  GLN  13          2HE2      GLN  13  -7.172   0.180  -9.442
  111    H    ALA  14           H        ALA  14  -1.256   0.758  -6.260
  112    HA   ALA  14           HA       ALA  14  -1.291   3.452  -5.490
  113    HB1  ALA  14           3HB      ALA  14  -1.529   1.582  -3.918
  114    HB2  ALA  14           1HB      ALA  14  -0.266   2.704  -3.406
  115    HB3  ALA  14           2HB      ALA  14   0.168   1.168  -4.156
  116    H    LEU  15           H        LEU  15   1.540   1.353  -6.107
  117    HA   LEU  15           HA       LEU  15   3.552   3.227  -5.637
  118    HB2  LEU  15           2HB      LEU  15   3.534   0.886  -7.548
  119    HB3  LEU  15           3HB      LEU  15   4.976   1.771  -7.080
  120    HG   LEU  15           HG       LEU  15   3.212   0.182  -5.201
  121   HD11  LEU  15          1HD1      LEU  15   4.441  -1.284  -6.689
  122   HD12  LEU  15          2HD1      LEU  15   5.133  -1.353  -5.068
  123   HD13  LEU  15          3HD1      LEU  15   5.944  -0.431  -6.336
  124   HD21  LEU  15          3HD2      LEU  15   4.259   2.090  -4.093
  125   HD22  LEU  15          1HD2      LEU  15   5.837   1.593  -4.705
  126   HD23  LEU  15          2HD2      LEU  15   4.976   0.574  -3.550
  127    H    GLN  16           H        GLN  16   1.765   2.566  -8.636
  128    HA   GLN  16           HA       GLN  16   3.360   4.363 -10.208
  129    HB2  GLN  16           2HB      GLN  16   0.760   2.943 -10.762
  130    HB3  GLN  16           3HB      GLN  16   1.516   4.026 -11.925
  131    HG2  GLN  16           2HG      GLN  16   2.710   1.498 -10.795
  132    HG3  GLN  16           3HG      GLN  16   2.069   1.723 -12.425
  133   HE21  GLN  16          1HE2      GLN  16   4.696   2.411 -10.263
  134   HE22  GLN  16          2HE2      GLN  16   5.789   3.014 -11.456
  135    H    THR  17           H        THR  17   0.304   4.660  -8.471
  136    HA   THR  17           HA       THR  17  -0.614   7.058  -9.581
  137    HB   THR  17           HB       THR  17  -0.939   6.126  -6.713
  138    HG1  THR  17           HG1      THR  17  -2.121   4.662  -7.692
  139   HG21  THR  17          3HG2      THR  17  -1.457   8.507  -6.934
  140   HG22  THR  17          1HG2      THR  17  -2.933   7.570  -6.690
  141   HG23  THR  17          2HG2      THR  17  -2.519   8.159  -8.299
  142    H    HIS  18           H        HIS  18   1.435   6.605  -6.690
  143    HA   HIS  18           HA       HIS  18   2.661   9.212  -7.214
  144    HB2  HIS  18           2HB      HIS  18   1.259   8.447  -4.659
  145    HB3  HIS  18           3HB      HIS  18   2.592   9.594  -4.634
  146    HD1  HIS  18           HD1      HIS  18   1.324  10.574  -7.634
  147    HD2  HIS  18           HD2      HIS  18  -0.283  10.768  -3.807
  148    HE1  HIS  18           HE1      HIS  18  -0.372  12.412  -7.712
  149    HE2  HIS  18           HE2      HIS  18  -1.145  12.672  -5.339
  150    HA   PRO  19           HA       PRO  19   6.398   6.912  -6.610
  151    HB2  PRO  19           2HB      PRO  19   7.565   9.506  -5.735
  152    HB3  PRO  19           3HB      PRO  19   8.069   8.426  -7.039
  153    HG2  PRO  19           2HG      PRO  19   6.823  10.728  -7.573
  154    HG3  PRO  19           3HG      PRO  19   6.495   9.266  -8.524
  155    HD2  PRO  19           2HD      PRO  19   4.861  10.523  -6.347
  156    HD3  PRO  19           3HD      PRO  19   4.330   9.779  -7.870
  157    H    GLY  20           H        GLY  20   5.673   9.339  -4.085
  158    HA2  GLY  20           2HA      GLY  20   7.392   8.362  -2.109
  159    HA3  GLY  20           3HA      GLY  20   5.963   9.332  -1.810
  160    H    VAL  21           H        VAL  21   4.481   6.921  -3.204
  161    HA   VAL  21           HA       VAL  21   3.467   5.735  -0.893
  162    HB   VAL  21           HB       VAL  21   3.496   4.661  -3.725
  163   HG11  VAL  21          1HG1      VAL  21   3.093   2.825  -2.179
  164   HG12  VAL  21          2HG1      VAL  21   1.609   3.236  -3.037
  165   HG13  VAL  21          3HG1      VAL  21   1.835   3.756  -1.366
  166   HG21  VAL  21          3HG2      VAL  21   1.384   6.176  -2.181
  167   HG22  VAL  21          1HG2      VAL  21   1.200   5.534  -3.814
  168   HG23  VAL  21          2HG2      VAL  21   2.372   6.813  -3.496
  169    H    ALA  22           H        ALA  22   6.185   4.729  -2.921
  170    HA   ALA  22           HA       ALA  22   6.608   2.157  -1.908
  171    HB1  ALA  22           3HB      ALA  22   8.691   4.137  -2.843
  172    HB2  ALA  22           1HB      ALA  22   7.772   3.040  -3.874
  173    HB3  ALA  22           2HB      ALA  22   8.912   2.393  -2.693
  174    H    GLY  23           H        GLY  23   8.018   5.247  -0.793
  175    HA2  GLY  23           2HA      GLY  23   9.485   4.246   1.378
  176    HA3  GLY  23           3HA      GLY  23   8.881   5.888   1.234
  177    H    VAL  24           H        VAL  24   6.096   5.263   1.204
  178    HA   VAL  24           HA       VAL  24   5.528   5.119   3.964
  179    HB   VAL  24           HB       VAL  24   3.650   4.678   1.628
  180   HG11  VAL  24          1HG1      VAL  24   2.686   3.818   3.692
  181   HG12  VAL  24          2HG1      VAL  24   1.860   5.299   3.205
  182   HG13  VAL  24          3HG1      VAL  24   3.041   5.338   4.515
  183   HG21  VAL  24          3HG2      VAL  24   4.755   6.849   1.512
  184   HG22  VAL  24          1HG2      VAL  24   4.296   7.191   3.181
  185   HG23  VAL  24          2HG2      VAL  24   3.054   7.046   1.936
  186    H    LEU  25           H        LEU  25   4.882   2.732   1.377
  187    HA   LEU  25           HA       LEU  25   3.811   0.712   2.946
  188    HB2  LEU  25           2HB      LEU  25   5.518   0.436   0.465
  189    HB3  LEU  25           3HB      LEU  25   4.504  -0.830   1.134
  190    HG   LEU  25           HG       LEU  25   3.544   1.798  -0.023
  191   HD11  LEU  25          1HD1      LEU  25   3.244  -1.023  -1.053
  192   HD12  LEU  25          2HD1      LEU  25   4.322   0.208  -1.711
  193   HD13  LEU  25          3HD1      LEU  25   2.576   0.435  -1.788
  194   HD21  LEU  25          3HD2      LEU  25   1.946  -0.504   1.107
  195   HD22  LEU  25          1HD2      LEU  25   1.285   0.912   0.290
  196   HD23  LEU  25          2HD2      LEU  25   2.120   1.096   1.831
  197    H    ARG  26           H        ARG  26   7.243   1.189   2.060
  198    HA   ARG  26           HA       ARG  26   8.278  -1.024   3.451
  199    HB2  ARG  26           2HB      ARG  26   9.614   1.640   2.906
  200    HB3  ARG  26           3HB      ARG  26  10.442   0.153   3.353
  201    HG2  ARG  26           2HG      ARG  26   9.738  -0.906   1.289
  202    HG3  ARG  26           3HG      ARG  26   8.805   0.524   0.846
  203    HD2  ARG  26           2HD      ARG  26  10.868   0.576  -0.363
  204    HD3  ARG  26           3HD      ARG  26  10.925   1.835   0.871
  205    HE   ARG  26           HE       ARG  26  12.104  -0.420   1.976
  206   HH11  ARG  26          1HH1      ARG  26  12.674   1.788  -0.593
  207   HH12  ARG  26          2HH1      ARG  26  14.371   1.468  -0.649
  208   HH21  ARG  26          1HH2      ARG  26  14.292  -0.805   1.930
  209   HH22  ARG  26          2HH2      ARG  26  15.278   0.015   0.771
  210    H    SER  27           H        SER  27   7.578   2.263   4.547
  211    HA   SER  27           HA       SER  27   8.764   2.143   7.092
  212    HB2  SER  27           2HB      SER  27   8.004   4.258   6.131
  213    HB3  SER  27           3HB      SER  27   6.331   3.710   6.186
  214    HG   SER  27           HG       SER  27   7.981   4.633   8.226
  215    H    TYR  28           H        TYR  28   5.647   0.970   5.950
  216    HA   TYR  28           HA       TYR  28   4.837   0.247   8.675
  217    HB2  TYR  28           2HB      TYR  28   3.350   0.302   6.047
  218    HB3  TYR  28           3HB      TYR  28   2.665  -0.399   7.509
  219    HD1  TYR  28           HD1      TYR  28   3.813   2.745   5.948
  220    HD2  TYR  28           HD2      TYR  28   1.838   0.983   9.282
  221    HE1  TYR  28           HE1      TYR  28   3.048   4.968   6.662
  222    HE2  TYR  28           HE2      TYR  28   1.065   3.201  10.002
  223    HH   TYR  28           HH       TYR  28   1.272   5.964   8.018
  224    H    ASN  29           H        ASN  29   6.769  -1.206   6.553
  225    HA   ASN  29           HA       ASN  29   7.529  -3.338   6.303
  226    HB2  ASN  29           2HB      ASN  29   6.866  -3.659   8.706
  227    HB3  ASN  29           3HB      ASN  29   5.305  -4.245   8.153
  228   HD21  ASN  29          1HD2      ASN  29   7.272  -5.633   9.724
  229   HD22  ASN  29          2HD2      ASN  29   7.696  -7.053   8.831
  230    H    LEU  30           H        LEU  30   6.116  -2.361   4.301
  231    HA   LEU  30           HA       LEU  30   4.808  -4.793   3.254
  232    HB2  LEU  30           2HB      LEU  30   4.031  -1.916   2.744
  233    HB3  LEU  30           3HB      LEU  30   3.476  -3.251   1.750
  234    HG   LEU  30           HG       LEU  30   2.906  -2.932   4.705
  235   HD11  LEU  30          1HD1      LEU  30   0.615  -2.453   4.012
  236   HD12  LEU  30          2HD1      LEU  30   1.102  -2.526   2.318
  237   HD13  LEU  30          3HD1      LEU  30   1.737  -1.257   3.366
  238   HD21  LEU  30          3HD2      LEU  30   1.354  -4.796   4.384
  239   HD22  LEU  30          1HD2      LEU  30   3.007  -5.277   4.007
  240   HD23  LEU  30          2HD2      LEU  30   1.867  -4.944   2.702
  241    H    GLY  31           H        GLY  31   7.594  -3.407   3.168
  242    HA2  GLY  31           2HA      GLY  31   8.023  -2.713   0.417
  243    HA3  GLY  31           3HA      GLY  31   9.265  -3.016   1.624
  244    H    CYS  32           H        CYS  32   7.794  -5.698   2.072
  245    HA   CYS  32           HA       CYS  32   9.459  -7.280   0.380
  246    HB2  CYS  32           2HB      CYS  32   7.146  -8.137   2.138
  247    HB3  CYS  32           3HB      CYS  32   8.360  -9.204   1.444
  248    HG   CYS  32           HG       CYS  32   8.720  -8.745   4.258
  249    H    ILE  33           H        ILE  33   6.579  -5.740  -0.340
  250    HA   ILE  33           HA       ILE  33   5.002  -7.634  -1.628
  251    HB   ILE  33           HB       ILE  33   4.131  -5.758  -3.038
  252   HG12  ILE  33          2HG1      ILE  33   6.196  -4.124  -1.523
  253   HG13  ILE  33          3HG1      ILE  33   6.231  -4.483  -3.247
  254   HG21  ILE  33          1HG2      ILE  33   4.344  -5.227  -0.072
  255   HG22  ILE  33          2HG2      ILE  33   3.160  -6.264  -0.865
  256   HG23  ILE  33          3HG2      ILE  33   3.145  -4.526  -1.159
  257   HD11  ILE  33          3HD1      ILE  33   5.443  -2.230  -2.831
  258   HD12  ILE  33          1HD1      ILE  33   4.134  -2.855  -1.827
  259   HD13  ILE  33          2HD1      ILE  33   4.170  -3.214  -3.553
  260    H    GLY  34           H        GLY  34   7.977  -6.183  -2.758
  261    HA2  GLY  34           2HA      GLY  34   7.688  -7.052  -5.484
  262    HA3  GLY  34           3HA      GLY  34   9.170  -6.508  -4.712
  263    H    CYS  35           H        CYS  35   9.487  -8.295  -2.674
  264    HA   CYS  35           HA       CYS  35  10.625 -10.515  -4.031
  265    HB2  CYS  35           2HB      CYS  35  11.609  -9.618  -1.978
  266    HB3  CYS  35           3HB      CYS  35  10.180 -10.096  -1.066
  267    HG   CYS  35           HG       CYS  35  10.887 -12.884  -2.229
  268    H    MET  36           H        MET  36   7.732 -10.230  -1.965
  269    HA   MET  36           HA       MET  36   7.143 -13.057  -2.238
  270    HB2  MET  36           2HB      MET  36   5.242 -12.646  -0.797
  271    HB3  MET  36           3HB      MET  36   6.667 -11.868  -0.129
  272    HG2  MET  36           2HG      MET  36   5.853  -9.723  -1.149
  273    HG3  MET  36           3HG      MET  36   4.357 -10.563  -1.545
  274    HE1  MET  36           3HE      MET  36   4.264 -12.526   1.064
  275    HE2  MET  36           1HE      MET  36   2.820 -11.760   0.405
  276    HE3  MET  36           2HE      MET  36   3.192 -11.608   2.121
  277    H    GLY  37           H        GLY  37   6.656 -10.434  -4.231
  278    HA2  GLY  37           2HA      GLY  37   5.488 -10.213  -6.202
  279    HA3  GLY  37           3HA      GLY  37   5.045 -11.904  -6.048
  280    H    ALA  38           H        ALA  38   4.262  -9.012  -4.106
  281    HA   ALA  38           HA       ALA  38   1.411  -9.741  -4.259
  282    HB1  ALA  38           3HB      ALA  38   2.413  -9.500  -2.016
  283    HB2  ALA  38           1HB      ALA  38   1.105  -8.348  -2.293
  284    HB3  ALA  38           2HB      ALA  38   2.783  -7.815  -2.379
  285    H    GLN  39           H        GLN  39   2.999  -8.243  -6.371
  286    HA   GLN  39           HA       GLN  39   2.327  -5.500  -6.343
  287    HB2  GLN  39           2HB      GLN  39   2.904  -7.309  -8.702
  288    HB3  GLN  39           3HB      GLN  39   2.863  -5.552  -8.765
  289    HG2  GLN  39           2HG      GLN  39   4.768  -7.192  -7.100
  290    HG3  GLN  39           3HG      GLN  39   5.146  -6.448  -8.653
  291   HE21  GLN  39          1HE2      GLN  39   4.535  -5.868  -5.278
  292   HE22  GLN  39          2HE2      GLN  39   5.100  -4.237  -5.258
  293    H    ASN  40           H        ASN  40   0.715  -8.259  -7.907
  294    HA   ASN  40           HA       ASN  40  -1.429  -6.595  -8.939
  295    HB2  ASN  40           2HB      ASN  40  -1.142  -9.613  -8.961
  296    HB3  ASN  40           3HB      ASN  40  -2.300  -8.673  -9.898
  297   HD21  ASN  40          1HD2      ASN  40   0.999  -9.650  -9.585
  298   HD22  ASN  40          2HD2      ASN  40   1.523  -9.080 -11.127
  299    H    GLU  41           H        GLU  41  -0.842  -7.509  -5.921
  300    HA   GLU  41           HA       GLU  41  -3.524  -8.480  -5.258
  301    HB2  GLU  41           2HB      GLU  41  -1.594  -9.660  -4.291
  302    HB3  GLU  41           3HB      GLU  41  -1.064  -8.174  -3.517
  303    HG2  GLU  41           2HG      GLU  41  -2.983  -8.151  -2.090
  304    HG3  GLU  41           3HG      GLU  41  -3.713  -9.496  -2.965
  305    H    SER  42           H        SER  42  -4.895  -7.407  -3.782
  306    HA   SER  42           HA       SER  42  -4.828  -4.555  -3.948
  307    HB2  SER  42           2HB      SER  42  -6.636  -6.359  -2.310
  308    HB3  SER  42           3HB      SER  42  -6.895  -4.635  -2.580
  309    HG   SER  42           HG       SER  42  -7.478  -5.013  -4.609
  310    H    LEU  43           H        LEU  43  -4.674  -3.019  -2.278
  311    HA   LEU  43           HA       LEU  43  -2.553  -3.268  -0.527
  312    HB2  LEU  43           2HB      LEU  43  -4.929  -1.408  -0.394
  313    HB3  LEU  43           3HB      LEU  43  -3.507  -1.236   0.620
  314    HG   LEU  43           HG       LEU  43  -3.495  -1.095  -2.405
  315   HD11  LEU  43          1HD1      LEU  43  -3.304   1.124  -0.365
  316   HD12  LEU  43          2HD1      LEU  43  -4.660   0.820  -1.450
  317   HD13  LEU  43          3HD1      LEU  43  -3.098   1.302  -2.108
  318   HD21  LEU  43          3HD2      LEU  43  -1.199  -0.249  -2.104
  319   HD22  LEU  43          1HD2      LEU  43  -1.385  -1.905  -1.527
  320   HD23  LEU  43          2HD2      LEU  43  -1.320  -0.572  -0.371
  321    H    GLU  44           H        GLU  44  -6.007  -3.687   0.227
  322    HA   GLU  44           HA       GLU  44  -5.751  -4.064   2.995
  323    HB2  GLU  44           2HB      GLU  44  -7.908  -3.686   1.981
  324    HB3  GLU  44           3HB      GLU  44  -7.783  -5.176   1.054
  325    HG2  GLU  44           2HG      GLU  44  -7.909  -6.490   3.082
  326    HG3  GLU  44           3HG      GLU  44  -7.918  -5.023   4.062
  327    H    GLN  45           H        GLN  45  -5.692  -6.453   0.368
  328    HA   GLN  45           HA       GLN  45  -5.545  -8.751   1.989
  329    HB2  GLN  45           2HB      GLN  45  -4.507  -8.361  -0.829
  330    HB3  GLN  45           3HB      GLN  45  -4.814  -9.910  -0.054
  331    HG2  GLN  45           2HG      GLN  45  -7.185  -9.440   0.041
  332    HG3  GLN  45           3HG      GLN  45  -6.917  -7.819  -0.601
  333   HE21  GLN  45          1HE2      GLN  45  -8.229  -8.155  -2.377
  334   HE22  GLN  45          2HE2      GLN  45  -7.780  -9.186  -3.686
  335    H    GLY  46           H        GLY  46  -2.983  -6.766   0.522
  336    HA2  GLY  46           2HA      GLY  46  -0.801  -8.301   1.505
  337    HA3  GLY  46           3HA      GLY  46  -0.730  -6.635   0.957
  338    H    ALA  47           H        ALA  47  -2.513  -5.480   2.816
  339    HA   ALA  47           HA       ALA  47  -0.902  -4.940   5.027
  340    HB1  ALA  47           3HB      ALA  47  -2.721  -3.476   4.312
  341    HB2  ALA  47           1HB      ALA  47  -2.888  -3.892   6.018
  342    HB3  ALA  47           2HB      ALA  47  -3.906  -4.682   4.813
  343    H    ASN  48           H        ASN  48  -3.849  -6.975   4.960
  344    HA   ASN  48           HA       ASN  48  -3.616  -7.982   7.571
  345    HB2  ASN  48           2HB      ASN  48  -4.991  -9.082   5.117
  346    HB3  ASN  48           3HB      ASN  48  -5.075  -9.887   6.680
  347   HD21  ASN  48          1HD2      ASN  48  -6.104  -7.161   4.813
  348   HD22  ASN  48          2HD2      ASN  48  -7.260  -6.572   5.949
  349    H    ALA  49           H        ALA  49  -2.064  -8.999   4.596
  350    HA   ALA  49           HA       ALA  49  -1.146 -11.533   5.441
  351    HB1  ALA  49           3HB      ALA  49   0.460 -11.365   3.609
  352    HB2  ALA  49           1HB      ALA  49   0.115  -9.641   3.453
  353    HB3  ALA  49           2HB      ALA  49  -1.142 -10.829   3.098
  354    H    HIS  50           H        HIS  50   0.129  -8.288   5.956
  355    HA   HIS  50           HA       HIS  50   2.437  -9.409   7.418
  356    HB2  HIS  50           2HB      HIS  50   1.925  -6.681   6.221
  357    HB3  HIS  50           3HB      HIS  50   3.247  -6.976   7.345
  358    HD1  HIS  50           HD1      HIS  50   5.302  -6.979   5.955
  359    HD2  HIS  50           HD2      HIS  50   2.227  -9.123   4.161
  360    HE1  HIS  50           HE1      HIS  50   6.316  -8.032   3.917
  361    HE2  HIS  50           HE2      HIS  50   4.505  -9.513   3.001
  362    H    GLY  51           H        GLY  51  -0.564  -8.818   8.225
  363    HA2  GLY  51           2HA      GLY  51  -1.625  -8.420  10.228
  364    HA3  GLY  51           3HA      GLY  51  -0.040  -8.425  10.983
  365    H    LEU  52           H        LEU  52  -1.613  -6.270   8.619
  366    HA   LEU  52           HA       LEU  52  -1.046  -3.987  10.415
  367    HB2  LEU  52           2HB      LEU  52  -0.942  -3.989   7.394
  368    HB3  LEU  52           3HB      LEU  52  -0.597  -2.628   8.444
  369    HG   LEU  52           HG       LEU  52   1.041  -5.169   8.325
  370   HD11  LEU  52          1HD1      LEU  52   2.705  -3.810   7.163
  371   HD12  LEU  52          2HD1      LEU  52   1.595  -2.438   7.163
  372   HD13  LEU  52          3HD1      LEU  52   1.198  -3.894   6.250
  373   HD21  LEU  52          3HD2      LEU  52   1.550  -2.539   9.729
  374   HD22  LEU  52          1HD2      LEU  52   2.672  -3.899   9.642
  375   HD23  LEU  52          2HD2      LEU  52   1.145  -4.071  10.507
  376    H    ASN  53           H        ASN  53  -2.637  -2.432  10.636
  377    HA   ASN  53           HA       ASN  53  -5.288  -2.994   9.698
  378    HB2  ASN  53           2HB      ASN  53  -4.786  -1.832  11.859
  379    HB3  ASN  53           3HB      ASN  53  -4.247  -0.429  10.943
  380   HD21  ASN  53          1HD2      ASN  53  -6.391  -0.539  12.837
  381   HD22  ASN  53          2HD2      ASN  53  -7.838  -0.119  11.993
  382    H    VAL  54           H        VAL  54  -5.944  -2.636   7.668
  383    HA   VAL  54           HA       VAL  54  -4.539  -1.246   5.704
  384    HB   VAL  54           HB       VAL  54  -6.235  -2.939   5.180
  385   HG11  VAL  54          1HG1      VAL  54  -7.921  -2.387   6.846
  386   HG12  VAL  54          2HG1      VAL  54  -8.633  -2.397   5.232
  387   HG13  VAL  54          3HG1      VAL  54  -8.266  -0.864   6.025
  388   HG21  VAL  54          3HG2      VAL  54  -5.571  -1.392   3.425
  389   HG22  VAL  54          1HG2      VAL  54  -6.823  -0.252   3.927
  390   HG23  VAL  54          2HG2      VAL  54  -7.273  -1.818   3.252
  391    H    GLU  55           H        GLU  55  -7.043  -0.069   7.902
  392    HA   GLU  55           HA       GLU  55  -7.691   2.347   6.640
  393    HB2  GLU  55           2HB      GLU  55  -7.637   1.659   9.588
  394    HB3  GLU  55           3HB      GLU  55  -8.368   3.115   8.931
  395    HG2  GLU  55           2HG      GLU  55  -9.967   1.764   7.674
  396    HG3  GLU  55           3HG      GLU  55  -9.219   0.291   8.292
  397    H    ASP  56           H        ASP  56  -5.199   1.710   9.117
  398    HA   ASP  56           HA       ASP  56  -4.366   4.395   9.378
  399    HB2  ASP  56           2HB      ASP  56  -3.955   2.445  10.984
  400    HB3  ASP  56           3HB      ASP  56  -2.625   1.984   9.926
  401    H    ILE  57           H        ILE  57  -3.254   1.765   7.302
  402    HA   ILE  57           HA       ILE  57  -0.993   3.076   6.208
  403    HB   ILE  57           HB       ILE  57  -2.735   0.961   4.911
  404   HG12  ILE  57          2HG1      ILE  57  -0.226   0.652   6.599
  405   HG13  ILE  57          3HG1      ILE  57  -1.863   0.254   7.116
  406   HG21  ILE  57          1HG2      ILE  57  -1.297   2.079   3.297
  407   HG22  ILE  57          2HG2      ILE  57  -0.722   0.439   3.588
  408   HG23  ILE  57          3HG2      ILE  57   0.108   1.808   4.327
  409   HD11  ILE  57          3HD1      ILE  57  -1.995  -1.476   5.411
  410   HD12  ILE  57          1HD1      ILE  57  -0.612  -1.729   6.475
  411   HD13  ILE  57          2HD1      ILE  57  -0.370  -1.067   4.859
  412    H    LEU  58           H        LEU  58  -4.307   2.684   4.907
  413    HA   LEU  58           HA       LEU  58  -4.014   4.177   2.574
  414    HB2  LEU  58           2HB      LEU  58  -6.468   3.868   4.311
  415    HB3  LEU  58           3HB      LEU  58  -6.481   4.514   2.681
  416    HG   LEU  58           HG       LEU  58  -5.735   1.692   3.476
  417   HD11  LEU  58          1HD1      LEU  58  -8.132   2.145   3.606
  418   HD12  LEU  58          2HD1      LEU  58  -7.759   1.061   2.267
  419   HD13  LEU  58          3HD1      LEU  58  -8.114   2.760   1.953
  420   HD21  LEU  58          3HD2      LEU  58  -5.600   1.252   1.064
  421   HD22  LEU  58          1HD2      LEU  58  -4.389   2.424   1.585
  422   HD23  LEU  58          2HD2      LEU  58  -5.838   2.971   0.742
  423    H    ARG  59           H        ARG  59  -4.666   5.268   5.857
  424    HA   ARG  59           HA       ARG  59  -5.371   7.910   5.446
  425    HB2  ARG  59           2HB      ARG  59  -5.412   6.950   7.655
  426    HB3  ARG  59           3HB      ARG  59  -3.675   6.672   7.625
  427    HG2  ARG  59           2HG      ARG  59  -3.312   9.115   7.601
  428    HG3  ARG  59           3HG      ARG  59  -5.059   9.353   7.703
  429    HD2  ARG  59           2HD      ARG  59  -3.908   9.548   9.893
  430    HD3  ARG  59           3HD      ARG  59  -5.135   8.284   9.856
  431    HE   ARG  59           HE       ARG  59  -3.288   6.674   9.612
  432   HH11  ARG  59          1HH1      ARG  59  -2.570   9.799  10.888
  433   HH12  ARG  59          2HH1      ARG  59  -1.161   9.244  11.717
  434   HH21  ARG  59          1HH2      ARG  59  -1.491   5.988  10.706
  435   HH22  ARG  59          2HH2      ARG  59  -0.559   7.124  11.615
  436    H    ASP  60           H        ASP  60  -2.031   6.668   5.890
  437    HA   ASP  60           HA       ASP  60  -0.827   9.201   5.401
  438    HB2  ASP  60           2HB      ASP  60   0.175   7.296   6.733
  439    HB3  ASP  60           3HB      ASP  60   0.515   6.494   5.202
  440    H    LEU  61           H        LEU  61  -1.606   6.449   3.345
  441    HA   LEU  61           HA       LEU  61  -0.162   7.196   1.047
  442    HB2  LEU  61           2HB      LEU  61  -2.754   5.663   1.302
  443    HB3  LEU  61           3HB      LEU  61  -1.844   5.808  -0.190
  444    HG   LEU  61           HG       LEU  61  -0.878   4.467   2.347
  445   HD11  LEU  61          1HD1      LEU  61  -2.591   3.170   1.201
  446   HD12  LEU  61          2HD1      LEU  61  -1.013   2.403   1.032
  447   HD13  LEU  61          3HD1      LEU  61  -1.703   3.306  -0.318
  448   HD21  LEU  61          3HD2      LEU  61   0.960   5.532   1.129
  449   HD22  LEU  61          1HD2      LEU  61   0.463   4.714  -0.353
  450   HD23  LEU  61          2HD2      LEU  61   1.056   3.776   1.018
  451    H    ASN  62           H        ASN  62  -3.595   7.869   1.863
  452    HA   ASN  62           HA       ASN  62  -4.043   9.539  -0.393
  453    HB2  ASN  62           2HB      ASN  62  -5.520   9.247   2.224
  454    HB3  ASN  62           3HB      ASN  62  -6.034  10.378   0.976
  455   HD21  ASN  62          1HD2      ASN  62  -5.753   7.032   1.849
  456   HD22  ASN  62          2HD2      ASN  62  -6.679   6.405   0.537
  457    H    ALA  63           H        ALA  63  -2.719  10.152   2.787
  458    HA   ALA  63           HA       ALA  63  -2.818  12.965   2.796
  459    HB1  ALA  63           3HB      ALA  63  -0.702  11.189   4.020
  460    HB2  ALA  63           1HB      ALA  63  -2.238  11.619   4.771
  461    HB3  ALA  63           2HB      ALA  63  -1.035  12.867   4.449
  462    H    LEU  64           H        LEU  64  -0.735  10.743   1.058
  463    HA   LEU  64           HA       LEU  64   1.245  12.617   0.230
  464    HB2  LEU  64           2HB      LEU  64   0.258  10.106  -1.138
  465    HB3  LEU  64           3HB      LEU  64   1.698  10.996  -1.595
  466    HG   LEU  64           HG       LEU  64   1.290   9.649   1.084
  467   HD11  LEU  64          1HD1      LEU  64   2.908   7.994   0.284
  468   HD12  LEU  64          2HD1      LEU  64   2.914   8.767  -1.302
  469   HD13  LEU  64          3HD1      LEU  64   1.444   7.999  -0.699
  470   HD21  LEU  64          3HD2      LEU  64   2.804  11.574   1.180
  471   HD22  LEU  64          1HD2      LEU  64   3.753  10.898  -0.145
  472   HD23  LEU  64          2HD2      LEU  64   3.675  10.058   1.404
  473    H    ALA  65           H        ALA  65  -1.957  11.814  -0.944
  474    HA   ALA  65           HA       ALA  65  -1.727  13.356  -3.376
  475    HB1  ALA  65           3HB      ALA  65  -4.177  12.192  -2.049
  476    HB2  ALA  65           1HB      ALA  65  -3.181  11.391  -3.264
  477    HB3  ALA  65           2HB      ALA  65  -4.090  12.841  -3.688
  478    H    LEU  66           H        LEU  66  -3.007  13.865  -0.139
  479    HA   LEU  66           HA       LEU  66  -4.191  16.426  -0.745
  480    HB2  LEU  66           2HB      LEU  66  -3.558  15.136   1.918
  481    HB3  LEU  66           3HB      LEU  66  -4.511  16.594   1.703
  482    HG   LEU  66           HG       LEU  66  -5.253  13.836   0.706
  483   HD11  LEU  66          1HD1      LEU  66  -6.428  15.481   2.948
  484   HD12  LEU  66          2HD1      LEU  66  -5.418  14.047   3.134
  485   HD13  LEU  66          3HD1      LEU  66  -7.011  13.910   2.389
  486   HD21  LEU  66          3HD2      LEU  66  -7.406  14.839   0.105
  487   HD22  LEU  66          1HD2      LEU  66  -6.082  15.579  -0.792
  488   HD23  LEU  66          2HD2      LEU  66  -6.803  16.430   0.575
  489    H    GLU  67           H        GLU  67  -1.103  15.287   0.456
  490    HA   GLU  67           HA       GLU  67   0.897  16.292   0.814
  491    HB2  GLU  67           2HB      GLU  67  -0.320  18.623  -0.691
  492    HB3  GLU  67           3HB      GLU  67   1.391  18.411  -0.344
  493    HG2  GLU  67           2HG      GLU  67   1.367  16.331  -1.689
  494    HG3  GLU  67           3HG      GLU  67  -0.317  16.654  -2.103
  495    H    HIS  68           H        HIS  68  -1.630  17.001   2.565
  496    HA   HIS  68           HA       HIS  68  -0.556  19.391   3.892
  497    HB2  HIS  68           2HB      HIS  68  -3.234  18.033   3.956
  498    HB3  HIS  68           3HB      HIS  68  -2.766  19.123   5.258
  499    HD1  HIS  68           HD1      HIS  68  -2.744  21.619   4.759
  500    HD2  HIS  68           HD2      HIS  68  -3.655  19.294   1.440
  501    HE1  HIS  68           HE1      HIS  68  -3.601  23.221   3.037
  502    HE2  HIS  68           HE2      HIS  68  -3.921  21.827   0.974
  503    H    HIS  69           H        HIS  69   0.878  19.046   5.439
  504    HA   HIS  69           HA       HIS  69   0.141  17.238   7.630
  505    HB2  HIS  69           2HB      HIS  69   2.849  17.285   6.282
  506    HB3  HIS  69           3HB      HIS  69   2.590  16.614   7.888
  507    HD1  HIS  69           HD1      HIS  69   0.965  14.487   7.998
  508    HD2  HIS  69           HD2      HIS  69   2.265  15.584   4.209
  509    HE1  HIS  69           HE1      HIS  69   0.551  12.489   6.546
  510    HE2  HIS  69           HE2      HIS  69   1.529  13.105   4.314
  511    H    HIS  70           H        HIS  70   2.189  19.899   6.514
  512    HA   HIS  70           HA       HIS  70   2.273  20.954   9.272
  513    HB2  HIS  70           2HB      HIS  70   4.161  21.425   6.951
  514    HB3  HIS  70           3HB      HIS  70   4.249  22.287   8.484
  515    HD1  HIS  70           HD1      HIS  70   5.822  21.288  10.115
  516    HD2  HIS  70           HD2      HIS  70   4.386  18.463   7.432
  517    HE1  HIS  70           HE1      HIS  70   6.984  19.144  10.709
  518    HE2  HIS  70           HE2      HIS  70   5.939  17.417   9.207
  519    H    HIS  71           H        HIS  71   1.839  21.942   5.867
  520    HA   HIS  71           HA       HIS  71   1.050  24.619   6.566
  521    HB2  HIS  71           2HB      HIS  71   2.131  23.929   4.377
  522    HB3  HIS  71           3HB      HIS  71   0.592  23.208   3.923
  523    HD1  HIS  71           HD1      HIS  71  -1.031  24.735   2.775
  524    HD2  HIS  71           HD2      HIS  71   1.933  26.824   4.807
  525    HE1  HIS  71           HE1      HIS  71  -1.367  27.141   2.164
  526    HE2  HIS  71           HE2      HIS  71   0.545  28.355   3.254
  527    H    HIS  72           H        HIS  72  -0.789  24.878   7.693
  528    HA   HIS  72           HA       HIS  72  -3.060  23.090   7.208
  529    HB2  HIS  72           2HB      HIS  72  -2.406  23.280   9.519
  530    HB3  HIS  72           3HB      HIS  72  -2.469  25.038   9.448
  531    HD1  HIS  72           HD1      HIS  72  -4.876  22.105   9.054
  532    HD2  HIS  72           HD2      HIS  72  -4.827  26.055  10.342
  533    HE1  HIS  72           HE1      HIS  72  -7.187  22.564   9.911
  534    HE2  HIS  72           HE2      HIS  72  -7.182  25.002  10.510
  535    H    HIS  73           H        HIS  73  -5.075  23.738   6.621
  536    HA   HIS  73           HA       HIS  73  -5.529  26.613   6.123
  537    HB2  HIS  73           2HB      HIS  73  -5.328  25.395   3.991
  538    HB3  HIS  73           3HB      HIS  73  -6.604  24.289   4.493
  539    HD1  HIS  73           HD1      HIS  73  -6.171  28.028   3.922
  540    HD2  HIS  73           HD2      HIS  73  -9.073  25.065   3.670
  541    HE1  HIS  73           HE1      HIS  73  -8.212  29.162   3.000
  542    HE2  HIS  73           HE2      HIS  73  -9.879  27.307   2.672
  Start of MODEL   15
    1    H1   MET   1           1H       MET   1 -17.217  13.591  -2.590
    2    H2   MET   1           2H       MET   1 -17.071  14.576  -1.221
    3    H3   MET   1           3H       MET   1 -17.235  12.903  -1.046
    4    HA   MET   1           HA       MET   1 -14.952  14.245  -2.366
    5    HB2  MET   1           2HB      MET   1 -13.647  13.657  -0.373
    6    HB3  MET   1           3HB      MET   1 -14.974  14.733   0.036
    7    HG2  MET   1           2HG      MET   1 -16.259  12.855   0.896
    8    HG3  MET   1           3HG      MET   1 -14.972  11.744   0.432
    9    HE1  MET   1           3HE      MET   1 -12.358  13.383   1.193
   10    HE2  MET   1           1HE      MET   1 -12.579  11.678   1.584
   11    HE3  MET   1           2HE      MET   1 -12.069  12.807   2.836
   12    H    THR   2           H        THR   2 -13.313  12.855  -3.094
   13    HA   THR   2           HA       THR   2 -13.809   9.946  -2.846
   14    HB   THR   2           HB       THR   2 -14.404  10.654  -5.136
   15    HG1  THR   2           HG1      THR   2 -13.617   8.789  -5.719
   16   HG21  THR   2          3HG2      THR   2 -12.928  12.596  -5.348
   17   HG22  THR   2          1HG2      THR   2 -12.672  11.461  -6.674
   18   HG23  THR   2          2HG2      THR   2 -11.519  11.535  -5.341
   19    H    GLN   3           H        GLN   3 -11.675   8.760  -3.691
   20    HA   GLN   3           HA       GLN   3  -9.314  10.095  -2.526
   21    HB2  GLN   3           2HB      GLN   3 -10.316   7.316  -1.859
   22    HB3  GLN   3           3HB      GLN   3  -8.716   7.907  -1.430
   23    HG2  GLN   3           2HG      GLN   3  -9.740   9.671  -0.066
   24    HG3  GLN   3           3HG      GLN   3 -11.339   9.058  -0.483
   25   HE21  GLN   3          1HE2      GLN   3  -8.599   6.971   0.127
   26   HE22  GLN   3          2HE2      GLN   3  -9.194   6.318   1.608
   27    H    LYS   4           H        LYS   4  -7.263   9.183  -3.154
   28    HA   LYS   4           HA       LYS   4  -7.336   7.870  -5.780
   29    HB2  LYS   4           2HB      LYS   4  -5.115   9.301  -4.304
   30    HB3  LYS   4           3HB      LYS   4  -4.903   8.509  -5.857
   31    HG2  LYS   4           2HG      LYS   4  -7.037  10.581  -5.598
   32    HG3  LYS   4           3HG      LYS   4  -5.354  11.100  -5.673
   33    HD2  LYS   4           2HD      LYS   4  -6.225  11.145  -7.898
   34    HD3  LYS   4           3HD      LYS   4  -5.115   9.781  -7.791
   35    HE2  LYS   4           2HE      LYS   4  -7.076   9.128  -9.035
   36    HE3  LYS   4           3HE      LYS   4  -7.060   8.272  -7.495
   37    HZ1  LYS   4           3HZ      LYS   4  -8.665   9.862  -6.638
   38    HZ2  LYS   4           1HZ      LYS   4  -9.263   9.115  -8.033
   39    HZ3  LYS   4           2HZ      LYS   4  -8.665  10.698  -8.102
   40    H    PHE   5           H        PHE   5  -6.915   7.045  -2.546
   41    HA   PHE   5           HA       PHE   5  -5.642   4.503  -3.316
   42    HB2  PHE   5           2HB      PHE   5  -4.968   6.082  -0.818
   43    HB3  PHE   5           3HB      PHE   5  -4.311   4.508  -1.251
   44    HD1  PHE   5           HD2      PHE   5  -2.913   4.328  -3.363
   45    HD2  PHE   5           HD1      PHE   5  -3.972   8.061  -1.606
   46    HE1  PHE   5           HE2      PHE   5  -1.102   5.429  -4.613
   47    HE2  PHE   5           HE1      PHE   5  -2.164   9.166  -2.859
   48    HZ   PHE   5           HZ       PHE   5  -0.728   7.849  -4.362
   49    H    THR   6           H        THR   6  -7.029   2.926  -2.930
   50    HA   THR   6           HA       THR   6  -8.694   3.014  -0.482
   51    HB   THR   6           HB       THR   6 -10.222   3.257  -2.307
   52    HG1  THR   6           HG1      THR   6 -11.376   1.840  -1.246
   53   HG21  THR   6          3HG2      THR   6 -10.317   1.702  -4.203
   54   HG22  THR   6          1HG2      THR   6  -8.902   0.850  -3.581
   55   HG23  THR   6          2HG2      THR   6  -8.755   2.519  -4.133
   56    H    LYS   7           H        LYS   7  -9.450   0.781   0.195
   57    HA   LYS   7           HA       LYS   7  -7.161  -0.875   0.617
   58    HB2  LYS   7           2HB      LYS   7  -8.702  -2.363   1.825
   59    HB3  LYS   7           3HB      LYS   7  -8.909  -0.686   2.313
   60    HG2  LYS   7           2HG      LYS   7 -10.948  -0.485   1.123
   61    HG3  LYS   7           3HG      LYS   7 -10.671  -1.993   0.250
   62    HD2  LYS   7           2HD      LYS   7 -12.345  -2.303   1.996
   63    HD3  LYS   7           3HD      LYS   7 -10.897  -3.249   2.345
   64    HE2  LYS   7           2HE      LYS   7 -10.154  -1.493   3.910
   65    HE3  LYS   7           3HE      LYS   7 -11.637  -0.593   3.585
   66    HZ1  LYS   7           3HZ      LYS   7 -12.898  -2.505   4.429
   67    HZ2  LYS   7           1HZ      LYS   7 -11.866  -1.857   5.603
   68    HZ3  LYS   7           2HZ      LYS   7 -11.449  -3.293   4.809
   69    H    ASP   8           H        ASP   8  -9.651  -0.826  -1.761
   70    HA   ASP   8           HA       ASP   8  -9.576  -3.635  -2.398
   71    HB2  ASP   8           2HB      ASP   8 -11.582  -2.087  -2.582
   72    HB3  ASP   8           3HB      ASP   8 -10.825  -1.413  -4.021
   73    H    MET   9           H        MET   9  -8.046  -0.734  -3.664
   74    HA   MET   9           HA       MET   9  -7.337  -1.800  -6.206
   75    HB2  MET   9           2HB      MET   9  -5.934   0.170  -6.450
   76    HB3  MET   9           3HB      MET   9  -7.493   0.618  -5.773
   77    HG2  MET   9           2HG      MET   9  -6.434   0.621  -3.515
   78    HG3  MET   9           3HG      MET   9  -4.879   0.359  -4.302
   79    HE1  MET   9           3HE      MET   9  -3.728   2.117  -5.933
   80    HE2  MET   9           1HE      MET   9  -4.483   3.636  -6.413
   81    HE3  MET   9           2HE      MET   9  -5.175   2.101  -6.942
   82    H    THR  10           H        THR  10  -5.125  -2.162  -6.978
   83    HA   THR  10           HA       THR  10  -3.760  -4.003  -5.197
   84    HB   THR  10           HB       THR  10  -2.521  -4.747  -7.101
   85    HG1  THR  10           HG1      THR  10  -2.816  -3.553  -9.152
   86   HG21  THR  10          3HG2      THR  10  -5.322  -4.042  -8.004
   87   HG22  THR  10          1HG2      THR  10  -4.870  -5.464  -7.062
   88   HG23  THR  10          2HG2      THR  10  -4.289  -5.281  -8.716
   89    H    PHE  11           H        PHE  11  -1.462  -3.984  -4.807
   90    HA   PHE  11           HA       PHE  11  -0.361  -1.580  -3.945
   91    HB2  PHE  11           2HB      PHE  11   0.956  -4.191  -4.701
   92    HB3  PHE  11           3HB      PHE  11   1.867  -2.836  -4.045
   93    HD1  PHE  11           HD1      PHE  11   1.582  -2.139  -1.732
   94    HD2  PHE  11           HD2      PHE  11  -0.544  -5.487  -3.293
   95    HE1  PHE  11           HE1      PHE  11   1.038  -2.857   0.554
   96    HE2  PHE  11           HE2      PHE  11  -1.091  -6.206  -1.004
   97    HZ   PHE  11           HZ       PHE  11  -0.298  -4.890   0.923
   98    H    ALA  12           H        ALA  12   0.129  -3.237  -7.054
   99    HA   ALA  12           HA       ALA  12   2.148  -1.633  -8.109
  100    HB1  ALA  12           3HB      ALA  12  -0.109  -2.954  -9.620
  101    HB2  ALA  12           1HB      ALA  12   1.397  -3.732  -9.131
  102    HB3  ALA  12           2HB      ALA  12   1.426  -2.413 -10.304
  103    H    GLN  13           H        GLN  13  -1.384  -1.247  -8.494
  104    HA   GLN  13           HA       GLN  13  -1.376   1.067 -10.050
  105    HB2  GLN  13           2HB      GLN  13  -3.407   0.258  -7.950
  106    HB3  GLN  13           3HB      GLN  13  -3.671   1.449  -9.216
  107    HG2  GLN  13           2HG      GLN  13  -3.366  -0.308 -10.910
  108    HG3  GLN  13           3HG      GLN  13  -3.155  -1.493  -9.624
  109   HE21  GLN  13          1HE2      GLN  13  -5.441   1.169  -9.545
  110   HE22  GLN  13          2HE2      GLN  13  -6.859   0.191  -9.608
  111    H    ALA  14           H        ALA  14  -1.442   0.771  -6.502
  112    HA   ALA  14           HA       ALA  14  -1.549   3.498  -5.864
  113    HB1  ALA  14           3HB      ALA  14  -1.927   1.734  -4.219
  114    HB2  ALA  14           1HB      ALA  14  -0.670   2.844  -3.669
  115    HB3  ALA  14           2HB      ALA  14  -0.230   1.263  -4.317
  116    H    LEU  15           H        LEU  15   1.291   1.380  -6.264
  117    HA   LEU  15           HA       LEU  15   3.284   3.277  -5.730
  118    HB2  LEU  15           2HB      LEU  15   3.358   0.844  -7.523
  119    HB3  LEU  15           3HB      LEU  15   4.778   1.755  -7.040
  120    HG   LEU  15           HG       LEU  15   2.930   0.284  -5.150
  121   HD11  LEU  15          1HD1      LEU  15   4.192  -1.265  -6.528
  122   HD12  LEU  15          2HD1      LEU  15   4.799  -1.279  -4.872
  123   HD13  LEU  15          3HD1      LEU  15   5.694  -0.427  -6.132
  124   HD21  LEU  15          3HD2      LEU  15   3.961   2.231  -4.103
  125   HD22  LEU  15          1HD2      LEU  15   5.554   1.693  -4.639
  126   HD23  LEU  15          2HD2      LEU  15   4.649   0.740  -3.462
  127    H    GLN  16           H        GLN  16   1.532   2.602  -8.725
  128    HA   GLN  16           HA       GLN  16   3.207   4.287 -10.355
  129    HB2  GLN  16           2HB      GLN  16   0.406   3.282 -10.919
  130    HB3  GLN  16           3HB      GLN  16   1.517   3.969 -12.095
  131    HG2  GLN  16           2HG      GLN  16   1.815   1.363 -10.618
  132    HG3  GLN  16           3HG      GLN  16   1.484   1.585 -12.334
  133   HE21  GLN  16          1HE2      GLN  16   3.904   1.718  -9.848
  134   HE22  GLN  16          2HE2      GLN  16   5.268   1.818 -10.901
  135    H    THR  17           H        THR  17   0.172   4.686  -8.606
  136    HA   THR  17           HA       THR  17  -0.685   7.126  -9.687
  137    HB   THR  17           HB       THR  17  -1.112   6.076  -6.873
  138    HG1  THR  17           HG1      THR  17  -1.920   4.751  -8.634
  139   HG21  THR  17          3HG2      THR  17  -1.587   8.471  -6.966
  140   HG22  THR  17          1HG2      THR  17  -3.085   7.552  -6.824
  141   HG23  THR  17          2HG2      THR  17  -2.611   8.231  -8.382
  142    H    HIS  18           H        HIS  18   1.243   6.590  -6.704
  143    HA   HIS  18           HA       HIS  18   2.651   9.093  -7.235
  144    HB2  HIS  18           2HB      HIS  18   1.125   8.577  -4.678
  145    HB3  HIS  18           3HB      HIS  18   2.432   9.752  -4.777
  146    HD1  HIS  18           HD1      HIS  18   1.959  11.490  -7.005
  147    HD2  HIS  18           HD2      HIS  18  -1.260   9.774  -5.032
  148    HE1  HIS  18           HE1      HIS  18  -0.011  12.942  -7.552
  149    HE2  HIS  18           HE2      HIS  18  -1.976  11.769  -6.513
  150    HA   PRO  19           HA       PRO  19   6.052   6.582  -6.068
  151    HB2  PRO  19           2HB      PRO  19   7.971   8.458  -5.717
  152    HB3  PRO  19           3HB      PRO  19   7.298   8.074  -7.306
  153    HG2  PRO  19           2HG      PRO  19   6.658  10.360  -5.480
  154    HG3  PRO  19           3HG      PRO  19   6.863  10.356  -7.242
  155    HD2  PRO  19           2HD      PRO  19   4.425  10.341  -5.990
  156    HD3  PRO  19           3HD      PRO  19   4.696   9.673  -7.609
  157    H    GLY  20           H        GLY  20   5.039   9.105  -3.846
  158    HA2  GLY  20           2HA      GLY  20   6.686   8.503  -1.651
  159    HA3  GLY  20           3HA      GLY  20   5.095   9.240  -1.552
  160    H    VAL  21           H        VAL  21   3.924   6.826  -2.919
  161    HA   VAL  21           HA       VAL  21   3.011   5.412  -0.705
  162    HB   VAL  21           HB       VAL  21   3.191   4.431  -3.569
  163   HG11  VAL  21          1HG1      VAL  21   2.744   2.590  -2.044
  164   HG12  VAL  21          2HG1      VAL  21   1.294   2.975  -2.972
  165   HG13  VAL  21          3HG1      VAL  21   1.432   3.499  -1.294
  166   HG21  VAL  21          3HG2      VAL  21   0.893   5.269  -3.786
  167   HG22  VAL  21          1HG2      VAL  21   2.024   6.567  -3.408
  168   HG23  VAL  21          2HG2      VAL  21   0.974   5.917  -2.146
  169    H    ALA  22           H        ALA  22   5.733   4.696  -2.869
  170    HA   ALA  22           HA       ALA  22   6.412   2.160  -1.908
  171    HB1  ALA  22           3HB      ALA  22   8.261   4.308  -2.953
  172    HB2  ALA  22           1HB      ALA  22   7.387   3.127  -3.930
  173    HB3  ALA  22           2HB      ALA  22   8.645   2.592  -2.816
  174    H    GLY  23           H        GLY  23   7.623   5.350  -0.836
  175    HA2  GLY  23           2HA      GLY  23   9.306   4.457   1.227
  176    HA3  GLY  23           3HA      GLY  23   8.558   6.044   1.147
  177    H    VAL  24           H        VAL  24   5.833   5.208   1.276
  178    HA   VAL  24           HA       VAL  24   5.494   4.914   4.081
  179    HB   VAL  24           HB       VAL  24   3.440   4.575   1.881
  180   HG11  VAL  24          1HG1      VAL  24   2.672   3.595   3.974
  181   HG12  VAL  24          2HG1      VAL  24   1.788   5.083   3.638
  182   HG13  VAL  24          3HG1      VAL  24   3.077   5.076   4.842
  183   HG21  VAL  24          3HG2      VAL  24   4.531   6.767   1.813
  184   HG22  VAL  24          1HG2      VAL  24   4.153   7.017   3.517
  185   HG23  VAL  24          2HG2      VAL  24   2.852   6.910   2.331
  186    H    LEU  25           H        LEU  25   4.814   2.648   1.385
  187    HA   LEU  25           HA       LEU  25   3.936   0.487   2.921
  188    HB2  LEU  25           2HB      LEU  25   5.459   0.423   0.308
  189    HB3  LEU  25           3HB      LEU  25   4.589  -0.935   0.998
  190    HG   LEU  25           HG       LEU  25   3.376   1.652   0.004
  191   HD11  LEU  25          1HD1      LEU  25   2.327   0.240  -1.689
  192   HD12  LEU  25          2HD1      LEU  25   3.180  -1.168  -1.054
  193   HD13  LEU  25          3HD1      LEU  25   4.087   0.159  -1.784
  194   HD21  LEU  25          3HD2      LEU  25   2.011  -0.757   1.216
  195   HD22  LEU  25          1HD2      LEU  25   1.204   0.633   0.487
  196   HD23  LEU  25          2HD2      LEU  25   2.155   0.839   1.958
  197    H    ARG  26           H        ARG  26   7.252   1.247   1.833
  198    HA   ARG  26           HA       ARG  26   8.535  -0.949   3.039
  199    HB2  ARG  26           2HB      ARG  26   9.601   1.826   2.458
  200    HB3  ARG  26           3HB      ARG  26  10.597   0.434   2.872
  201    HG2  ARG  26           2HG      ARG  26   9.960  -0.703   0.853
  202    HG3  ARG  26           3HG      ARG  26   8.777   0.547   0.468
  203    HD2  ARG  26           2HD      ARG  26  10.730   0.891  -0.888
  204    HD3  ARG  26           3HD      ARG  26  10.635   2.188   0.303
  205    HE   ARG  26           HE       ARG  26  12.352  -0.129   0.852
  206   HH11  ARG  26          1HH1      ARG  26  12.021   3.221   0.173
  207   HH12  ARG  26          2HH1      ARG  26  13.677   3.572   0.498
  208   HH21  ARG  26          1HH2      ARG  26  14.490   0.318   1.248
  209   HH22  ARG  26          2HH2      ARG  26  15.063   1.942   1.092
  210    H    SER  27           H        SER  27   7.615   2.202   4.344
  211    HA   SER  27           HA       SER  27   8.895   1.904   6.873
  212    HB2  SER  27           2HB      SER  27   8.199   4.109   6.080
  213    HB3  SER  27           3HB      SER  27   6.509   3.602   6.077
  214    HG   SER  27           HG       SER  27   6.460   4.220   8.075
  215    H    TYR  28           H        TYR  28   5.757   0.942   5.625
  216    HA   TYR  28           HA       TYR  28   4.911  -0.055   8.247
  217    HB2  TYR  28           2HB      TYR  28   3.488   0.360   5.620
  218    HB3  TYR  28           3HB      TYR  28   2.764  -0.596   6.910
  219    HD1  TYR  28           HD2      TYR  28   4.242   2.781   6.269
  220    HD2  TYR  28           HD1      TYR  28   1.487   0.472   8.554
  221    HE1  TYR  28           HE2      TYR  28   3.391   4.839   7.310
  222    HE2  TYR  28           HE1      TYR  28   0.628   2.526   9.598
  223    HH   TYR  28           HH       TYR  28   1.253   4.773  10.029
  224    H    ASN  29           H        ASN  29   7.094  -1.352   6.754
  225    HA   ASN  29           HA       ASN  29   7.906  -3.472   6.644
  226    HB2  ASN  29           2HB      ASN  29   6.493  -3.804   8.690
  227    HB3  ASN  29           3HB      ASN  29   5.201  -4.392   7.649
  228   HD21  ASN  29          1HD2      ASN  29   8.301  -5.071   9.029
  229   HD22  ASN  29          2HD2      ASN  29   8.346  -6.749   8.611
  230    H    LEU  30           H        LEU  30   5.299  -2.470   4.771
  231    HA   LEU  30           HA       LEU  30   4.841  -4.914   3.314
  232    HB2  LEU  30           2HB      LEU  30   4.027  -2.070   2.685
  233    HB3  LEU  30           3HB      LEU  30   3.456  -3.496   1.836
  234    HG   LEU  30           HG       LEU  30   2.936  -2.848   4.748
  235   HD11  LEU  30          1HD1      LEU  30   0.614  -2.559   4.036
  236   HD12  LEU  30          2HD1      LEU  30   1.091  -2.821   2.359
  237   HD13  LEU  30          3HD1      LEU  30   1.685  -1.409   3.235
  238   HD21  LEU  30          3HD2      LEU  30   1.431  -4.789   4.698
  239   HD22  LEU  30          1HD2      LEU  30   3.105  -5.255   4.395
  240   HD23  LEU  30          2HD2      LEU  30   1.961  -5.157   3.056
  241    H    GLY  31           H        GLY  31   7.480  -3.014   3.344
  242    HA2  GLY  31           2HA      GLY  31   8.065  -2.459   0.649
  243    HA3  GLY  31           3HA      GLY  31   9.252  -2.692   1.920
  244    H    CYS  32           H        CYS  32   7.814  -5.500   2.156
  245    HA   CYS  32           HA       CYS  32   9.666  -6.844   0.353
  246    HB2  CYS  32           2HB      CYS  32   7.844  -7.937   2.510
  247    HB3  CYS  32           3HB      CYS  32   8.972  -8.908   1.570
  248    HG   CYS  32           HG       CYS  32  10.765  -8.696   3.382
  249    H    ILE  33           H        ILE  33   6.760  -5.607  -0.273
  250    HA   ILE  33           HA       ILE  33   5.147  -7.677  -1.220
  251    HB   ILE  33           HB       ILE  33   4.218  -5.995  -2.860
  252   HG12  ILE  33          2HG1      ILE  33   6.209  -4.158  -1.493
  253   HG13  ILE  33          3HG1      ILE  33   6.272  -4.664  -3.177
  254   HG21  ILE  33          1HG2      ILE  33   3.184  -4.614  -1.109
  255   HG22  ILE  33          2HG2      ILE  33   4.388  -5.188   0.044
  256   HG23  ILE  33          3HG2      ILE  33   3.237  -6.321  -0.664
  257   HD11  ILE  33          3HD1      ILE  33   4.147  -2.960  -1.896
  258   HD12  ILE  33          1HD1      ILE  33   4.129  -3.517  -3.572
  259   HD13  ILE  33          2HD1      ILE  33   5.401  -2.430  -3.019
  260    H    GLY  34           H        GLY  34   7.939  -6.166  -2.772
  261    HA2  GLY  34           2HA      GLY  34   7.601  -7.278  -5.350
  262    HA3  GLY  34           3HA      GLY  34   9.128  -6.755  -4.656
  263    H    CYS  35           H        CYS  35   9.507  -8.460  -2.580
  264    HA   CYS  35           HA       CYS  35  10.510 -10.786  -3.768
  265    HB2  CYS  35           2HB      CYS  35  11.402  -9.934  -1.676
  266    HB3  CYS  35           3HB      CYS  35   9.871 -10.237  -0.862
  267    HG   CYS  35           HG       CYS  35  11.857 -12.708  -2.171
  268    H    MET  36           H        MET  36   7.496 -10.320  -1.922
  269    HA   MET  36           HA       MET  36   6.690 -13.075  -2.338
  270    HB2  MET  36           2HB      MET  36   4.627 -12.443  -1.154
  271    HB3  MET  36           3HB      MET  36   6.065 -11.976  -0.262
  272    HG2  MET  36           2HG      MET  36   5.791  -9.665  -1.097
  273    HG3  MET  36           3HG      MET  36   4.296 -10.159  -1.887
  274    HE1  MET  36           3HE      MET  36   3.051 -12.178   0.242
  275    HE2  MET  36           1HE      MET  36   2.107 -10.932  -0.574
  276    HE3  MET  36           2HE      MET  36   2.031 -11.088   1.181
  277    H    GLY  37           H        GLY  37   6.652 -10.358  -4.267
  278    HA2  GLY  37           2HA      GLY  37   5.795 -10.007  -6.371
  279    HA3  GLY  37           3HA      GLY  37   5.164 -11.642  -6.323
  280    H    ALA  38           H        ALA  38   4.255  -9.292  -3.911
  281    HA   ALA  38           HA       ALA  38   1.466  -9.635  -4.599
  282    HB1  ALA  38           3HB      ALA  38   2.182  -9.709  -2.256
  283    HB2  ALA  38           1HB      ALA  38   1.010  -8.420  -2.531
  284    HB3  ALA  38           2HB      ALA  38   2.725  -8.034  -2.365
  285    H    GLN  39           H        GLN  39   2.458  -8.395  -6.715
  286    HA   GLN  39           HA       GLN  39   2.146  -5.514  -6.512
  287    HB2  GLN  39           2HB      GLN  39   2.519  -7.303  -8.929
  288    HB3  GLN  39           3HB      GLN  39   2.520  -5.545  -8.968
  289    HG2  GLN  39           2HG      GLN  39   4.495  -7.263  -7.470
  290    HG3  GLN  39           3HG      GLN  39   4.783  -6.482  -9.024
  291   HE21  GLN  39          1HE2      GLN  39   4.418  -5.987  -5.597
  292   HE22  GLN  39          2HE2      GLN  39   5.004  -4.365  -5.573
  293    H    ASN  40           H        ASN  40   0.349  -8.238  -7.897
  294    HA   ASN  40           HA       ASN  40  -1.864  -6.543  -8.724
  295    HB2  ASN  40           2HB      ASN  40  -1.711  -9.564  -8.757
  296    HB3  ASN  40           3HB      ASN  40  -2.821  -8.541  -9.665
  297   HD21  ASN  40          1HD2      ASN  40   0.383  -9.802  -9.464
  298   HD22  ASN  40          2HD2      ASN  40   0.910  -9.255 -11.016
  299    H    GLU  41           H        GLU  41  -0.916  -7.989  -5.868
  300    HA   GLU  41           HA       GLU  41  -3.495  -8.747  -4.865
  301    HB2  GLU  41           2HB      GLU  41  -1.336  -9.726  -4.070
  302    HB3  GLU  41           3HB      GLU  41  -0.957  -8.187  -3.310
  303    HG2  GLU  41           2HG      GLU  41  -2.652  -8.424  -1.711
  304    HG3  GLU  41           3HG      GLU  41  -3.477  -9.675  -2.641
  305    H    SER  42           H        SER  42  -4.837  -7.612  -3.451
  306    HA   SER  42           HA       SER  42  -4.818  -4.771  -3.782
  307    HB2  SER  42           2HB      SER  42  -6.615  -6.473  -2.032
  308    HB3  SER  42           3HB      SER  42  -6.908  -4.798  -2.502
  309    HG   SER  42           HG       SER  42  -7.871  -5.626  -4.169
  310    H    LEU  43           H        LEU  43  -4.746  -3.155  -2.165
  311    HA   LEU  43           HA       LEU  43  -2.600  -3.273  -0.436
  312    HB2  LEU  43           2HB      LEU  43  -5.022  -1.475  -0.359
  313    HB3  LEU  43           3HB      LEU  43  -3.613  -1.230   0.657
  314    HG   LEU  43           HG       LEU  43  -3.637  -1.150  -2.371
  315   HD11  LEU  43          1HD1      LEU  43  -3.355   1.060  -0.333
  316   HD12  LEU  43          2HD1      LEU  43  -4.735   0.789  -1.398
  317   HD13  LEU  43          3HD1      LEU  43  -3.173   1.242  -2.079
  318   HD21  LEU  43          3HD2      LEU  43  -1.321  -0.375  -2.158
  319   HD22  LEU  43          1HD2      LEU  43  -1.521  -2.004  -1.513
  320   HD23  LEU  43          2HD2      LEU  43  -1.395  -0.629  -0.413
  321    H    GLU  44           H        GLU  44  -6.035  -3.795   0.393
  322    HA   GLU  44           HA       GLU  44  -5.656  -4.065   3.172
  323    HB2  GLU  44           2HB      GLU  44  -7.875  -3.730   2.200
  324    HB3  GLU  44           3HB      GLU  44  -7.793  -5.308   1.426
  325    HG2  GLU  44           2HG      GLU  44  -7.801  -6.412   3.577
  326    HG3  GLU  44           3HG      GLU  44  -7.734  -4.859   4.408
  327    H    GLN  45           H        GLN  45  -5.780  -6.546   0.632
  328    HA   GLN  45           HA       GLN  45  -5.512  -8.821   2.207
  329    HB2  GLN  45           2HB      GLN  45  -4.370  -8.370  -0.563
  330    HB3  GLN  45           3HB      GLN  45  -4.675  -9.933   0.183
  331    HG2  GLN  45           2HG      GLN  45  -7.067  -9.480   0.202
  332    HG3  GLN  45           3HG      GLN  45  -6.782  -7.882  -0.484
  333   HE21  GLN  45          1HE2      GLN  45  -8.017  -8.291  -2.311
  334   HE22  GLN  45          2HE2      GLN  45  -7.506  -9.374  -3.558
  335    H    GLY  46           H        GLY  46  -2.893  -6.983   0.599
  336    HA2  GLY  46           2HA      GLY  46  -0.750  -8.461   1.684
  337    HA3  GLY  46           3HA      GLY  46  -0.644  -6.828   1.051
  338    H    ALA  47           H        ALA  47  -2.399  -5.564   2.912
  339    HA   ALA  47           HA       ALA  47  -0.682  -4.949   5.036
  340    HB1  ALA  47           3HB      ALA  47  -2.475  -3.460   4.305
  341    HB2  ALA  47           1HB      ALA  47  -2.597  -3.786   6.034
  342    HB3  ALA  47           2HB      ALA  47  -3.681  -4.599   4.903
  343    H    ASN  48           H        ASN  48  -3.696  -6.885   5.163
  344    HA   ASN  48           HA       ASN  48  -3.364  -7.741   7.831
  345    HB2  ASN  48           2HB      ASN  48  -4.956  -8.928   5.550
  346    HB3  ASN  48           3HB      ASN  48  -5.036  -9.527   7.205
  347   HD21  ASN  48          1HD2      ASN  48  -5.911  -6.970   5.054
  348   HD22  ASN  48          2HD2      ASN  48  -6.952  -6.133   6.146
  349    H    ALA  49           H        ALA  49  -2.138  -9.031   4.805
  350    HA   ALA  49           HA       ALA  49  -1.229 -11.531   5.707
  351    HB1  ALA  49           3HB      ALA  49   0.317 -11.461   3.802
  352    HB2  ALA  49           1HB      ALA  49  -0.011  -9.738   3.598
  353    HB3  ALA  49           2HB      ALA  49  -1.297 -10.918   3.343
  354    H    HIS  50           H        HIS  50   0.193  -8.313   6.008
  355    HA   HIS  50           HA       HIS  50   2.587  -9.425   7.302
  356    HB2  HIS  50           2HB      HIS  50   1.935  -6.663   6.270
  357    HB3  HIS  50           3HB      HIS  50   3.379  -7.008   7.216
  358    HD1  HIS  50           HD1      HIS  50   5.353  -7.311   5.772
  359    HD2  HIS  50           HD2      HIS  50   1.889  -8.651   3.901
  360    HE1  HIS  50           HE1      HIS  50   6.081  -8.126   3.515
  361    HE2  HIS  50           HE2      HIS  50   4.004  -9.096   2.478
  362    H    GLY  51           H        GLY  51  -0.379  -8.727   8.375
  363    HA2  GLY  51           2HA      GLY  51  -1.082  -8.689  10.592
  364    HA3  GLY  51           3HA      GLY  51   0.582  -8.449  11.088
  365    H    LEU  52           H        LEU  52  -1.042  -6.325   8.800
  366    HA   LEU  52           HA       LEU  52  -1.343  -4.268  10.909
  367    HB2  LEU  52           2HB      LEU  52  -0.408  -3.825   8.065
  368    HB3  LEU  52           3HB      LEU  52  -0.724  -2.557   9.234
  369    HG   LEU  52           HG       LEU  52   1.451  -4.650   9.437
  370   HD11  LEU  52          1HD1      LEU  52   2.984  -2.785   9.098
  371   HD12  LEU  52          2HD1      LEU  52   1.619  -1.683   8.906
  372   HD13  LEU  52          3HD1      LEU  52   1.891  -2.965   7.726
  373   HD21  LEU  52          3HD2      LEU  52   0.819  -2.329  11.268
  374   HD22  LEU  52          1HD2      LEU  52   2.227  -3.388  11.385
  375   HD23  LEU  52          2HD2      LEU  52   0.610  -4.040  11.645
  376    H    ASN  53           H        ASN  53  -2.920  -2.508  10.280
  377    HA   ASN  53           HA       ASN  53  -5.138  -3.647   8.713
  378    HB2  ASN  53           2HB      ASN  53  -5.648  -2.900  11.033
  379    HB3  ASN  53           3HB      ASN  53  -5.199  -1.258  10.576
  380   HD21  ASN  53          1HD2      ASN  53  -7.277  -0.490  11.025
  381   HD22  ASN  53          2HD2      ASN  53  -8.625  -0.837   9.997
  382    H    VAL  54           H        VAL  54  -5.850  -2.727   6.874
  383    HA   VAL  54           HA       VAL  54  -4.032  -1.208   5.372
  384    HB   VAL  54           HB       VAL  54  -5.664  -2.808   4.424
  385   HG11  VAL  54          1HG1      VAL  54  -7.627  -2.186   5.739
  386   HG12  VAL  54          2HG1      VAL  54  -7.975  -2.122   4.012
  387   HG13  VAL  54          3HG1      VAL  54  -7.700  -0.630   4.911
  388   HG21  VAL  54          3HG2      VAL  54  -4.537  -1.242   2.947
  389   HG22  VAL  54          1HG2      VAL  54  -5.777  -0.023   3.254
  390   HG23  VAL  54          2HG2      VAL  54  -6.192  -1.507   2.396
  391    H    GLU  55           H        GLU  55  -6.792  -0.175   7.290
  392    HA   GLU  55           HA       GLU  55  -7.314   2.265   5.980
  393    HB2  GLU  55           2HB      GLU  55  -7.865   1.450   8.839
  394    HB3  GLU  55           3HB      GLU  55  -8.529   2.884   8.061
  395    HG2  GLU  55           2HG      GLU  55  -9.678   1.496   6.429
  396    HG3  GLU  55           3HG      GLU  55  -8.977   0.047   7.146
  397    H    ASP  56           H        ASP  56  -5.331   1.641   8.896
  398    HA   ASP  56           HA       ASP  56  -4.456   4.251   9.348
  399    HB2  ASP  56           2HB      ASP  56  -4.037   2.378  10.896
  400    HB3  ASP  56           3HB      ASP  56  -2.906   1.677   9.744
  401    H    ILE  57           H        ILE  57  -3.135   1.785   7.170
  402    HA   ILE  57           HA       ILE  57  -0.927   3.274   6.212
  403    HB   ILE  57           HB       ILE  57  -2.478   1.141   4.722
  404   HG12  ILE  57          2HG1      ILE  57  -0.115   0.811   6.599
  405   HG13  ILE  57          3HG1      ILE  57  -1.779   0.397   6.997
  406   HG21  ILE  57          1HG2      ILE  57  -0.910   2.394   3.320
  407   HG22  ILE  57          2HG2      ILE  57  -0.359   0.736   3.554
  408   HG23  ILE  57          3HG2      ILE  57   0.395   2.051   4.456
  409   HD11  ILE  57          3HD1      ILE  57  -0.473  -1.565   6.400
  410   HD12  ILE  57          1HD1      ILE  57  -0.128  -0.866   4.818
  411   HD13  ILE  57          2HD1      ILE  57  -1.784  -1.296   5.251
  412    H    LEU  58           H        LEU  58  -4.201   2.797   4.856
  413    HA   LEU  58           HA       LEU  58  -3.965   4.380   2.576
  414    HB2  LEU  58           2HB      LEU  58  -6.382   3.865   4.316
  415    HB3  LEU  58           3HB      LEU  58  -6.459   4.642   2.746
  416    HG   LEU  58           HG       LEU  58  -5.533   1.810   3.260
  417   HD11  LEU  58          1HD1      LEU  58  -8.080   2.852   2.017
  418   HD12  LEU  58          2HD1      LEU  58  -7.932   2.073   3.592
  419   HD13  LEU  58          3HD1      LEU  58  -7.599   1.159   2.123
  420   HD21  LEU  58          3HD2      LEU  58  -5.542   1.589   0.816
  421   HD22  LEU  58          1HD2      LEU  58  -4.374   2.796   1.357
  422   HD23  LEU  58          2HD2      LEU  58  -5.913   3.306   0.663
  423    H    ARG  59           H        ARG  59  -4.794   5.310   5.887
  424    HA   ARG  59           HA       ARG  59  -5.495   7.965   5.495
  425    HB2  ARG  59           2HB      ARG  59  -5.738   6.941   7.657
  426    HB3  ARG  59           3HB      ARG  59  -4.008   6.656   7.783
  427    HG2  ARG  59           2HG      ARG  59  -3.556   8.966   8.090
  428    HG3  ARG  59           3HG      ARG  59  -5.196   9.419   7.626
  429    HD2  ARG  59           2HD      ARG  59  -4.822   9.549  10.063
  430    HD3  ARG  59           3HD      ARG  59  -6.092   8.408   9.627
  431    HE   ARG  59           HE       ARG  59  -3.668   7.007   9.866
  432   HH11  ARG  59          1HH1      ARG  59  -5.979   8.665  11.804
  433   HH12  ARG  59          2HH1      ARG  59  -5.617   7.753  13.225
  434   HH21  ARG  59          1HH2      ARG  59  -3.236   5.805  11.696
  435   HH22  ARG  59          2HH2      ARG  59  -4.082   6.154  13.164
  436    H    ASP  60           H        ASP  60  -2.228   6.612   5.976
  437    HA   ASP  60           HA       ASP  60  -0.912   9.133   5.683
  438    HB2  ASP  60           2HB      ASP  60  -0.104   6.894   6.813
  439    HB3  ASP  60           3HB      ASP  60   0.491   6.521   5.198
  440    H    LEU  61           H        LEU  61  -1.642   6.455   3.472
  441    HA   LEU  61           HA       LEU  61  -0.143   7.323   1.254
  442    HB2  LEU  61           2HB      LEU  61  -2.703   5.719   1.361
  443    HB3  LEU  61           3HB      LEU  61  -1.742   5.940  -0.090
  444    HG   LEU  61           HG       LEU  61  -0.836   4.530   2.430
  445   HD11  LEU  61          1HD1      LEU  61  -0.885   2.508   1.037
  446   HD12  LEU  61          2HD1      LEU  61  -1.560   3.448  -0.294
  447   HD13  LEU  61          3HD1      LEU  61  -2.483   3.238   1.194
  448   HD21  LEU  61          3HD2      LEU  61   1.018   5.665   1.321
  449   HD22  LEU  61          1HD2      LEU  61   0.578   4.910  -0.212
  450   HD23  LEU  61          2HD2      LEU  61   1.147   3.918   1.131
  451    H    ASN  62           H        ASN  62  -3.615   7.857   1.951
  452    HA   ASN  62           HA       ASN  62  -4.023   9.591  -0.258
  453    HB2  ASN  62           2HB      ASN  62  -5.617   9.160   2.275
  454    HB3  ASN  62           3HB      ASN  62  -6.131  10.259   0.998
  455   HD21  ASN  62          1HD2      ASN  62  -5.772   6.962   1.949
  456   HD22  ASN  62          2HD2      ASN  62  -6.569   6.262   0.588
  457    H    ALA  63           H        ALA  63  -2.842  10.108   2.993
  458    HA   ALA  63           HA       ALA  63  -3.050  12.902   3.142
  459    HB1  ALA  63           3HB      ALA  63  -2.391  11.502   5.044
  460    HB2  ALA  63           1HB      ALA  63  -1.232  12.802   4.765
  461    HB3  ALA  63           2HB      ALA  63  -0.852  11.156   4.256
  462    H    LEU  64           H        LEU  64  -0.897  10.872   1.292
  463    HA   LEU  64           HA       LEU  64   1.062  12.820   0.619
  464    HB2  LEU  64           2HB      LEU  64   0.172  10.393  -0.946
  465    HB3  LEU  64           3HB      LEU  64   1.646  11.299  -1.224
  466    HG   LEU  64           HG       LEU  64   1.011   9.751   1.297
  467   HD11  LEU  64          1HD1      LEU  64   2.869   9.065  -0.981
  468   HD12  LEU  64          2HD1      LEU  64   1.343   8.265  -0.608
  469   HD13  LEU  64          3HD1      LEU  64   2.692   8.157   0.522
  470   HD21  LEU  64          3HD2      LEU  64   3.554  11.134   0.423
  471   HD22  LEU  64          1HD2      LEU  64   3.368  10.129   1.862
  472   HD23  LEU  64          2HD2      LEU  64   2.483  11.647   1.728
  473    H    ALA  65           H        ALA  65  -2.156  12.214  -0.540
  474    HA   ALA  65           HA       ALA  65  -1.852  13.951  -2.868
  475    HB1  ALA  65           3HB      ALA  65  -4.297  12.558  -1.762
  476    HB2  ALA  65           1HB      ALA  65  -3.270  11.973  -3.072
  477    HB3  ALA  65           2HB      ALA  65  -4.222  13.444  -3.286
  478    H    LEU  66           H        LEU  66  -3.218  14.021   0.367
  479    HA   LEU  66           HA       LEU  66  -4.569  16.517   0.135
  480    HB2  LEU  66           2HB      LEU  66  -3.491  15.165   2.616
  481    HB3  LEU  66           3HB      LEU  66  -4.687  16.448   2.579
  482    HG   LEU  66           HG       LEU  66  -5.057  13.642   1.507
  483   HD11  LEU  66          1HD1      LEU  66  -6.268  15.022   3.903
  484   HD12  LEU  66          2HD1      LEU  66  -5.071  13.727   3.937
  485   HD13  LEU  66          3HD1      LEU  66  -6.690  13.411   3.317
  486   HD21  LEU  66          3HD2      LEU  66  -6.997  15.956   1.587
  487   HD22  LEU  66          1HD2      LEU  66  -7.386  14.299   1.120
  488   HD23  LEU  66          2HD2      LEU  66  -6.272  15.252   0.141
  489    H    GLU  67           H        GLU  67  -1.471  15.647   1.672
  490    HA   GLU  67           HA       GLU  67   0.464  16.754   2.023
  491    HB2  GLU  67           2HB      GLU  67  -0.557  18.493  -0.228
  492    HB3  GLU  67           3HB      GLU  67   1.076  18.573   0.422
  493    HG2  GLU  67           2HG      GLU  67   1.456  16.245  -0.229
  494    HG3  GLU  67           3HG      GLU  67  -0.183  16.156  -0.872
  495    H    HIS  68           H        HIS  68  -2.437  18.249   2.758
  496    HA   HIS  68           HA       HIS  68  -1.517  20.817   3.573
  497    HB2  HIS  68           2HB      HIS  68  -3.980  19.292   4.457
  498    HB3  HIS  68           3HB      HIS  68  -3.688  21.008   4.723
  499    HD1  HIS  68           HD1      HIS  68  -2.956  22.124   2.108
  500    HD2  HIS  68           HD2      HIS  68  -5.747  19.057   2.420
  501    HE1  HIS  68           HE1      HIS  68  -4.314  22.227   0.002
  502    HE2  HIS  68           HE2      HIS  68  -5.905  20.295   0.158
  503    H    HIS  69           H        HIS  69  -2.083  17.775   5.329
  504    HA   HIS  69           HA       HIS  69  -1.056  18.883   7.803
  505    HB2  HIS  69           2HB      HIS  69  -1.889  16.068   7.066
  506    HB3  HIS  69           3HB      HIS  69  -1.388  16.570   8.679
  507    HD1  HIS  69           HD1      HIS  69  -4.359  15.991   6.845
  508    HD2  HIS  69           HD2      HIS  69  -3.146  18.929   9.522
  509    HE1  HIS  69           HE1      HIS  69  -6.470  17.077   7.662
  510    HE2  HIS  69           HE2      HIS  69  -5.715  18.861   9.259
  511    H    HIS  70           H        HIS  70   1.051  19.337   7.773
  512    HA   HIS  70           HA       HIS  70   2.893  17.768   6.154
  513    HB2  HIS  70           2HB      HIS  70   2.771  20.294   6.161
  514    HB3  HIS  70           3HB      HIS  70   3.447  20.259   7.785
  515    HD1  HIS  70           HD1      HIS  70   5.940  19.897   8.003
  516    HD2  HIS  70           HD2      HIS  70   4.580  19.527   4.100
  517    HE1  HIS  70           HE1      HIS  70   8.001  19.847   6.578
  518    HE2  HIS  70           HE2      HIS  70   7.161  19.467   4.241
  519    H    HIS  71           H        HIS  71   1.978  16.336   8.426
  520    HA   HIS  71           HA       HIS  71   2.728  14.992  10.099
  521    HB2  HIS  71           2HB      HIS  71   5.475  15.856   9.153
  522    HB3  HIS  71           3HB      HIS  71   5.147  14.500  10.229
  523    HD1  HIS  71           HD1      HIS  71   5.899  15.110   6.847
  524    HD2  HIS  71           HD2      HIS  71   3.189  12.626   8.781
  525    HE1  HIS  71           HE1      HIS  71   5.320  13.322   5.184
  526    HE2  HIS  71           HE2      HIS  71   3.819  11.742   6.436
  527    H    HIS  72           H        HIS  72   2.344  17.959  10.549
  528    HA   HIS  72           HA       HIS  72   4.278  18.862  12.428
  529    HB2  HIS  72           2HB      HIS  72   2.856  20.751  12.783
  530    HB3  HIS  72           3HB      HIS  72   2.723  20.336  11.080
  531    HD1  HIS  72           HD1      HIS  72   0.728  20.850  14.102
  532    HD2  HIS  72           HD2      HIS  72   0.225  18.965  10.437
  533    HE1  HIS  72           HE1      HIS  72  -1.741  20.508  13.859
  534    HE2  HIS  72           HE2      HIS  72  -1.995  19.169  11.748
  535    H    HIS  73           H        HIS  73   1.506  16.825  12.748
  536    HA   HIS  73           HA       HIS  73   0.352  15.923  14.483
  537    HB2  HIS  73           2HB      HIS  73   2.568  15.000  15.033
  538    HB3  HIS  73           3HB      HIS  73   2.936  16.430  15.990
  539    HD1  HIS  73           HD1      HIS  73   1.479  16.737  18.213
  540    HD2  HIS  73           HD2      HIS  73   1.187  13.024  16.371
  541    HE1  HIS  73           HE1      HIS  73   0.505  15.206  19.943
  542    HE2  HIS  73           HE2      HIS  73   0.522  12.935  18.870
  Start of MODEL   16
    1    H1   MET   1           1H       MET   1 -17.460  11.331  -0.136
    2    H2   MET   1           2H       MET   1 -18.119  10.947  -1.641
    3    H3   MET   1           3H       MET   1 -17.971  12.565  -1.174
    4    HA   MET   1           HA       MET   1 -16.281  11.961  -2.777
    5    HB2  MET   1           2HB      MET   1 -14.310  12.726  -1.477
    6    HB3  MET   1           3HB      MET   1 -15.740  13.703  -1.178
    7    HG2  MET   1           2HG      MET   1 -16.114  12.534   0.932
    8    HG3  MET   1           3HG      MET   1 -14.704  11.521   0.627
    9    HE1  MET   1           3HE      MET   1 -14.443  16.082   1.319
   10    HE2  MET   1           1HE      MET   1 -15.964  15.188   1.298
   11    HE3  MET   1           2HE      MET   1 -15.025  15.367  -0.186
   12    H    THR   2           H        THR   2 -15.134  10.331  -3.662
   13    HA   THR   2           HA       THR   2 -14.582   7.938  -2.058
   14    HB   THR   2           HB       THR   2 -15.606   7.540  -4.237
   15    HG1  THR   2           HG1      THR   2 -13.328   6.447  -5.041
   16   HG21  THR   2          3HG2      THR   2 -13.125   8.808  -5.426
   17   HG22  THR   2          1HG2      THR   2 -14.745   9.510  -5.432
   18   HG23  THR   2          2HG2      THR   2 -14.424   8.026  -6.327
   19    H    GLN   3           H        GLN   3 -12.499   6.961  -1.973
   20    HA   GLN   3           HA       GLN   3 -10.343   8.918  -1.878
   21    HB2  GLN   3           2HB      GLN   3 -10.570   6.060  -0.927
   22    HB3  GLN   3           3HB      GLN   3  -9.068   6.970  -0.848
   23    HG2  GLN   3           2HG      GLN   3 -10.117   8.612   0.611
   24    HG3  GLN   3           3HG      GLN   3 -11.647   7.741   0.509
   25   HE21  GLN   3          1HE2      GLN   3  -8.598   6.054   0.688
   26   HE22  GLN   3          2HE2      GLN   3  -8.802   5.470   2.297
   27    H    LYS   4           H        LYS   4  -8.696   9.067  -3.295
   28    HA   LYS   4           HA       LYS   4  -8.473   7.522  -5.644
   29    HB2  LYS   4           2HB      LYS   4  -6.410   9.204  -4.194
   30    HB3  LYS   4           3HB      LYS   4  -6.158   8.509  -5.788
   31    HG2  LYS   4           2HG      LYS   4  -8.337  10.475  -5.084
   32    HG3  LYS   4           3HG      LYS   4  -6.808  10.888  -5.862
   33    HD2  LYS   4           2HD      LYS   4  -8.937   9.047  -6.978
   34    HD3  LYS   4           3HD      LYS   4  -8.612  10.700  -7.507
   35    HE2  LYS   4           2HE      LYS   4  -6.328   9.992  -8.173
   36    HE3  LYS   4           3HE      LYS   4  -6.734   8.338  -7.722
   37    HZ1  LYS   4           3HZ      LYS   4  -8.536   8.418  -9.386
   38    HZ2  LYS   4           1HZ      LYS   4  -7.002   8.602 -10.069
   39    HZ3  LYS   4           2HZ      LYS   4  -8.005   9.947  -9.869
   40    H    PHE   5           H        PHE   5  -6.792   7.314  -2.531
   41    HA   PHE   5           HA       PHE   5  -5.685   4.699  -3.282
   42    HB2  PHE   5           2HB      PHE   5  -5.128   6.423  -0.849
   43    HB3  PHE   5           3HB      PHE   5  -4.315   4.909  -1.242
   44    HD1  PHE   5           HD2      PHE   5  -2.703   4.801  -3.071
   45    HD2  PHE   5           HD1      PHE   5  -4.632   8.459  -2.047
   46    HE1  PHE   5           HE2      PHE   5  -1.055   6.044  -4.410
   47    HE2  PHE   5           HE1      PHE   5  -2.989   9.704  -3.387
   48    HZ   PHE   5           HZ       PHE   5  -1.199   8.496  -4.569
   49    H    THR   6           H        THR   6  -7.126   3.124  -2.982
   50    HA   THR   6           HA       THR   6  -8.701   3.060  -0.471
   51    HB   THR   6           HB       THR   6 -10.256   3.269  -2.272
   52    HG1  THR   6           HG1      THR   6 -11.468   1.646  -1.614
   53   HG21  THR   6          3HG2      THR   6 -10.306   1.726  -4.188
   54   HG22  THR   6          1HG2      THR   6  -8.824   0.966  -3.610
   55   HG23  THR   6          2HG2      THR   6  -8.804   2.651  -4.136
   56    H    LYS   7           H        LYS   7  -9.336   0.792   0.193
   57    HA   LYS   7           HA       LYS   7  -6.933  -0.749   0.491
   58    HB2  LYS   7           2HB      LYS   7  -8.331  -2.245   1.874
   59    HB3  LYS   7           3HB      LYS   7  -8.477  -0.559   2.348
   60    HG2  LYS   7           2HG      LYS   7 -10.620  -0.386   1.234
   61    HG3  LYS   7           3HG      LYS   7 -10.464  -2.032   0.618
   62    HD2  LYS   7           2HD      LYS   7 -11.943  -2.006   2.545
   63    HD3  LYS   7           3HD      LYS   7 -10.464  -2.883   2.935
   64    HE2  LYS   7           2HE      LYS   7  -9.598  -0.831   4.039
   65    HE3  LYS   7           3HE      LYS   7 -11.147  -0.049   3.726
   66    HZ1  LYS   7           3HZ      LYS   7 -12.212  -1.822   5.040
   67    HZ2  LYS   7           1HZ      LYS   7 -11.119  -0.908   5.954
   68    HZ3  LYS   7           2HZ      LYS   7 -10.691  -2.453   5.408
   69    H    ASP   8           H        ASP   8  -9.410  -0.760  -1.838
   70    HA   ASP   8           HA       ASP   8  -9.308  -3.592  -2.447
   71    HB2  ASP   8           2HB      ASP   8 -11.401  -2.361  -2.744
   72    HB3  ASP   8           3HB      ASP   8 -10.631  -1.299  -3.920
   73    H    MET   9           H        MET   9  -7.934  -0.624  -3.809
   74    HA   MET   9           HA       MET   9  -7.055  -1.712  -6.262
   75    HB2  MET   9           2HB      MET   9  -5.655   0.270  -6.456
   76    HB3  MET   9           3HB      MET   9  -7.242   0.710  -5.842
   77    HG2  MET   9           2HG      MET   9  -6.233   0.671  -3.534
   78    HG3  MET   9           3HG      MET   9  -4.658   0.533  -4.311
   79    HE1  MET   9           3HE      MET   9  -3.702   2.388  -6.010
   80    HE2  MET   9           1HE      MET   9  -4.543   3.894  -6.377
   81    HE3  MET   9           2HE      MET   9  -5.198   2.360  -6.946
   82    H    THR  10           H        THR  10  -4.914  -2.297  -6.941
   83    HA   THR  10           HA       THR  10  -3.588  -3.969  -4.988
   84    HB   THR  10           HB       THR  10  -2.227  -4.792  -6.823
   85    HG1  THR  10           HG1      THR  10  -2.988  -3.734  -8.992
   86   HG21  THR  10          3HG2      THR  10  -5.101  -4.426  -7.703
   87   HG22  THR  10          1HG2      THR  10  -4.503  -5.692  -6.629
   88   HG23  THR  10          2HG2      THR  10  -3.978  -5.643  -8.312
   89    H    PHE  11           H        PHE  11  -1.300  -3.952  -4.580
   90    HA   PHE  11           HA       PHE  11  -0.214  -1.532  -3.785
   91    HB2  PHE  11           2HB      PHE  11   1.210  -4.101  -4.524
   92    HB3  PHE  11           3HB      PHE  11   1.981  -2.750  -3.704
   93    HD1  PHE  11           HD2      PHE  11   1.314  -2.147  -1.404
   94    HD2  PHE  11           HD1      PHE  11  -0.212  -5.621  -3.340
   95    HE1  PHE  11           HE2      PHE  11   0.598  -3.040   0.772
   96    HE2  PHE  11           HE1      PHE  11  -0.927  -6.519  -1.165
   97    HZ   PHE  11           HZ       PHE  11  -0.525  -5.229   0.893
   98    H    ALA  12           H        ALA  12   0.338  -3.278  -6.832
   99    HA   ALA  12           HA       ALA  12   2.315  -1.663  -7.945
  100    HB1  ALA  12           3HB      ALA  12   1.616  -3.819  -8.886
  101    HB2  ALA  12           1HB      ALA  12   1.622  -2.547 -10.106
  102    HB3  ALA  12           2HB      ALA  12   0.096  -3.096  -9.412
  103    H    GLN  13           H        GLN  13  -1.228  -1.367  -8.301
  104    HA   GLN  13           HA       GLN  13  -1.295   0.875  -9.963
  105    HB2  GLN  13           2HB      GLN  13  -3.256   0.142  -7.773
  106    HB3  GLN  13           3HB      GLN  13  -3.573   1.248  -9.102
  107    HG2  GLN  13           2HG      GLN  13  -3.403  -0.539 -10.705
  108    HG3  GLN  13           3HG      GLN  13  -2.902  -1.670  -9.450
  109   HE21  GLN  13          1HE2      GLN  13  -5.435   0.729  -9.074
  110   HE22  GLN  13          2HE2      GLN  13  -6.734  -0.399  -8.954
  111    H    ALA  14           H        ALA  14  -1.380   0.745  -6.397
  112    HA   ALA  14           HA       ALA  14  -1.496   3.481  -5.868
  113    HB1  ALA  14           3HB      ALA  14  -1.819   1.763  -4.159
  114    HB2  ALA  14           1HB      ALA  14  -0.598   2.933  -3.655
  115    HB3  ALA  14           2HB      ALA  14  -0.109   1.343  -4.244
  116    H    LEU  15           H        LEU  15   1.402   1.415  -6.181
  117    HA   LEU  15           HA       LEU  15   3.361   3.360  -5.768
  118    HB2  LEU  15           2HB      LEU  15   3.444   0.901  -7.521
  119    HB3  LEU  15           3HB      LEU  15   4.854   1.845  -7.075
  120    HG   LEU  15           HG       LEU  15   3.069   0.361  -5.136
  121   HD11  LEU  15          1HD1      LEU  15   4.357  -1.168  -6.533
  122   HD12  LEU  15          2HD1      LEU  15   4.953  -1.172  -4.874
  123   HD13  LEU  15          3HD1      LEU  15   5.841  -0.303  -6.127
  124   HD21  LEU  15          3HD2      LEU  15   4.071   2.341  -4.131
  125   HD22  LEU  15          1HD2      LEU  15   5.666   1.838  -4.693
  126   HD23  LEU  15          2HD2      LEU  15   4.811   0.875  -3.486
  127    H    GLN  16           H        GLN  16   1.613   2.529  -8.726
  128    HA   GLN  16           HA       GLN  16   3.172   4.322 -10.376
  129    HB2  GLN  16           2HB      GLN  16   0.571   2.890 -10.970
  130    HB3  GLN  16           3HB      GLN  16   1.564   3.732 -12.150
  131    HG2  GLN  16           2HG      GLN  16   2.341   1.272 -10.587
  132    HG3  GLN  16           3HG      GLN  16   1.910   1.338 -12.293
  133   HE21  GLN  16          1HE2      GLN  16   4.343   2.034  -9.933
  134   HE22  GLN  16          2HE2      GLN  16   5.624   2.351 -11.041
  135    H    THR  17           H        THR  17   0.425   4.625  -8.344
  136    HA   THR  17           HA       THR  17  -0.723   6.925  -9.666
  137    HB   THR  17           HB       THR  17  -1.276   5.822  -6.894
  138    HG1  THR  17           HG1      THR  17  -1.777   4.512  -8.874
  139   HG21  THR  17          3HG2      THR  17  -1.950   8.171  -7.082
  140   HG22  THR  17          1HG2      THR  17  -3.363   7.118  -7.019
  141   HG23  THR  17          2HG2      THR  17  -2.844   7.807  -8.558
  142    H    HIS  18           H        HIS  18   1.324   6.390  -6.809
  143    HA   HIS  18           HA       HIS  18   2.321   9.119  -7.037
  144    HB2  HIS  18           2HB      HIS  18   0.656   8.166  -4.761
  145    HB3  HIS  18           3HB      HIS  18   2.078   9.111  -4.344
  146    HD1  HIS  18           HD1      HIS  18  -0.860   9.486  -6.764
  147    HD2  HIS  18           HD2      HIS  18   1.554  11.748  -4.258
  148    HE1  HIS  18           HE1      HIS  18  -1.781  11.811  -6.870
  149    HE2  HIS  18           HE2      HIS  18  -0.153  13.193  -5.555
  150    HA   PRO  19           HA       PRO  19   6.125   6.874  -6.336
  151    HB2  PRO  19           2HB      PRO  19   7.147   9.562  -5.549
  152    HB3  PRO  19           3HB      PRO  19   7.762   8.433  -6.762
  153    HG2  PRO  19           2HG      PRO  19   6.451  10.628  -7.509
  154    HG3  PRO  19           3HG      PRO  19   6.202   9.090  -8.359
  155    HD2  PRO  19           2HD      PRO  19   4.455  10.435  -6.324
  156    HD3  PRO  19           3HD      PRO  19   4.000   9.579  -7.814
  157    H    GLY  20           H        GLY  20   4.984   9.245  -3.936
  158    HA2  GLY  20           2HA      GLY  20   6.693   8.550  -1.817
  159    HA3  GLY  20           3HA      GLY  20   5.123   9.314  -1.647
  160    H    VAL  21           H        VAL  21   3.960   6.838  -3.075
  161    HA   VAL  21           HA       VAL  21   3.078   5.447  -0.812
  162    HB   VAL  21           HB       VAL  21   3.162   4.509  -3.693
  163   HG11  VAL  21          1HG1      VAL  21   2.883   2.609  -2.177
  164   HG12  VAL  21          2HG1      VAL  21   1.392   2.930  -3.062
  165   HG13  VAL  21          3HG1      VAL  21   1.542   3.431  -1.378
  166   HG21  VAL  21          3HG2      VAL  21   0.963   5.842  -2.100
  167   HG22  VAL  21          1HG2      VAL  21   0.811   5.239  -3.752
  168   HG23  VAL  21          2HG2      VAL  21   1.902   6.581  -3.397
  169    H    ALA  22           H        ALA  22   5.835   4.847  -2.930
  170    HA   ALA  22           HA       ALA  22   6.538   2.267  -2.103
  171    HB1  ALA  22           3HB      ALA  22   8.395   4.508  -2.922
  172    HB2  ALA  22           1HB      ALA  22   7.559   3.411  -4.024
  173    HB3  ALA  22           2HB      ALA  22   8.780   2.786  -2.914
  174    H    GLY  23           H        GLY  23   7.550   5.423  -0.771
  175    HA2  GLY  23           2HA      GLY  23   9.163   4.415   1.319
  176    HA3  GLY  23           3HA      GLY  23   8.424   6.006   1.277
  177    H    VAL  24           H        VAL  24   5.714   5.250   1.238
  178    HA   VAL  24           HA       VAL  24   5.154   4.887   3.970
  179    HB   VAL  24           HB       VAL  24   3.302   4.434   1.613
  180   HG11  VAL  24          1HG1      VAL  24   2.404   3.422   3.640
  181   HG12  VAL  24          2HG1      VAL  24   1.485   4.869   3.223
  182   HG13  VAL  24          3HG1      VAL  24   2.668   4.923   4.530
  183   HG21  VAL  24          3HG2      VAL  24   3.794   6.906   3.279
  184   HG22  VAL  24          1HG2      VAL  24   2.553   6.740   2.037
  185   HG23  VAL  24          2HG2      VAL  24   4.258   6.673   1.594
  186    H    LEU  25           H        LEU  25   4.704   2.591   1.263
  187    HA   LEU  25           HA       LEU  25   3.818   0.423   2.799
  188    HB2  LEU  25           2HB      LEU  25   5.319   0.399   0.175
  189    HB3  LEU  25           3HB      LEU  25   4.469  -0.977   0.857
  190    HG   LEU  25           HG       LEU  25   3.203   1.624  -0.032
  191   HD11  LEU  25          1HD1      LEU  25   2.172   0.269  -1.787
  192   HD12  LEU  25          2HD1      LEU  25   3.087  -1.137  -1.239
  193   HD13  LEU  25          3HD1      LEU  25   3.931   0.261  -1.904
  194   HD21  LEU  25          3HD2      LEU  25   1.933  -0.879   1.090
  195   HD22  LEU  25          1HD2      LEU  25   1.061   0.486   0.390
  196   HD23  LEU  25          2HD2      LEU  25   1.998   0.704   1.865
  197    H    ARG  26           H        ARG  26   7.133   1.294   1.811
  198    HA   ARG  26           HA       ARG  26   8.465  -0.877   3.009
  199    HB2  ARG  26           2HB      ARG  26   9.330   1.954   2.419
  200    HB3  ARG  26           3HB      ARG  26  10.425   0.784   3.148
  201    HG2  ARG  26           2HG      ARG  26  10.208  -0.667   1.218
  202    HG3  ARG  26           3HG      ARG  26   9.035   0.435   0.495
  203    HD2  ARG  26           2HD      ARG  26  11.344   0.648  -0.427
  204    HD3  ARG  26           3HD      ARG  26  10.690   2.141   0.240
  205    HE   ARG  26           HE       ARG  26  12.250   2.053   1.956
  206   HH11  ARG  26          1HH1      ARG  26  12.435  -0.842   0.079
  207   HH12  ARG  26          2HH1      ARG  26  13.985  -1.271   0.712
  208   HH21  ARG  26          1HH2      ARG  26  14.221   1.481   2.745
  209   HH22  ARG  26          2HH2      ARG  26  14.990   0.033   2.195
  210    H    SER  27           H        SER  27   7.605   2.304   4.350
  211    HA   SER  27           HA       SER  27   8.701   2.014   6.906
  212    HB2  SER  27           2HB      SER  27   7.820   4.157   6.121
  213    HB3  SER  27           3HB      SER  27   6.185   3.499   6.081
  214    HG   SER  27           HG       SER  27   6.125   4.309   8.031
  215    H    TYR  28           H        TYR  28   5.513   1.021   5.687
  216    HA   TYR  28           HA       TYR  28   4.753  -0.157   8.233
  217    HB2  TYR  28           2HB      TYR  28   3.395   0.073   5.550
  218    HB3  TYR  28           3HB      TYR  28   2.718  -0.909   6.845
  219    HD1  TYR  28           HD2      TYR  28   3.669   2.564   5.913
  220    HD2  TYR  28           HD1      TYR  28   1.505   0.087   8.622
  221    HE1  TYR  28           HE2      TYR  28   2.556   4.552   6.836
  222    HE2  TYR  28           HE1      TYR  28   0.391   2.072   9.554
  223    HH   TYR  28           HH       TYR  28   0.432   4.336   9.641
  224    H    ASN  29           H        ASN  29   7.042  -1.251   6.449
  225    HA   ASN  29           HA       ASN  29   8.047  -3.286   6.278
  226    HB2  ASN  29           2HB      ASN  29   7.056  -3.727   8.501
  227    HB3  ASN  29           3HB      ASN  29   5.603  -4.344   7.726
  228   HD21  ASN  29          1HD2      ASN  29   8.967  -4.942   8.381
  229   HD22  ASN  29          2HD2      ASN  29   8.940  -6.625   8.004
  230    H    LEU  30           H        LEU  30   5.263  -2.494   4.684
  231    HA   LEU  30           HA       LEU  30   4.709  -4.994   3.362
  232    HB2  LEU  30           2HB      LEU  30   3.811  -2.191   2.671
  233    HB3  LEU  30           3HB      LEU  30   3.198  -3.661   1.938
  234    HG   LEU  30           HG       LEU  30   2.873  -2.847   4.834
  235   HD11  LEU  30          1HD1      LEU  30   0.500  -2.680   4.274
  236   HD12  LEU  30          2HD1      LEU  30   0.864  -3.070   2.593
  237   HD13  LEU  30          3HD1      LEU  30   1.467  -1.572   3.300
  238   HD21  LEU  30          3HD2      LEU  30   1.857  -5.300   3.391
  239   HD22  LEU  30          1HD2      LEU  30   1.443  -4.824   5.039
  240   HD23  LEU  30          2HD2      LEU  30   3.102  -5.270   4.641
  241    H    GLY  31           H        GLY  31   7.238  -2.863   3.020
  242    HA2  GLY  31           2HA      GLY  31   7.613  -2.531   0.277
  243    HA3  GLY  31           3HA      GLY  31   8.910  -2.672   1.447
  244    H    CYS  32           H        CYS  32   7.736  -5.464   2.068
  245    HA   CYS  32           HA       CYS  32   9.469  -6.962   0.388
  246    HB2  CYS  32           2HB      CYS  32   7.226  -7.987   2.143
  247    HB3  CYS  32           3HB      CYS  32   8.580  -8.926   1.524
  248    HG   CYS  32           HG       CYS  32   8.404  -6.931   4.199
  249    H    ILE  33           H        ILE  33   6.320  -5.791  -0.168
  250    HA   ILE  33           HA       ILE  33   5.129  -7.728  -1.771
  251    HB   ILE  33           HB       ILE  33   4.026  -5.861  -2.994
  252   HG12  ILE  33          2HG1      ILE  33   5.767  -4.096  -1.241
  253   HG13  ILE  33          3HG1      ILE  33   5.950  -4.293  -2.979
  254   HG21  ILE  33          1HG2      ILE  33   2.845  -4.937  -1.026
  255   HG22  ILE  33          2HG2      ILE  33   4.087  -5.630   0.018
  256   HG23  ILE  33          3HG2      ILE  33   3.051  -6.687  -0.941
  257   HD11  ILE  33          3HD1      ILE  33   4.829  -2.218  -2.422
  258   HD12  ILE  33          1HD1      ILE  33   3.558  -3.113  -1.587
  259   HD13  ILE  33          2HD1      ILE  33   3.765  -3.292  -3.331
  260    H    GLY  34           H        GLY  34   7.651  -5.388  -2.602
  261    HA2  GLY  34           2HA      GLY  34   7.853  -6.343  -5.345
  262    HA3  GLY  34           3HA      GLY  34   8.873  -5.133  -4.577
  263    H    CYS  35           H        CYS  35   8.103  -8.531  -3.937
  264    HA   CYS  35           HA       CYS  35  10.690  -9.564  -4.433
  265    HB2  CYS  35           2HB      CYS  35  11.247  -8.256  -2.402
  266    HB3  CYS  35           3HB      CYS  35  10.012  -9.134  -1.506
  267    HG   CYS  35           HG       CYS  35  11.910 -10.607  -0.553
  268    H    MET  36           H        MET  36   7.788  -9.907  -2.390
  269    HA   MET  36           HA       MET  36   7.800 -12.807  -2.682
  270    HB2  MET  36           2HB      MET  36   5.885 -12.803  -1.208
  271    HB3  MET  36           3HB      MET  36   7.120 -11.738  -0.549
  272    HG2  MET  36           2HG      MET  36   5.918  -9.792  -1.307
  273    HG3  MET  36           3HG      MET  36   4.727 -10.803  -2.127
  274    HE1  MET  36           3HE      MET  36   4.342 -13.151   0.011
  275    HE2  MET  36           1HE      MET  36   2.996 -12.388  -0.834
  276    HE3  MET  36           2HE      MET  36   2.962 -12.551   0.924
  277    H    GLY  37           H        GLY  37   6.885 -10.401  -4.724
  278    HA2  GLY  37           2HA      GLY  37   5.620 -10.419  -6.653
  279    HA3  GLY  37           3HA      GLY  37   5.262 -12.109  -6.339
  280    H    ALA  38           H        ALA  38   4.505  -9.274  -4.321
  281    HA   ALA  38           HA       ALA  38   1.664 -10.074  -4.400
  282    HB1  ALA  38           3HB      ALA  38   2.701 -10.035  -2.187
  283    HB2  ALA  38           1HB      ALA  38   1.426  -8.822  -2.309
  284    HB3  ALA  38           2HB      ALA  38   3.118  -8.335  -2.400
  285    H    GLN  39           H        GLN  39   3.222  -8.277  -6.355
  286    HA   GLN  39           HA       GLN  39   2.458  -5.596  -6.028
  287    HB2  GLN  39           2HB      GLN  39   3.033  -7.134  -8.572
  288    HB3  GLN  39           3HB      GLN  39   2.920  -5.382  -8.468
  289    HG2  GLN  39           2HG      GLN  39   4.921  -7.068  -6.973
  290    HG3  GLN  39           3HG      GLN  39   5.242  -6.220  -8.482
  291   HE21  GLN  39          1HE2      GLN  39   4.722  -5.877  -5.064
  292   HE22  GLN  39          2HE2      GLN  39   5.211  -4.226  -4.958
  293    H    ASN  40           H        ASN  40   0.727  -8.285  -7.539
  294    HA   ASN  40           HA       ASN  40  -1.383  -6.483  -8.490
  295    HB2  ASN  40           2HB      ASN  40  -1.068  -9.461  -8.937
  296    HB3  ASN  40           3HB      ASN  40  -2.196  -8.390  -9.764
  297   HD21  ASN  40          1HD2      ASN  40   1.090  -9.427  -9.496
  298   HD22  ASN  40          2HD2      ASN  40   1.662  -8.641 -10.924
  299    H    GLU  41           H        GLU  41  -0.910  -7.388  -5.588
  300    HA   GLU  41           HA       GLU  41  -3.566  -8.560  -5.067
  301    HB2  GLU  41           2HB      GLU  41  -1.692  -9.812  -4.124
  302    HB3  GLU  41           3HB      GLU  41  -1.122  -8.377  -3.284
  303    HG2  GLU  41           2HG      GLU  41  -2.925  -8.408  -1.776
  304    HG3  GLU  41           3HG      GLU  41  -3.845  -9.537  -2.770
  305    H    SER  42           H        SER  42  -5.002  -7.577  -3.610
  306    HA   SER  42           HA       SER  42  -5.084  -4.757  -3.639
  307    HB2  SER  42           2HB      SER  42  -6.622  -6.601  -1.785
  308    HB3  SER  42           3HB      SER  42  -7.057  -4.949  -2.222
  309    HG   SER  42           HG       SER  42  -7.432  -5.633  -4.332
  310    H    LEU  43           H        LEU  43  -4.899  -3.220  -1.965
  311    HA   LEU  43           HA       LEU  43  -2.687  -3.407  -0.313
  312    HB2  LEU  43           2HB      LEU  43  -5.108  -1.622  -0.011
  313    HB3  LEU  43           3HB      LEU  43  -3.604  -1.403   0.866
  314    HG   LEU  43           HG       LEU  43  -3.969  -1.182  -2.131
  315   HD11  LEU  43          1HD1      LEU  43  -3.298   0.919  -0.068
  316   HD12  LEU  43          2HD1      LEU  43  -4.866   0.714  -0.848
  317   HD13  LEU  43          3HD1      LEU  43  -3.459   1.168  -1.808
  318   HD21  LEU  43          3HD2      LEU  43  -1.620  -0.471  -2.170
  319   HD22  LEU  43          1HD2      LEU  43  -1.789  -2.131  -1.603
  320   HD23  LEU  43          2HD2      LEU  43  -1.485  -0.833  -0.449
  321    H    GLU  44           H        GLU  44  -6.120  -3.830   0.671
  322    HA   GLU  44           HA       GLU  44  -5.516  -4.265   3.402
  323    HB2  GLU  44           2HB      GLU  44  -7.765  -3.618   2.673
  324    HB3  GLU  44           3HB      GLU  44  -7.961  -5.165   1.858
  325    HG2  GLU  44           2HG      GLU  44  -8.049  -6.353   3.886
  326    HG3  GLU  44           3HG      GLU  44  -7.389  -5.003   4.803
  327    H    GLN  45           H        GLN  45  -5.844  -6.531   0.700
  328    HA   GLN  45           HA       GLN  45  -5.755  -8.912   2.191
  329    HB2  GLN  45           2HB      GLN  45  -4.869  -8.305  -0.633
  330    HB3  GLN  45           3HB      GLN  45  -4.815  -9.925   0.050
  331    HG2  GLN  45           2HG      GLN  45  -7.270  -9.756   0.475
  332    HG3  GLN  45           3HG      GLN  45  -7.261  -8.218  -0.387
  333   HE21  GLN  45          1HE2      GLN  45  -7.068  -8.225  -2.627
  334   HE22  GLN  45          2HE2      GLN  45  -7.175  -9.665  -3.567
  335    H    GLY  46           H        GLY  46  -3.073  -7.070   0.698
  336    HA2  GLY  46           2HA      GLY  46  -0.987  -8.699   1.712
  337    HA3  GLY  46           3HA      GLY  46  -0.823  -7.036   1.172
  338    H    ALA  47           H        ALA  47  -2.548  -5.796   3.043
  339    HA   ALA  47           HA       ALA  47  -0.890  -5.395   5.262
  340    HB1  ALA  47           3HB      ALA  47  -2.561  -3.765   4.533
  341    HB2  ALA  47           1HB      ALA  47  -2.760  -4.158   6.240
  342    HB3  ALA  47           2HB      ALA  47  -3.854  -4.851   5.042
  343    H    ASN  48           H        ASN  48  -3.995  -7.175   5.143
  344    HA   ASN  48           HA       ASN  48  -3.942  -8.217   7.730
  345    HB2  ASN  48           2HB      ASN  48  -5.225  -9.193   5.184
  346    HB3  ASN  48           3HB      ASN  48  -5.387 -10.095   6.690
  347   HD21  ASN  48          1HD2      ASN  48  -7.399  -8.675   5.076
  348   HD22  ASN  48          2HD2      ASN  48  -8.145  -7.562   6.162
  349    H    ALA  49           H        ALA  49  -2.348  -9.411   4.811
  350    HA   ALA  49           HA       ALA  49  -1.499 -11.912   5.747
  351    HB1  ALA  49           3HB      ALA  49  -1.270 -11.181   3.410
  352    HB2  ALA  49           1HB      ALA  49   0.253 -11.789   4.059
  353    HB3  ALA  49           2HB      ALA  49  -0.005 -10.051   3.893
  354    H    HIS  50           H        HIS  50  -0.073  -8.696   6.213
  355    HA   HIS  50           HA       HIS  50   2.057  -9.783   7.896
  356    HB2  HIS  50           2HB      HIS  50   1.406  -6.948   7.049
  357    HB3  HIS  50           3HB      HIS  50   2.737  -7.363   8.122
  358    HD1  HIS  50           HD1      HIS  50   4.899  -7.451   6.910
  359    HD2  HIS  50           HD2      HIS  50   1.726  -8.604   4.478
  360    HE1  HIS  50           HE1      HIS  50   5.912  -7.950   4.673
  361    HE2  HIS  50           HE2      HIS  50   3.970  -8.544   3.195
  362    H    GLY  51           H        GLY  51  -1.133  -8.852   8.316
  363    HA2  GLY  51           2HA      GLY  51  -2.376  -8.890  10.279
  364    HA3  GLY  51           3HA      GLY  51  -0.884  -8.928  11.203
  365    H    LEU  52           H        LEU  52  -1.130  -6.454   8.825
  366    HA   LEU  52           HA       LEU  52  -1.362  -4.457  10.978
  367    HB2  LEU  52           2HB      LEU  52  -0.288  -4.149   8.169
  368    HB3  LEU  52           3HB      LEU  52  -0.278  -2.911   9.412
  369    HG   LEU  52           HG       LEU  52   1.250  -5.522   9.531
  370   HD11  LEU  52          1HD1      LEU  52   3.237  -4.133   9.264
  371   HD12  LEU  52          2HD1      LEU  52   2.225  -2.698   9.092
  372   HD13  LEU  52          3HD1      LEU  52   2.162  -3.975   7.874
  373   HD21  LEU  52          3HD2      LEU  52   2.317  -4.552  11.519
  374   HD22  LEU  52          1HD2      LEU  52   0.583  -4.772  11.750
  375   HD23  LEU  52          2HD2      LEU  52   1.231  -3.165  11.422
  376    H    ASN  53           H        ASN  53  -2.568  -2.475  10.575
  377    HA   ASN  53           HA       ASN  53  -5.077  -3.020   9.207
  378    HB2  ASN  53           2HB      ASN  53  -5.187  -2.060  11.435
  379    HB3  ASN  53           3HB      ASN  53  -4.195  -0.695  10.934
  380   HD21  ASN  53          1HD2      ASN  53  -7.337  -2.195  10.646
  381   HD22  ASN  53          2HD2      ASN  53  -8.154  -0.786  10.067
  382    H    VAL  54           H        VAL  54  -5.354  -2.526   7.140
  383    HA   VAL  54           HA       VAL  54  -3.588  -0.912   5.622
  384    HB   VAL  54           HB       VAL  54  -4.917  -2.759   4.648
  385   HG11  VAL  54          1HG1      VAL  54  -7.012  -2.403   5.842
  386   HG12  VAL  54          2HG1      VAL  54  -7.288  -2.421   4.103
  387   HG13  VAL  54          3HG1      VAL  54  -7.272  -0.890   4.976
  388   HG21  VAL  54          3HG2      VAL  54  -5.409  -0.068   3.353
  389   HG22  VAL  54          1HG2      VAL  54  -5.520  -1.633   2.545
  390   HG23  VAL  54          2HG2      VAL  54  -3.969  -1.069   3.167
  391    H    GLU  55           H        GLU  55  -6.511  -0.181   7.356
  392    HA   GLU  55           HA       GLU  55  -7.313   2.112   5.903
  393    HB2  GLU  55           2HB      GLU  55  -7.933   1.423   8.786
  394    HB3  GLU  55           3HB      GLU  55  -8.856   2.499   7.741
  395    HG2  GLU  55           2HG      GLU  55  -9.361   0.595   6.258
  396    HG3  GLU  55           3HG      GLU  55  -8.481  -0.470   7.350
  397    H    ASP  56           H        ASP  56  -5.180   1.689   8.696
  398    HA   ASP  56           HA       ASP  56  -4.723   4.478   9.118
  399    HB2  ASP  56           2HB      ASP  56  -4.250   2.764  10.848
  400    HB3  ASP  56           3HB      ASP  56  -2.948   2.131   9.844
  401    H    ILE  57           H        ILE  57  -3.217   1.996   7.117
  402    HA   ILE  57           HA       ILE  57  -1.026   3.509   6.164
  403    HB   ILE  57           HB       ILE  57  -2.537   1.347   4.672
  404   HG12  ILE  57          2HG1      ILE  57  -0.166   1.081   6.548
  405   HG13  ILE  57          3HG1      ILE  57  -1.819   0.612   6.931
  406   HG21  ILE  57          1HG2      ILE  57  -0.408   0.988   3.496
  407   HG22  ILE  57          2HG2      ILE  57   0.309   2.332   4.384
  408   HG23  ILE  57          3HG2      ILE  57  -1.011   2.627   3.250
  409   HD11  ILE  57          3HD1      ILE  57  -1.749  -1.065   5.156
  410   HD12  ILE  57          1HD1      ILE  57  -0.471  -1.311   6.346
  411   HD13  ILE  57          2HD1      ILE  57  -0.091  -0.593   4.780
  412    H    LEU  58           H        LEU  58  -4.348   3.115   4.952
  413    HA   LEU  58           HA       LEU  58  -4.194   4.657   2.633
  414    HB2  LEU  58           2HB      LEU  58  -6.522   4.365   4.542
  415    HB3  LEU  58           3HB      LEU  58  -6.635   5.030   2.922
  416    HG   LEU  58           HG       LEU  58  -5.886   2.182   3.625
  417   HD11  LEU  58          1HD1      LEU  58  -8.365   3.294   2.301
  418   HD12  LEU  58          2HD1      LEU  58  -8.264   2.697   3.957
  419   HD13  LEU  58          3HD1      LEU  58  -8.017   1.592   2.605
  420   HD21  LEU  58          3HD2      LEU  58  -5.954   1.779   1.199
  421   HD22  LEU  58          1HD2      LEU  58  -4.690   2.929   1.635
  422   HD23  LEU  58          2HD2      LEU  58  -6.198   3.505   0.925
  423    H    ARG  59           H        ARG  59  -4.641   5.663   5.989
  424    HA   ARG  59           HA       ARG  59  -5.107   8.378   5.714
  425    HB2  ARG  59           2HB      ARG  59  -5.090   7.415   7.899
  426    HB3  ARG  59           3HB      ARG  59  -3.436   6.854   7.717
  427    HG2  ARG  59           2HG      ARG  59  -2.664   9.202   7.721
  428    HG3  ARG  59           3HG      ARG  59  -4.331   9.722   7.989
  429    HD2  ARG  59           2HD      ARG  59  -2.972   9.629  10.072
  430    HD3  ARG  59           3HD      ARG  59  -4.399   8.597  10.117
  431    HE   ARG  59           HE       ARG  59  -3.030   6.717  10.102
  432   HH11  ARG  59          1HH1      ARG  59  -1.130   9.578   9.779
  433   HH12  ARG  59          2HH1      ARG  59   0.355   8.747  10.064
  434   HH21  ARG  59          1HH2      ARG  59  -1.119   5.680  10.511
  435   HH22  ARG  59          2HH2      ARG  59   0.364   6.574  10.500
  436    H    ASP  60           H        ASP  60  -1.893   6.800   5.864
  437    HA   ASP  60           HA       ASP  60  -0.416   9.165   5.342
  438    HB2  ASP  60           2HB      ASP  60   0.347   6.873   6.342
  439    HB3  ASP  60           3HB      ASP  60   0.597   6.408   4.663
  440    H    LEU  61           H        LEU  61  -1.467   6.493   3.231
  441    HA   LEU  61           HA       LEU  61  -0.204   7.208   0.870
  442    HB2  LEU  61           2HB      LEU  61  -2.906   5.911   1.225
  443    HB3  LEU  61           3HB      LEU  61  -2.023   5.970  -0.291
  444    HG   LEU  61           HG       LEU  61  -1.129   4.548   2.225
  445   HD11  LEU  61          1HD1      LEU  61  -2.976   3.426   1.073
  446   HD12  LEU  61          2HD1      LEU  61  -1.476   2.508   0.939
  447   HD13  LEU  61          3HD1      LEU  61  -2.055   3.454  -0.433
  448   HD21  LEU  61          3HD2      LEU  61   0.772   5.456   0.986
  449   HD22  LEU  61          1HD2      LEU  61   0.181   4.697  -0.492
  450   HD23  LEU  61          2HD2      LEU  61   0.715   3.697   0.860
  451    H    ASN  62           H        ASN  62  -3.490   8.210   1.897
  452    HA   ASN  62           HA       ASN  62  -3.833   9.928  -0.378
  453    HB2  ASN  62           2HB      ASN  62  -5.388   9.643   2.201
  454    HB3  ASN  62           3HB      ASN  62  -5.831  10.790   0.938
  455   HD21  ASN  62          1HD2      ASN  62  -5.620   7.430   1.798
  456   HD22  ASN  62          2HD2      ASN  62  -6.568   6.835   0.487
  457    H    ALA  63           H        ALA  63  -2.587  10.350   2.876
  458    HA   ALA  63           HA       ALA  63  -2.561  13.165   2.981
  459    HB1  ALA  63           3HB      ALA  63  -0.604  11.248   4.250
  460    HB2  ALA  63           1HB      ALA  63  -2.150  11.742   4.938
  461    HB3  ALA  63           2HB      ALA  63  -0.865  12.930   4.714
  462    H    LEU  64           H        LEU  64  -0.454  10.886   1.363
  463    HA   LEU  64           HA       LEU  64   1.777  12.441   0.791
  464    HB2  LEU  64           2HB      LEU  64   0.394  10.440  -1.003
  465    HB3  LEU  64           3HB      LEU  64   2.026  11.039  -1.235
  466    HG   LEU  64           HG       LEU  64   1.098   9.425   1.149
  467   HD11  LEU  64          1HD1      LEU  64   2.423   7.608   0.179
  468   HD12  LEU  64          2HD1      LEU  64   2.747   8.602  -1.242
  469   HD13  LEU  64          3HD1      LEU  64   1.099   8.085  -0.884
  470   HD21  LEU  64          3HD2      LEU  64   2.926  10.917   1.725
  471   HD22  LEU  64          1HD2      LEU  64   3.853  10.359   0.331
  472   HD23  LEU  64          2HD2      LEU  64   3.500   9.252   1.658
  473    H    ALA  65           H        ALA  65  -1.380  12.432  -0.789
  474    HA   ALA  65           HA       ALA  65  -0.502  14.378  -2.789
  475    HB1  ALA  65           3HB      ALA  65  -3.189  13.046  -2.416
  476    HB2  ALA  65           1HB      ALA  65  -1.910  12.507  -3.505
  477    HB3  ALA  65           2HB      ALA  65  -2.710  14.053  -3.783
  478    H    LEU  66           H        LEU  66  -2.764  14.165  -0.056
  479    HA   LEU  66           HA       LEU  66  -3.862  16.771  -0.381
  480    HB2  LEU  66           2HB      LEU  66  -3.765  15.000   2.065
  481    HB3  LEU  66           3HB      LEU  66  -4.764  16.432   1.896
  482    HG   LEU  66           HG       LEU  66  -5.011  13.912   0.239
  483   HD11  LEU  66          1HD1      LEU  66  -6.774  15.001   2.434
  484   HD12  LEU  66          2HD1      LEU  66  -5.741  13.576   2.538
  485   HD13  LEU  66          3HD1      LEU  66  -7.119  13.585   1.439
  486   HD21  LEU  66          3HD2      LEU  66  -7.052  14.928  -0.648
  487   HD22  LEU  66          1HD2      LEU  66  -5.636  15.907  -1.030
  488   HD23  LEU  66          2HD2      LEU  66  -6.725  16.401   0.267
  489    H    GLU  67           H        GLU  67  -1.449  15.506   1.920
  490    HA   GLU  67           HA       GLU  67   0.017  16.491   3.331
  491    HB2  GLU  67           2HB      GLU  67   0.161  18.494   1.068
  492    HB3  GLU  67           3HB      GLU  67   1.305  18.417   2.402
  493    HG2  GLU  67           2HG      GLU  67   1.735  16.008   1.697
  494    HG3  GLU  67           3HG      GLU  67   0.852  16.396   0.222
  495    H    HIS  68           H        HIS  68  -2.824  17.277   3.649
  496    HA   HIS  68           HA       HIS  68  -2.789  19.982   4.648
  497    HB2  HIS  68           2HB      HIS  68  -4.794  17.733   4.816
  498    HB3  HIS  68           3HB      HIS  68  -5.018  19.228   5.715
  499    HD1  HIS  68           HD1      HIS  68  -6.290  20.976   4.535
  500    HD2  HIS  68           HD2      HIS  68  -4.532  18.306   1.879
  501    HE1  HIS  68           HE1      HIS  68  -7.097  21.657   2.264
  502    HE2  HIS  68           HE2      HIS  68  -6.135  19.954   0.692
  503    H    HIS  69           H        HIS  69  -2.591  20.673   6.759
  504    HA   HIS  69           HA       HIS  69  -1.131  18.990   8.559
  505    HB2  HIS  69           2HB      HIS  69  -0.774  21.445   8.364
  506    HB3  HIS  69           3HB      HIS  69  -2.368  21.713   9.058
  507    HD1  HIS  69           HD1      HIS  69   1.136  21.103   9.958
  508    HD2  HIS  69           HD2      HIS  69  -2.556  20.961  11.854
  509    HE1  HIS  69           HE1      HIS  69   1.646  21.037  12.409
  510    HE2  HIS  69           HE2      HIS  69  -0.594  20.857  13.536
  511    H    HIS  70           H        HIS  70  -2.098  17.413   9.718
  512    HA   HIS  70           HA       HIS  70  -4.858  17.294  10.316
  513    HB2  HIS  70           2HB      HIS  70  -3.257  15.336  10.210
  514    HB3  HIS  70           3HB      HIS  70  -2.647  15.832  11.785
  515    HD1  HIS  70           HD1      HIS  70  -3.440  13.872  13.150
  516    HD2  HIS  70           HD2      HIS  70  -6.490  15.571  10.896
  517    HE1  HIS  70           HE1      HIS  70  -5.546  12.740  13.907
  518    HE2  HIS  70           HE2      HIS  70  -7.332  13.623  12.377
  519    H    HIS  71           H        HIS  71  -5.463  19.240  11.285
  520    HA   HIS  71           HA       HIS  71  -4.103  20.465  13.449
  521    HB2  HIS  71           2HB      HIS  71  -5.508  21.713  11.878
  522    HB3  HIS  71           3HB      HIS  71  -6.936  20.852  12.443
  523    HD1  HIS  71           HD1      HIS  71  -7.694  21.391  14.945
  524    HD2  HIS  71           HD2      HIS  71  -4.827  23.934  13.344
  525    HE1  HIS  71           HE1      HIS  71  -7.696  23.414  16.422
  526    HE2  HIS  71           HE2      HIS  71  -5.839  24.859  15.536
  527    H    HIS  72           H        HIS  72  -4.094  19.927  15.553
  528    HA   HIS  72           HA       HIS  72  -6.096  18.056  16.577
  529    HB2  HIS  72           2HB      HIS  72  -3.638  19.181  17.940
  530    HB3  HIS  72           3HB      HIS  72  -4.656  17.881  18.552
  531    HD1  HIS  72           HD1      HIS  72  -4.892  16.045  16.181
  532    HD2  HIS  72           HD2      HIS  72  -1.345  17.964  17.180
  533    HE1  HIS  72           HE1      HIS  72  -3.074  14.679  15.136
  534    HE2  HIS  72           HE2      HIS  72  -0.951  15.925  15.643
  535    H    HIS  73           H        HIS  73  -7.425  18.450  18.358
  536    HA   HIS  73           HA       HIS  73  -8.011  21.266  18.902
  537    HB2  HIS  73           2HB      HIS  73  -9.852  19.704  18.299
  538    HB3  HIS  73           3HB      HIS  73  -9.514  18.771  19.753
  539    HD1  HIS  73           HD1      HIS  73 -10.531  19.597  21.919
  540    HD2  HIS  73           HD2      HIS  73 -11.008  22.283  18.791
  541    HE1  HIS  73           HE1      HIS  73 -12.137  21.325  22.760
  542    HE2  HIS  73           HE2      HIS  73 -12.547  22.835  20.793
  Start of MODEL   17
    1    H1   MET   1           1H       MET   1 -16.232  13.228  -1.343
    2    H2   MET   1           2H       MET   1 -15.121  12.164  -2.046
    3    H3   MET   1           3H       MET   1 -15.034  12.513  -0.393
    4    HA   MET   1           HA       MET   1 -17.138  11.453   0.008
    5    HB2  MET   1           2HB      MET   1 -18.138  11.943  -2.191
    6    HB3  MET   1           3HB      MET   1 -17.057  10.781  -2.946
    7    HG2  MET   1           2HG      MET   1 -18.087   8.977  -1.659
    8    HG3  MET   1           3HG      MET   1 -19.163  10.142  -0.887
    9    HE1  MET   1           3HE      MET   1 -21.594   8.173  -3.242
   10    HE2  MET   1           1HE      MET   1 -21.317   8.749  -1.599
   11    HE3  MET   1           2HE      MET   1 -20.242   7.540  -2.300
   12    H    THR   2           H        THR   2 -14.830  10.128  -2.401
   13    HA   THR   2           HA       THR   2 -14.206   7.979  -0.465
   14    HB   THR   2           HB       THR   2 -15.509   6.910  -2.190
   15    HG1  THR   2           HG1      THR   2 -12.776   6.345  -2.798
   16   HG21  THR   2          3HG2      THR   2 -15.246   8.574  -3.974
   17   HG22  THR   2          1HG2      THR   2 -14.860   6.953  -4.556
   18   HG23  THR   2          2HG2      THR   2 -13.561   8.090  -4.183
   19    H    GLN   3           H        GLN   3 -12.084   7.328  -0.323
   20    HA   GLN   3           HA       GLN   3 -10.059   9.175  -1.124
   21    HB2  GLN   3           2HB      GLN   3  -9.746   6.350  -0.069
   22    HB3  GLN   3           3HB      GLN   3  -8.501   7.591  -0.097
   23    HG2  GLN   3           2HG      GLN   3  -9.781   8.931   1.488
   24    HG3  GLN   3           3HG      GLN   3 -11.058   7.717   1.497
   25   HE21  GLN   3          1HE2      GLN   3  -9.101   5.502   1.413
   26   HE22  GLN   3          2HE2      GLN   3  -8.448   5.410   3.004
   27    H    LYS   4           H        LYS   4  -8.389   8.909  -2.681
   28    HA   LYS   4           HA       LYS   4  -8.989   7.237  -4.944
   29    HB2  LYS   4           2HB      LYS   4  -6.530   8.895  -4.324
   30    HB3  LYS   4           3HB      LYS   4  -6.810   8.062  -5.848
   31    HG2  LYS   4           2HG      LYS   4  -8.909   9.425  -6.099
   32    HG3  LYS   4           3HG      LYS   4  -8.388  10.356  -4.695
   33    HD2  LYS   4           2HD      LYS   4  -7.751  11.510  -6.738
   34    HD3  LYS   4           3HD      LYS   4  -6.307  10.954  -5.890
   35    HE2  LYS   4           2HE      LYS   4  -6.149   9.032  -7.405
   36    HE3  LYS   4           3HE      LYS   4  -7.610   9.565  -8.239
   37    HZ1  LYS   4           3HZ      LYS   4  -5.624  10.214  -9.440
   38    HZ2  LYS   4           1HZ      LYS   4  -5.053  11.072  -8.099
   39    HZ3  LYS   4           2HZ      LYS   4  -6.450  11.582  -8.894
   40    H    PHE   5           H        PHE   5  -6.535   7.214  -2.380
   41    HA   PHE   5           HA       PHE   5  -5.609   4.567  -3.140
   42    HB2  PHE   5           2HB      PHE   5  -4.947   6.270  -0.719
   43    HB3  PHE   5           3HB      PHE   5  -4.160   4.752  -1.134
   44    HD1  PHE   5           HD2      PHE   5  -4.504   8.295  -1.973
   45    HD2  PHE   5           HD1      PHE   5  -2.568   4.632  -2.965
   46    HE1  PHE   5           HE2      PHE   5  -2.864   9.528  -3.332
   47    HE2  PHE   5           HE1      PHE   5  -0.930   5.861  -4.324
   48    HZ   PHE   5           HZ       PHE   5  -1.077   8.309  -4.509
   49    H    THR   6           H        THR   6  -7.159   3.049  -2.838
   50    HA   THR   6           HA       THR   6  -8.534   2.971  -0.213
   51    HB   THR   6           HB       THR   6 -10.121   3.516  -1.991
   52    HG1  THR   6           HG1      THR   6 -11.542   2.252  -1.064
   53   HG21  THR   6          3HG2      THR   6 -10.615   1.907  -3.788
   54   HG22  THR   6          1HG2      THR   6  -9.271   0.899  -3.248
   55   HG23  THR   6          2HG2      THR   6  -8.962   2.511  -3.896
   56    H    LYS   7           H        LYS   7  -9.483   0.705   0.210
   57    HA   LYS   7           HA       LYS   7  -7.272  -1.081   0.469
   58    HB2  LYS   7           2HB      LYS   7  -8.939  -2.605   1.523
   59    HB3  LYS   7           3HB      LYS   7  -8.943  -0.986   2.208
   60    HG2  LYS   7           2HG      LYS   7 -10.969  -0.418   1.131
   61    HG3  LYS   7           3HG      LYS   7 -10.880  -1.822   0.066
   62    HD2  LYS   7           2HD      LYS   7 -12.541  -2.162   1.822
   63    HD3  LYS   7           3HD      LYS   7 -11.211  -3.308   1.981
   64    HE2  LYS   7           2HE      LYS   7 -10.220  -1.824   3.726
   65    HE3  LYS   7           3HE      LYS   7 -11.660  -0.810   3.621
   66    HZ1  LYS   7           3HZ      LYS   7 -11.786  -2.404   5.447
   67    HZ2  LYS   7           1HZ      LYS   7 -11.638  -3.689   4.358
   68    HZ3  LYS   7           2HZ      LYS   7 -13.001  -2.686   4.304
   69    H    ASP   8           H        ASP   8  -9.589  -0.659  -1.994
   70    HA   ASP   8           HA       ASP   8  -9.681  -3.405  -2.888
   71    HB2  ASP   8           2HB      ASP   8 -11.616  -1.892  -3.111
   72    HB3  ASP   8           3HB      ASP   8 -10.688  -0.870  -4.202
   73    H    MET   9           H        MET   9  -7.919  -0.482  -3.797
   74    HA   MET   9           HA       MET   9  -7.082  -1.419  -6.360
   75    HB2  MET   9           2HB      MET   9  -5.635   0.524  -6.419
   76    HB3  MET   9           3HB      MET   9  -7.204   0.986  -5.776
   77    HG2  MET   9           2HG      MET   9  -6.218   0.784  -3.482
   78    HG3  MET   9           3HG      MET   9  -4.648   0.567  -4.247
   79    HE1  MET   9           3HE      MET   9  -3.598   2.421  -5.927
   80    HE2  MET   9           1HE      MET   9  -4.317   4.015  -6.178
   81    HE3  MET   9           2HE      MET   9  -5.120   2.575  -6.807
   82    H    THR  10           H        THR  10  -4.911  -1.936  -7.023
   83    HA   THR  10           HA       THR  10  -3.653  -3.807  -5.195
   84    HB   THR  10           HB       THR  10  -2.324  -4.544  -7.070
   85    HG1  THR  10           HG1      THR  10  -2.641  -3.361  -9.139
   86   HG21  THR  10          3HG2      THR  10  -5.136  -3.914  -7.997
   87   HG22  THR  10          1HG2      THR  10  -4.651  -5.319  -7.047
   88   HG23  THR  10          2HG2      THR  10  -4.070  -5.129  -8.701
   89    H    PHE  11           H        PHE  11  -1.331  -3.874  -4.822
   90    HA   PHE  11           HA       PHE  11  -0.152  -1.488  -3.975
   91    HB2  PHE  11           2HB      PHE  11   1.093  -4.143  -4.714
   92    HB3  PHE  11           3HB      PHE  11   2.024  -2.813  -4.040
   93    HD1  PHE  11           HD1      PHE  11   1.641  -2.068  -1.731
   94    HD2  PHE  11           HD2      PHE  11  -0.375  -5.460  -3.335
   95    HE1  PHE  11           HE1      PHE  11   1.057  -2.796   0.545
   96    HE2  PHE  11           HE2      PHE  11  -0.960  -6.190  -1.061
   97    HZ   PHE  11           HZ       PHE  11  -0.242  -4.859   0.883
   98    H    ALA  12           H        ALA  12   0.120  -3.162  -7.095
   99    HA   ALA  12           HA       ALA  12   2.120  -1.584  -8.263
  100    HB1  ALA  12           3HB      ALA  12   1.292  -3.683  -9.238
  101    HB2  ALA  12           1HB      ALA  12   1.278  -2.362 -10.409
  102    HB3  ALA  12           2HB      ALA  12  -0.226  -2.886  -9.649
  103    H    GLN  13           H        GLN  13  -1.440  -1.184  -8.441
  104    HA   GLN  13           HA       GLN  13  -1.501   1.176  -9.941
  105    HB2  GLN  13           2HB      GLN  13  -3.388   0.321  -7.728
  106    HB3  GLN  13           3HB      GLN  13  -3.722   1.580  -8.909
  107    HG2  GLN  13           2HG      GLN  13  -3.677  -0.052 -10.705
  108    HG3  GLN  13           3HG      GLN  13  -3.237  -1.320  -9.563
  109   HE21  GLN  13          1HE2      GLN  13  -5.590   1.211  -8.897
  110   HE22  GLN  13          2HE2      GLN  13  -6.961   0.160  -8.838
  111    H    ALA  14           H        ALA  14  -1.377   0.782  -6.400
  112    HA   ALA  14           HA       ALA  14  -1.440   3.474  -5.664
  113    HB1  ALA  14           3HB      ALA  14  -1.682   1.626  -4.079
  114    HB2  ALA  14           1HB      ALA  14  -0.437   2.760  -3.557
  115    HB3  ALA  14           2HB      ALA  14   0.023   1.221  -4.282
  116    H    LEU  15           H        LEU  15   1.424   1.416  -6.255
  117    HA   LEU  15           HA       LEU  15   3.384   3.377  -5.829
  118    HB2  LEU  15           2HB      LEU  15   3.455   0.971  -7.659
  119    HB3  LEU  15           3HB      LEU  15   4.860   1.928  -7.227
  120    HG   LEU  15           HG       LEU  15   3.176   0.284  -5.324
  121   HD11  LEU  15          1HD1      LEU  15   5.184  -1.100  -5.106
  122   HD12  LEU  15          2HD1      LEU  15   5.992  -0.126  -6.336
  123   HD13  LEU  15          3HD1      LEU  15   4.577  -1.092  -6.762
  124   HD21  LEU  15          3HD2      LEU  15   4.858   0.853  -3.636
  125   HD22  LEU  15          1HD2      LEU  15   4.021   2.289  -4.226
  126   HD23  LEU  15          2HD2      LEU  15   5.653   1.926  -4.788
  127    H    GLN  16           H        GLN  16   1.678   2.481  -8.823
  128    HA   GLN  16           HA       GLN  16   3.110   4.286 -10.496
  129    HB2  GLN  16           2HB      GLN  16   0.377   3.041 -10.864
  130    HB3  GLN  16           3HB      GLN  16   1.257   3.913 -12.112
  131    HG2  GLN  16           2HG      GLN  16   2.072   1.324 -10.800
  132    HG3  GLN  16           3HG      GLN  16   1.495   1.545 -12.450
  133   HE21  GLN  16          1HE2      GLN  16   4.175   1.892 -10.290
  134   HE22  GLN  16          2HE2      GLN  16   5.365   2.219 -11.492
  135    H    THR  17           H        THR  17   0.328   4.664  -8.416
  136    HA   THR  17           HA       THR  17  -0.566   7.154  -9.535
  137    HB   THR  17           HB       THR  17  -1.169   5.940  -6.821
  138    HG1  THR  17           HG1      THR  17  -1.882   4.718  -8.694
  139   HG21  THR  17          3HG2      THR  17  -1.612   8.347  -6.828
  140   HG22  THR  17          1HG2      THR  17  -3.125   7.443  -6.813
  141   HG23  THR  17          2HG2      THR  17  -2.553   8.182  -8.310
  142    H    HIS  18           H        HIS  18   1.481   6.269  -6.769
  143    HA   HIS  18           HA       HIS  18   2.743   8.888  -6.870
  144    HB2  HIS  18           2HB      HIS  18   1.055   7.998  -4.564
  145    HB3  HIS  18           3HB      HIS  18   2.517   8.915  -4.220
  146    HD1  HIS  18           HD1      HIS  18  -0.853   9.244  -5.845
  147    HD2  HIS  18           HD2      HIS  18   2.383  11.627  -4.814
  148    HE1  HIS  18           HE1      HIS  18  -1.644  11.604  -6.131
  149    HE2  HIS  18           HE2      HIS  18   0.399  13.009  -5.721
  150    HA   PRO  19           HA       PRO  19   6.247   6.082  -6.247
  151    HB2  PRO  19           2HB      PRO  19   7.563   8.747  -5.908
  152    HB3  PRO  19           3HB      PRO  19   8.056   7.366  -6.895
  153    HG2  PRO  19           2HG      PRO  19   6.954   9.497  -8.040
  154    HG3  PRO  19           3HG      PRO  19   6.529   7.861  -8.586
  155    HD2  PRO  19           2HD      PRO  19   4.970   9.753  -6.862
  156    HD3  PRO  19           3HD      PRO  19   4.396   8.642  -8.126
  157    H    GLY  20           H        GLY  20   5.256   8.747  -4.160
  158    HA2  GLY  20           2HA      GLY  20   6.888   8.228  -1.929
  159    HA3  GLY  20           3HA      GLY  20   5.320   9.016  -1.881
  160    H    VAL  21           H        VAL  21   4.021   6.577  -3.059
  161    HA   VAL  21           HA       VAL  21   3.150   5.319  -0.733
  162    HB   VAL  21           HB       VAL  21   3.163   4.242  -3.565
  163   HG11  VAL  21          1HG1      VAL  21   2.898   2.402  -1.986
  164   HG12  VAL  21          2HG1      VAL  21   1.382   2.715  -2.831
  165   HG13  VAL  21          3HG1      VAL  21   1.595   3.268  -1.170
  166   HG21  VAL  21          3HG2      VAL  21   0.817   4.997  -3.597
  167   HG22  VAL  21          1HG2      VAL  21   1.939   6.333  -3.339
  168   HG23  VAL  21          2HG2      VAL  21   1.023   5.677  -1.981
  169    H    ALA  22           H        ALA  22   5.791   4.416  -2.922
  170    HA   ALA  22           HA       ALA  22   6.479   1.931  -1.874
  171    HB1  ALA  22           3HB      ALA  22   8.728   2.349  -2.747
  172    HB2  ALA  22           1HB      ALA  22   8.348   4.064  -2.921
  173    HB3  ALA  22           2HB      ALA  22   7.493   2.866  -3.893
  174    H    GLY  23           H        GLY  23   7.593   5.152  -0.834
  175    HA2  GLY  23           2HA      GLY  23   9.245   4.313   1.285
  176    HA3  GLY  23           3HA      GLY  23   8.494   5.893   1.144
  177    H    VAL  24           H        VAL  24   5.803   5.191   1.263
  178    HA   VAL  24           HA       VAL  24   5.317   4.921   4.016
  179    HB   VAL  24           HB       VAL  24   3.369   4.360   1.762
  180   HG11  VAL  24          1HG1      VAL  24   2.563   3.547   3.919
  181   HG12  VAL  24          2HG1      VAL  24   1.637   4.956   3.403
  182   HG13  VAL  24          3HG1      VAL  24   2.877   5.122   4.647
  183   HG21  VAL  24          3HG2      VAL  24   3.993   6.951   3.187
  184   HG22  VAL  24          1HG2      VAL  24   2.702   6.712   2.006
  185   HG23  VAL  24          2HG2      VAL  24   4.389   6.559   1.513
  186    H    LEU  25           H        LEU  25   4.947   2.533   1.390
  187    HA   LEU  25           HA       LEU  25   4.115   0.361   2.947
  188    HB2  LEU  25           2HB      LEU  25   5.770   0.339   0.414
  189    HB3  LEU  25           3HB      LEU  25   4.947  -1.054   1.091
  190    HG   LEU  25           HG       LEU  25   3.605   1.444   0.034
  191   HD11  LEU  25          1HD1      LEU  25   2.804   0.015  -1.769
  192   HD12  LEU  25          2HD1      LEU  25   3.718  -1.344  -1.114
  193   HD13  LEU  25          3HD1      LEU  25   4.567   0.070  -1.739
  194   HD21  LEU  25          3HD2      LEU  25   2.385  -1.118   1.071
  195   HD22  LEU  25          1HD2      LEU  25   1.509   0.233   0.351
  196   HD23  LEU  25          2HD2      LEU  25   2.350   0.445   1.884
  197    H    ARG  26           H        ARG  26   7.408   1.375   2.047
  198    HA   ARG  26           HA       ARG  26   8.807  -0.646   3.416
  199    HB2  ARG  26           2HB      ARG  26   9.610   2.209   2.812
  200    HB3  ARG  26           3HB      ARG  26  10.714   0.980   3.416
  201    HG2  ARG  26           2HG      ARG  26  10.422  -0.337   1.415
  202    HG3  ARG  26           3HG      ARG  26   9.189   0.776   0.820
  203    HD2  ARG  26           2HD      ARG  26  11.310   1.191  -0.289
  204    HD3  ARG  26           3HD      ARG  26  10.863   2.569   0.717
  205    HE   ARG  26           HE       ARG  26  12.561   0.774   2.126
  206   HH11  ARG  26          1HH1      ARG  26  12.586   3.248  -0.271
  207   HH12  ARG  26          2HH1      ARG  26  14.236   3.667   0.025
  208   HH21  ARG  26          1HH2      ARG  26  14.674   1.342   2.513
  209   HH22  ARG  26          2HH2      ARG  26  15.405   2.606   1.590
  210    H    SER  27           H        SER  27   7.501   2.445   4.537
  211    HA   SER  27           HA       SER  27   8.574   2.358   7.165
  212    HB2  SER  27           2HB      SER  27   7.656   4.427   6.208
  213    HB3  SER  27           3HB      SER  27   6.050   3.705   6.149
  214    HG   SER  27           HG       SER  27   6.498   5.103   8.000
  215    H    TYR  28           H        TYR  28   5.602   1.109   5.739
  216    HA   TYR  28           HA       TYR  28   4.758  -0.058   8.285
  217    HB2  TYR  28           2HB      TYR  28   3.413   0.282   5.606
  218    HB3  TYR  28           3HB      TYR  28   2.729  -0.750   6.857
  219    HD1  TYR  28           HD1      TYR  28   3.870   2.762   6.260
  220    HD2  TYR  28           HD2      TYR  28   1.343   0.164   8.493
  221    HE1  TYR  28           HE1      TYR  28   2.779   4.710   7.284
  222    HE2  TYR  28           HE2      TYR  28   0.248   2.105   9.523
  223    HH   TYR  28           HH       TYR  28   0.462   4.353   9.894
  224    H    ASN  29           H        ASN  29   7.096  -1.086   6.610
  225    HA   ASN  29           HA       ASN  29   8.094  -3.125   6.439
  226    HB2  ASN  29           2HB      ASN  29   7.096  -3.787   8.498
  227    HB3  ASN  29           3HB      ASN  29   5.526  -4.030   7.744
  228   HD21  ASN  29          1HD2      ASN  29   8.731  -5.333   8.150
  229   HD22  ASN  29          2HD2      ASN  29   8.343  -6.931   7.627
  230    H    LEU  30           H        LEU  30   5.179  -2.451   4.786
  231    HA   LEU  30           HA       LEU  30   4.953  -4.854   3.259
  232    HB2  LEU  30           2HB      LEU  30   3.836  -2.094   2.753
  233    HB3  LEU  30           3HB      LEU  30   3.402  -3.527   1.840
  234    HG   LEU  30           HG       LEU  30   2.878  -3.090   4.790
  235   HD11  LEU  30          1HD1      LEU  30   1.437  -1.718   3.394
  236   HD12  LEU  30          2HD1      LEU  30   0.519  -3.034   4.127
  237   HD13  LEU  30          3HD1      LEU  30   0.995  -3.130   2.431
  238   HD21  LEU  30          3HD2      LEU  30   3.289  -5.442   4.310
  239   HD22  LEU  30          1HD2      LEU  30   2.121  -5.393   2.990
  240   HD23  LEU  30          2HD2      LEU  30   1.581  -5.170   4.652
  241    H    GLY  31           H        GLY  31   7.395  -2.670   3.152
  242    HA2  GLY  31           2HA      GLY  31   7.774  -2.106   0.422
  243    HA3  GLY  31           3HA      GLY  31   9.050  -2.209   1.622
  244    H    CYS  32           H        CYS  32   7.846  -5.141   1.939
  245    HA   CYS  32           HA       CYS  32   9.738  -6.331   0.072
  246    HB2  CYS  32           2HB      CYS  32   8.031  -7.641   2.201
  247    HB3  CYS  32           3HB      CYS  32   9.327  -8.415   1.297
  248    HG   CYS  32           HG       CYS  32  11.072  -6.186   2.402
  249    H    ILE  33           H        ILE  33   6.809  -5.262  -0.550
  250    HA   ILE  33           HA       ILE  33   5.216  -7.354  -1.431
  251    HB   ILE  33           HB       ILE  33   4.337  -5.751  -3.182
  252   HG12  ILE  33          2HG1      ILE  33   6.274  -3.843  -1.833
  253   HG13  ILE  33          3HG1      ILE  33   6.427  -4.458  -3.475
  254   HG21  ILE  33          1HG2      ILE  33   4.432  -4.875  -0.299
  255   HG22  ILE  33          2HG2      ILE  33   3.269  -5.976  -1.035
  256   HG23  ILE  33          3HG2      ILE  33   3.291  -4.274  -1.500
  257   HD11  ILE  33          3HD1      ILE  33   5.542  -2.200  -3.454
  258   HD12  ILE  33          1HD1      ILE  33   4.190  -2.724  -2.450
  259   HD13  ILE  33          2HD1      ILE  33   4.355  -3.335  -4.097
  260    H    GLY  34           H        GLY  34   8.082  -6.033  -2.974
  261    HA2  GLY  34           2HA      GLY  34   7.765  -7.264  -5.512
  262    HA3  GLY  34           3HA      GLY  34   9.288  -6.748  -4.800
  263    H    CYS  35           H        CYS  35   9.427  -8.350  -2.556
  264    HA   CYS  35           HA       CYS  35  10.332 -10.812  -3.676
  265    HB2  CYS  35           2HB      CYS  35  11.461  -9.815  -1.751
  266    HB3  CYS  35           3HB      CYS  35  10.012 -10.020  -0.773
  267    HG   CYS  35           HG       CYS  35  10.500 -12.980  -1.786
  268    H    MET  36           H        MET  36   7.471  -9.935  -1.762
  269    HA   MET  36           HA       MET  36   6.567 -12.697  -1.651
  270    HB2  MET  36           2HB      MET  36   4.605 -11.801  -0.461
  271    HB3  MET  36           3HB      MET  36   6.115 -11.261   0.260
  272    HG2  MET  36           2HG      MET  36   5.882  -9.101  -0.842
  273    HG3  MET  36           3HG      MET  36   4.373  -9.633  -1.582
  274    HE1  MET  36           3HE      MET  36   2.920 -11.234   0.699
  275    HE2  MET  36           1HE      MET  36   2.124 -10.004  -0.284
  276    HE3  MET  36           2HE      MET  36   1.985  -9.958   1.477
  277    H    GLY  37           H        GLY  37   6.507 -10.380  -4.022
  278    HA2  GLY  37           2HA      GLY  37   5.440 -10.254  -6.049
  279    HA3  GLY  37           3HA      GLY  37   4.886 -11.893  -5.756
  280    H    ALA  38           H        ALA  38   4.176  -8.705  -4.293
  281    HA   ALA  38           HA       ALA  38   1.312  -9.413  -4.356
  282    HB1  ALA  38           3HB      ALA  38   2.282  -9.035  -2.135
  283    HB2  ALA  38           1HB      ALA  38   1.025  -7.857  -2.513
  284    HB3  ALA  38           2HB      ALA  38   2.724  -7.396  -2.611
  285    H    GLN  39           H        GLN  39   2.955  -8.037  -6.572
  286    HA   GLN  39           HA       GLN  39   2.165  -5.332  -6.728
  287    HB2  GLN  39           2HB      GLN  39   2.888  -7.305  -8.898
  288    HB3  GLN  39           3HB      GLN  39   2.532  -5.616  -9.228
  289    HG2  GLN  39           2HG      GLN  39   4.747  -6.630  -7.450
  290    HG3  GLN  39           3HG      GLN  39   4.935  -6.023  -9.093
  291   HE21  GLN  39          1HE2      GLN  39   4.325  -5.172  -5.784
  292   HE22  GLN  39          2HE2      GLN  39   4.543  -3.472  -5.970
  293    H    ASN  40           H        ASN  40   0.569  -8.254  -8.007
  294    HA   ASN  40           HA       ASN  40  -1.660  -6.705  -9.056
  295    HB2  ASN  40           2HB      ASN  40  -1.390  -9.718  -8.841
  296    HB3  ASN  40           3HB      ASN  40  -2.535  -8.828  -9.841
  297   HD21  ASN  40          1HD2      ASN  40   0.740  -9.886  -9.498
  298   HD22  ASN  40          2HD2      ASN  40   1.257  -9.449 -11.087
  299    H    GLU  41           H        GLU  41  -0.823  -7.752  -6.036
  300    HA   GLU  41           HA       GLU  41  -3.461  -8.576  -5.132
  301    HB2  GLU  41           2HB      GLU  41  -1.423  -9.706  -4.314
  302    HB3  GLU  41           3HB      GLU  41  -0.869  -8.195  -3.609
  303    HG2  GLU  41           2HG      GLU  41  -2.574  -8.225  -1.970
  304    HG3  GLU  41           3HG      GLU  41  -3.458  -9.501  -2.803
  305    H    SER  42           H        SER  42  -4.737  -7.419  -3.611
  306    HA   SER  42           HA       SER  42  -4.584  -4.568  -3.918
  307    HB2  SER  42           2HB      SER  42  -6.679  -4.459  -2.736
  308    HB3  SER  42           3HB      SER  42  -6.749  -5.823  -3.847
  309    HG   SER  42           HG       SER  42  -7.544  -6.247  -1.683
  310    H    LEU  43           H        LEU  43  -4.417  -2.991  -2.293
  311    HA   LEU  43           HA       LEU  43  -2.334  -3.186  -0.512
  312    HB2  LEU  43           2HB      LEU  43  -4.765  -1.398  -0.331
  313    HB3  LEU  43           3HB      LEU  43  -3.295  -1.166   0.597
  314    HG   LEU  43           HG       LEU  43  -3.456  -1.072  -2.425
  315   HD11  LEU  43          1HD1      LEU  43  -3.234   1.177  -0.426
  316   HD12  LEU  43          2HD1      LEU  43  -4.648   0.798  -1.406
  317   HD13  LEU  43          3HD1      LEU  43  -3.160   1.339  -2.181
  318   HD21  LEU  43          3HD2      LEU  43  -1.191  -0.137  -2.271
  319   HD22  LEU  43          1HD2      LEU  43  -1.265  -1.777  -1.625
  320   HD23  LEU  43          2HD2      LEU  43  -1.205  -0.397  -0.525
  321    H    GLU  44           H        GLU  44  -5.753  -3.822   0.139
  322    HA   GLU  44           HA       GLU  44  -5.527  -4.098   2.943
  323    HB2  GLU  44           2HB      GLU  44  -7.676  -3.729   1.889
  324    HB3  GLU  44           3HB      GLU  44  -7.558  -5.254   1.021
  325    HG2  GLU  44           2HG      GLU  44  -7.728  -6.496   3.084
  326    HG3  GLU  44           3HG      GLU  44  -7.687  -5.005   4.025
  327    H    GLN  45           H        GLN  45  -5.481  -6.584   0.364
  328    HA   GLN  45           HA       GLN  45  -5.382  -8.824   2.051
  329    HB2  GLN  45           2HB      GLN  45  -4.151  -8.538  -0.701
  330    HB3  GLN  45           3HB      GLN  45  -4.522 -10.056   0.110
  331    HG2  GLN  45           2HG      GLN  45  -6.904  -9.501   0.061
  332    HG3  GLN  45           3HG      GLN  45  -6.533  -7.980  -0.749
  333   HE21  GLN  45          1HE2      GLN  45  -7.695  -8.459  -2.586
  334   HE22  GLN  45          2HE2      GLN  45  -7.212  -9.670  -3.717
  335    H    GLY  46           H        GLY  46  -2.673  -7.077   0.494
  336    HA2  GLY  46           2HA      GLY  46  -0.586  -8.531   1.693
  337    HA3  GLY  46           3HA      GLY  46  -0.456  -6.892   1.079
  338    H    ALA  47           H        ALA  47  -2.299  -5.633   2.823
  339    HA   ALA  47           HA       ALA  47  -0.742  -5.043   5.070
  340    HB1  ALA  47           3HB      ALA  47  -2.484  -3.552   4.203
  341    HB2  ALA  47           1HB      ALA  47  -2.701  -3.860   5.926
  342    HB3  ALA  47           2HB      ALA  47  -3.725  -4.681   4.747
  343    H    ASN  48           H        ASN  48  -3.791  -6.942   5.005
  344    HA   ASN  48           HA       ASN  48  -3.642  -7.790   7.687
  345    HB2  ASN  48           2HB      ASN  48  -5.065  -9.074   5.345
  346    HB3  ASN  48           3HB      ASN  48  -5.278  -9.558   7.023
  347   HD21  ASN  48          1HD2      ASN  48  -6.021  -7.192   4.631
  348   HD22  ASN  48          2HD2      ASN  48  -7.130  -6.284   5.589
  349    H    ALA  49           H        ALA  49  -2.331  -9.229   4.733
  350    HA   ALA  49           HA       ALA  49  -1.518 -11.704   5.738
  351    HB1  ALA  49           3HB      ALA  49   0.116 -11.743   3.919
  352    HB2  ALA  49           1HB      ALA  49  -0.114 -10.011   3.667
  353    HB3  ALA  49           2HB      ALA  49  -1.441 -11.131   3.360
  354    H    HIS  50           H        HIS  50   0.003  -8.530   6.037
  355    HA   HIS  50           HA       HIS  50   2.233  -9.692   7.562
  356    HB2  HIS  50           2HB      HIS  50   1.763  -6.914   6.460
  357    HB3  HIS  50           3HB      HIS  50   3.113  -7.309   7.521
  358    HD1  HIS  50           HD1      HIS  50   5.190  -7.826   6.292
  359    HD2  HIS  50           HD2      HIS  50   1.824  -8.797   4.061
  360    HE1  HIS  50           HE1      HIS  50   6.061  -8.641   4.090
  361    HE2  HIS  50           HE2      HIS  50   4.023  -9.455   2.869
  362    H    GLY  51           H        GLY  51  -0.782  -8.983   8.343
  363    HA2  GLY  51           2HA      GLY  51  -1.823  -8.683  10.374
  364    HA3  GLY  51           3HA      GLY  51  -0.239  -8.694  11.126
  365    H    LEU  52           H        LEU  52  -1.587  -6.442   8.721
  366    HA   LEU  52           HA       LEU  52  -1.184  -4.239  10.658
  367    HB2  LEU  52           2HB      LEU  52  -0.864  -4.164   7.652
  368    HB3  LEU  52           3HB      LEU  52  -0.637  -2.805   8.738
  369    HG   LEU  52           HG       LEU  52   1.050  -5.317   8.754
  370   HD11  LEU  52          1HD1      LEU  52   2.793  -3.925   7.747
  371   HD12  LEU  52          2HD1      LEU  52   1.650  -2.588   7.611
  372   HD13  LEU  52          3HD1      LEU  52   1.385  -4.073   6.697
  373   HD21  LEU  52          3HD2      LEU  52   1.384  -2.684  10.205
  374   HD22  LEU  52          1HD2      LEU  52   2.542  -4.017  10.205
  375   HD23  LEU  52          2HD2      LEU  52   0.952  -4.232  10.933
  376    H    ASN  53           H        ASN  53  -2.573  -2.370  10.412
  377    HA   ASN  53           HA       ASN  53  -5.258  -3.006   9.468
  378    HB2  ASN  53           2HB      ASN  53  -5.097  -1.934  11.641
  379    HB3  ASN  53           3HB      ASN  53  -4.159  -0.607  10.962
  380   HD21  ASN  53          1HD2      ASN  53  -5.665   0.918  11.682
  381   HD22  ASN  53          2HD2      ASN  53  -7.205   1.106  10.919
  382    H    VAL  54           H        VAL  54  -5.750  -2.647   7.398
  383    HA   VAL  54           HA       VAL  54  -4.146  -1.225   5.595
  384    HB   VAL  54           HB       VAL  54  -5.706  -2.984   4.884
  385   HG11  VAL  54          1HG1      VAL  54  -7.606  -2.417   6.327
  386   HG12  VAL  54          2HG1      VAL  54  -8.092  -2.548   4.637
  387   HG13  VAL  54          3HG1      VAL  54  -7.893  -0.957   5.376
  388   HG21  VAL  54          3HG2      VAL  54  -4.858  -1.439   3.208
  389   HG22  VAL  54          1HG2      VAL  54  -6.175  -0.314   3.542
  390   HG23  VAL  54          2HG2      VAL  54  -6.520  -1.888   2.826
  391    H    GLU  55           H        GLU  55  -6.964  -0.143   7.448
  392    HA   GLU  55           HA       GLU  55  -7.465   2.239   6.026
  393    HB2  GLU  55           2HB      GLU  55  -8.016   1.555   8.925
  394    HB3  GLU  55           3HB      GLU  55  -8.659   2.969   8.097
  395    HG2  GLU  55           2HG      GLU  55  -9.835   1.510   6.517
  396    HG3  GLU  55           3HG      GLU  55  -9.195   0.096   7.352
  397    H    ASP  56           H        ASP  56  -5.296   1.579   8.753
  398    HA   ASP  56           HA       ASP  56  -4.531   4.259   9.253
  399    HB2  ASP  56           2HB      ASP  56  -4.146   2.247  10.753
  400    HB3  ASP  56           3HB      ASP  56  -2.813   1.806   9.693
  401    H    ILE  57           H        ILE  57  -3.359   1.807   7.018
  402    HA   ILE  57           HA       ILE  57  -1.062   3.231   6.099
  403    HB   ILE  57           HB       ILE  57  -2.634   1.098   4.633
  404   HG12  ILE  57          2HG1      ILE  57  -0.260   0.761   6.491
  405   HG13  ILE  57          3HG1      ILE  57  -1.926   0.376   6.912
  406   HG21  ILE  57          1HG2      ILE  57  -1.068   2.318   3.203
  407   HG22  ILE  57          2HG2      ILE  57  -0.521   0.662   3.464
  408   HG23  ILE  57          3HG2      ILE  57   0.240   1.990   4.341
  409   HD11  ILE  57          3HD1      ILE  57  -1.984  -1.347   5.213
  410   HD12  ILE  57          1HD1      ILE  57  -0.626  -1.604   6.306
  411   HD13  ILE  57          2HD1      ILE  57  -0.348  -0.927   4.702
  412    H    LEU  58           H        LEU  58  -4.305   2.723   4.674
  413    HA   LEU  58           HA       LEU  58  -4.080   4.290   2.394
  414    HB2  LEU  58           2HB      LEU  58  -6.523   4.000   4.159
  415    HB3  LEU  58           3HB      LEU  58  -6.527   4.532   2.489
  416    HG   LEU  58           HG       LEU  58  -5.757   1.778   3.470
  417   HD11  LEU  58          1HD1      LEU  58  -8.153   2.182   3.608
  418   HD12  LEU  58          2HD1      LEU  58  -7.787   1.040   2.317
  419   HD13  LEU  58          3HD1      LEU  58  -8.177   2.716   1.927
  420   HD21  LEU  58          3HD2      LEU  58  -5.632   1.177   1.096
  421   HD22  LEU  58          1HD2      LEU  58  -4.441   2.404   1.522
  422   HD23  LEU  58          2HD2      LEU  58  -5.908   2.862   0.657
  423    H    ARG  59           H        ARG  59  -4.787   5.258   5.698
  424    HA   ARG  59           HA       ARG  59  -5.410   7.929   5.458
  425    HB2  ARG  59           2HB      ARG  59  -5.433   6.832   7.591
  426    HB3  ARG  59           3HB      ARG  59  -3.717   6.465   7.489
  427    HG2  ARG  59           2HG      ARG  59  -3.316   8.971   7.540
  428    HG3  ARG  59           3HG      ARG  59  -5.021   9.129   7.982
  429    HD2  ARG  59           2HD      ARG  59  -3.565   9.116   9.961
  430    HD3  ARG  59           3HD      ARG  59  -4.659   7.732   9.949
  431    HE   ARG  59           HE       ARG  59  -2.513   6.640   8.846
  432   HH11  ARG  59          1HH1      ARG  59  -2.768   8.670  11.617
  433   HH12  ARG  59          2HH1      ARG  59  -1.340   8.030  12.351
  434   HH21  ARG  59          1HH2      ARG  59  -0.709   5.801   9.812
  435   HH22  ARG  59          2HH2      ARG  59  -0.195   6.416  11.344
  436    H    ASP  60           H        ASP  60  -2.111   6.551   5.695
  437    HA   ASP  60           HA       ASP  60  -0.831   9.094   5.387
  438    HB2  ASP  60           2HB      ASP  60   0.049   6.908   6.516
  439    HB3  ASP  60           3HB      ASP  60   0.539   6.453   4.886
  440    H    LEU  61           H        LEU  61  -1.596   6.413   3.214
  441    HA   LEU  61           HA       LEU  61  -0.143   7.190   0.960
  442    HB2  LEU  61           2HB      LEU  61  -2.810   5.776   1.092
  443    HB3  LEU  61           3HB      LEU  61  -1.798   5.871  -0.337
  444    HG   LEU  61           HG       LEU  61  -1.085   4.476   2.250
  445   HD11  LEU  61          1HD1      LEU  61  -2.766   3.264   0.998
  446   HD12  LEU  61          2HD1      LEU  61  -1.217   2.430   0.890
  447   HD13  LEU  61          3HD1      LEU  61  -1.799   3.384  -0.473
  448   HD21  LEU  61          3HD2      LEU  61   0.898   5.434   1.199
  449   HD22  LEU  61          1HD2      LEU  61   0.467   4.679  -0.337
  450   HD23  LEU  61          2HD2      LEU  61   0.898   3.678   1.050
  451    H    ASN  62           H        ASN  62  -3.564   7.974   1.729
  452    HA   ASN  62           HA       ASN  62  -3.863   9.720  -0.510
  453    HB2  ASN  62           2HB      ASN  62  -5.495   9.430   2.024
  454    HB3  ASN  62           3HB      ASN  62  -5.936  10.515   0.707
  455   HD21  ASN  62          1HD2      ASN  62  -5.825   7.257   1.794
  456   HD22  ASN  62          2HD2      ASN  62  -6.637   6.551   0.445
  457    H    ALA  63           H        ALA  63  -2.786  10.187   2.802
  458    HA   ALA  63           HA       ALA  63  -2.862  12.974   2.962
  459    HB1  ALA  63           3HB      ALA  63  -2.362  11.545   4.875
  460    HB2  ALA  63           1HB      ALA  63  -1.108  12.767   4.655
  461    HB3  ALA  63           2HB      ALA  63  -0.813  11.102   4.151
  462    H    LEU  64           H        LEU  64  -0.553  10.857   1.341
  463    HA   LEU  64           HA       LEU  64   1.482  12.673   0.724
  464    HB2  LEU  64           2HB      LEU  64   0.386  10.398  -0.943
  465    HB3  LEU  64           3HB      LEU  64   1.895  11.226  -1.272
  466    HG   LEU  64           HG       LEU  64   1.330   9.662   1.255
  467   HD11  LEU  64          1HD1      LEU  64   2.784   7.939   0.307
  468   HD12  LEU  64          2HD1      LEU  64   2.897   8.854  -1.197
  469   HD13  LEU  64          3HD1      LEU  64   1.348   8.186  -0.684
  470   HD21  LEU  64          3HD2      LEU  64   3.901  10.809   0.149
  471   HD22  LEU  64          1HD2      LEU  64   3.749   9.820   1.602
  472   HD23  LEU  64          2HD2      LEU  64   3.008  11.418   1.542
  473    H    ALA  65           H        ALA  65  -1.671  12.212  -0.757
  474    HA   ALA  65           HA       ALA  65  -1.119  13.988  -2.982
  475    HB1  ALA  65           3HB      ALA  65  -3.722  12.728  -2.112
  476    HB2  ALA  65           1HB      ALA  65  -2.575  12.033  -3.256
  477    HB3  ALA  65           2HB      ALA  65  -3.413  13.533  -3.652
  478    H    LEU  66           H        LEU  66  -2.836  14.133   0.093
  479    HA   LEU  66           HA       LEU  66  -4.055  16.681  -0.387
  480    HB2  LEU  66           2HB      LEU  66  -3.602  15.206   2.214
  481    HB3  LEU  66           3HB      LEU  66  -4.634  16.611   2.010
  482    HG   LEU  66           HG       LEU  66  -5.064  13.896   0.744
  483   HD11  LEU  66          1HD1      LEU  66  -7.027  13.784   2.198
  484   HD12  LEU  66          2HD1      LEU  66  -6.569  15.317   2.940
  485   HD13  LEU  66          3HD1      LEU  66  -5.536  13.900   3.129
  486   HD21  LEU  66          3HD2      LEU  66  -7.186  14.802  -0.059
  487   HD22  LEU  66          1HD2      LEU  66  -5.826  15.711  -0.720
  488   HD23  LEU  66          2HD2      LEU  66  -6.777  16.383   0.605
  489    H    GLU  67           H        GLU  67  -0.999  15.642   0.940
  490    HA   GLU  67           HA       GLU  67   0.816  16.724   1.769
  491    HB2  GLU  67           2HB      GLU  67  -0.232  19.040   0.120
  492    HB3  GLU  67           3HB      GLU  67   1.415  18.857   0.714
  493    HG2  GLU  67           2HG      GLU  67   1.669  16.831  -0.666
  494    HG3  GLU  67           3HG      GLU  67   0.034  17.058  -1.283
  495    H    HIS  68           H        HIS  68   0.054  16.693   3.941
  496    HA   HIS  68           HA       HIS  68  -1.576  18.886   4.910
  497    HB2  HIS  68           2HB      HIS  68  -1.407  17.674   7.122
  498    HB3  HIS  68           3HB      HIS  68  -2.136  16.757   5.811
  499    HD1  HIS  68           HD1      HIS  68   1.203  17.039   7.619
  500    HD2  HIS  68           HD2      HIS  68  -0.996  14.322   5.373
  501    HE1  HIS  68           HE1      HIS  68   2.465  14.876   7.758
  502    HE2  HIS  68           HE2      HIS  68   1.056  13.217   6.495
  503    H    HIS  69           H        HIS  69  -0.561  20.800   5.155
  504    HA   HIS  69           HA       HIS  69   2.054  20.901   6.485
  505    HB2  HIS  69           2HB      HIS  69   0.422  23.048   5.108
  506    HB3  HIS  69           3HB      HIS  69   1.960  23.347   5.912
  507    HD1  HIS  69           HD1      HIS  69   0.490  21.896   2.814
  508    HD2  HIS  69           HD2      HIS  69   4.231  22.326   4.569
  509    HE1  HIS  69           HE1      HIS  69   2.141  21.317   1.022
  510    HE2  HIS  69           HE2      HIS  69   4.397  21.666   2.074
  511    H    HIS  70           H        HIS  70  -1.314  21.547   7.080
  512    HA   HIS  70           HA       HIS  70  -0.669  22.620   9.755
  513    HB2  HIS  70           2HB      HIS  70  -3.349  22.539   8.335
  514    HB3  HIS  70           3HB      HIS  70  -3.014  23.312   9.879
  515    HD1  HIS  70           HD1      HIS  70  -3.498  24.164   6.503
  516    HD2  HIS  70           HD2      HIS  70  -0.794  25.384   9.415
  517    HE1  HIS  70           HE1      HIS  70  -2.630  26.389   5.726
  518    HE2  HIS  70           HE2      HIS  70  -0.883  27.028   7.416
  519    H    HIS  71           H        HIS  71  -2.675  21.860  11.329
  520    HA   HIS  71           HA       HIS  71  -2.957  18.935  11.075
  521    HB2  HIS  71           2HB      HIS  71  -2.098  20.354  13.611
  522    HB3  HIS  71           3HB      HIS  71  -2.364  18.624  13.427
  523    HD1  HIS  71           HD1      HIS  71   0.134  21.291  12.878
  524    HD2  HIS  71           HD2      HIS  71  -0.333  17.275  11.925
  525    HE1  HIS  71           HE1      HIS  71   2.399  20.511  12.134
  526    HE2  HIS  71           HE2      HIS  71   2.123  18.053  11.705
  527    H    HIS  72           H        HIS  72  -4.653  18.018  12.430
  528    HA   HIS  72           HA       HIS  72  -6.820  19.911  13.035
  529    HB2  HIS  72           2HB      HIS  72  -6.792  16.900  12.722
  530    HB3  HIS  72           3HB      HIS  72  -8.197  17.793  13.297
  531    HD1  HIS  72           HD1      HIS  72  -9.621  18.980  11.575
  532    HD2  HIS  72           HD2      HIS  72  -6.140  17.378   9.963
  533    HE1  HIS  72           HE1      HIS  72  -9.891  19.155   9.090
  534    HE2  HIS  72           HE2      HIS  72  -7.726  18.311   8.140
  535    H    HIS  73           H        HIS  73  -6.425  20.763  15.018
  536    HA   HIS  73           HA       HIS  73  -5.248  19.338  17.178
  537    HB2  HIS  73           2HB      HIS  73  -5.746  21.336  18.525
  538    HB3  HIS  73           3HB      HIS  73  -5.009  21.753  16.985
  539    HD1  HIS  73           HD1      HIS  73  -7.729  22.680  19.128
  540    HD2  HIS  73           HD2      HIS  73  -7.110  22.606  15.023
  541    HE1  HIS  73           HE1      HIS  73  -9.474  24.199  18.158
  542    HE2  HIS  73           HE2      HIS  73  -9.183  24.003  15.668
  Start of MODEL   18
    1    H1   MET   1           1H       MET   1 -17.496  12.415  -2.989
    2    H2   MET   1           2H       MET   1 -17.224  10.794  -3.375
    3    H3   MET   1           3H       MET   1 -15.968  11.919  -3.511
    4    HA   MET   1           HA       MET   1 -15.971  12.286  -1.143
    5    HB2  MET   1           2HB      MET   1 -18.165  10.204  -1.174
    6    HB3  MET   1           3HB      MET   1 -17.322  10.710   0.287
    7    HG2  MET   1           2HG      MET   1 -18.999  12.455  -1.509
    8    HG3  MET   1           3HG      MET   1 -19.433  11.863   0.096
    9    HE1  MET   1           3HE      MET   1 -18.878  15.701   0.716
   10    HE2  MET   1           1HE      MET   1 -20.003  14.350   0.865
   11    HE3  MET   1           2HE      MET   1 -19.562  14.962  -0.731
   12    H    THR   2           H        THR   2 -15.767   9.590  -3.266
   13    HA   THR   2           HA       THR   2 -14.435   7.721  -1.628
   14    HB   THR   2           HB       THR   2 -15.334   7.026  -3.770
   15    HG1  THR   2           HG1      THR   2 -13.291   6.065  -4.649
   16   HG21  THR   2          3HG2      THR   2 -13.241   8.825  -5.011
   17   HG22  THR   2          1HG2      THR   2 -14.987   9.069  -5.055
   18   HG23  THR   2          2HG2      THR   2 -14.267   7.694  -5.891
   19    H    GLN   3           H        GLN   3 -12.154   7.099  -1.668
   20    HA   GLN   3           HA       GLN   3 -10.470   9.423  -1.273
   21    HB2  GLN   3           2HB      GLN   3  -9.864   6.474  -0.957
   22    HB3  GLN   3           3HB      GLN   3  -8.808   7.785  -0.450
   23    HG2  GLN   3           2HG      GLN   3 -10.507   8.536   1.146
   24    HG3  GLN   3           3HG      GLN   3 -11.564   7.218   0.640
   25   HE21  GLN   3          1HE2      GLN   3 -11.010   5.093   1.211
   26   HE22  GLN   3          2HE2      GLN   3  -9.881   4.758   2.471
   27    H    LYS   4           H        LYS   4  -8.081   9.197  -1.994
   28    HA   LYS   4           HA       LYS   4  -7.949   8.675  -4.868
   29    HB2  LYS   4           2HB      LYS   4  -5.975   9.881  -2.910
   30    HB3  LYS   4           3HB      LYS   4  -5.616   9.618  -4.612
   31    HG2  LYS   4           2HG      LYS   4  -7.885  11.330  -3.600
   32    HG3  LYS   4           3HG      LYS   4  -6.298  11.947  -4.067
   33    HD2  LYS   4           2HD      LYS   4  -8.104  10.370  -5.907
   34    HD3  LYS   4           3HD      LYS   4  -8.063  12.131  -5.846
   35    HE2  LYS   4           2HE      LYS   4  -5.673  10.389  -6.457
   36    HE3  LYS   4           3HE      LYS   4  -6.695  11.146  -7.679
   37    HZ1  LYS   4           3HZ      LYS   4  -5.270  12.682  -5.578
   38    HZ2  LYS   4           1HZ      LYS   4  -6.052  13.288  -6.947
   39    HZ3  LYS   4           2HZ      LYS   4  -4.629  12.397  -7.117
   40    H    PHE   5           H        PHE   5  -6.868   7.338  -1.844
   41    HA   PHE   5           HA       PHE   5  -5.814   4.994  -3.295
   42    HB2  PHE   5           2HB      PHE   5  -4.781   6.150  -0.686
   43    HB3  PHE   5           3HB      PHE   5  -4.246   4.632  -1.398
   44    HD1  PHE   5           HD1      PHE   5  -2.884   4.617  -3.431
   45    HD2  PHE   5           HD2      PHE   5  -4.056   8.271  -1.580
   46    HE1  PHE   5           HE1      PHE   5  -1.193   5.824  -4.745
   47    HE2  PHE   5           HE2      PHE   5  -2.366   9.480  -2.893
   48    HZ   PHE   5           HZ       PHE   5  -0.934   8.261  -4.477
   49    H    THR   6           H        THR   6  -7.071   3.275  -2.966
   50    HA   THR   6           HA       THR   6  -8.591   3.059  -0.429
   51    HB   THR   6           HB       THR   6 -10.191   3.568  -2.137
   52    HG1  THR   6           HG1      THR   6 -11.510   1.812  -1.889
   53   HG21  THR   6          3HG2      THR   6 -10.426   2.245  -4.190
   54   HG22  THR   6          1HG2      THR   6  -9.000   1.303  -3.752
   55   HG23  THR   6          2HG2      THR   6  -8.846   3.023  -4.108
   56    H    LYS   7           H        LYS   7  -9.171   0.867   0.223
   57    HA   LYS   7           HA       LYS   7  -7.030  -0.958   0.186
   58    HB2  LYS   7           2HB      LYS   7  -8.551  -2.500   1.284
   59    HB3  LYS   7           3HB      LYS   7  -8.806  -0.879   1.919
   60    HG2  LYS   7           2HG      LYS   7 -10.793  -0.619   0.541
   61    HG3  LYS   7           3HG      LYS   7 -10.519  -2.200  -0.189
   62    HD2  LYS   7           2HD      LYS   7 -12.217  -2.428   1.486
   63    HD3  LYS   7           3HD      LYS   7 -10.755  -3.219   2.076
   64    HE2  LYS   7           2HE      LYS   7 -10.244  -1.220   3.424
   65    HE3  LYS   7           3HE      LYS   7 -11.731  -0.465   2.848
   66    HZ1  LYS   7           3HZ      LYS   7 -12.107  -1.432   4.989
   67    HZ2  LYS   7           1HZ      LYS   7 -11.515  -2.934   4.479
   68    HZ3  LYS   7           2HZ      LYS   7 -12.959  -2.334   3.840
   69    H    ASP   8           H        ASP   8  -9.692  -0.511  -1.972
   70    HA   ASP   8           HA       ASP   8  -9.907  -3.049  -3.150
   71    HB2  ASP   8           2HB      ASP   8 -11.642  -1.394  -3.383
   72    HB3  ASP   8           3HB      ASP   8 -10.544  -0.278  -4.187
   73    H    MET   9           H        MET   9  -7.896  -0.260  -4.067
   74    HA   MET   9           HA       MET   9  -6.992  -1.439  -6.516
   75    HB2  MET   9           2HB      MET   9  -5.462   0.493  -6.628
   76    HB3  MET   9           3HB      MET   9  -7.125   0.966  -6.317
   77    HG2  MET   9           2HG      MET   9  -6.491   1.066  -3.866
   78    HG3  MET   9           3HG      MET   9  -4.816   0.935  -4.395
   79    HE1  MET   9           3HE      MET   9  -3.613   2.733  -5.943
   80    HE2  MET   9           1HE      MET   9  -4.401   4.191  -6.548
   81    HE3  MET   9           2HE      MET   9  -4.898   2.607  -7.145
   82    H    THR  10           H        THR  10  -4.797  -2.006  -7.039
   83    HA   THR  10           HA       THR  10  -3.668  -3.731  -5.003
   84    HB   THR  10           HB       THR  10  -2.229  -4.600  -6.769
   85    HG1  THR  10           HG1      THR  10  -2.633  -3.634  -8.955
   86   HG21  THR  10          3HG2      THR  10  -5.078  -4.186  -7.702
   87   HG22  THR  10          1HG2      THR  10  -4.488  -5.501  -6.682
   88   HG23  THR  10          2HG2      THR  10  -3.958  -5.379  -8.360
   89    H    PHE  11           H        PHE  11  -1.322  -3.853  -4.624
   90    HA   PHE  11           HA       PHE  11  -0.112  -1.478  -3.817
   91    HB2  PHE  11           2HB      PHE  11   1.137  -4.134  -4.554
   92    HB3  PHE  11           3HB      PHE  11   2.045  -2.808  -3.836
   93    HD1  PHE  11           HD2      PHE  11   1.556  -2.075  -1.527
   94    HD2  PHE  11           HD1      PHE  11  -0.313  -5.501  -3.234
   95    HE1  PHE  11           HE2      PHE  11   0.903  -2.837   0.721
   96    HE2  PHE  11           HE1      PHE  11  -0.969  -6.264  -0.992
   97    HZ   PHE  11           HZ       PHE  11  -0.359  -4.932   0.990
   98    H    ALA  12           H        ALA  12   0.251  -3.233  -6.886
   99    HA   ALA  12           HA       ALA  12   2.235  -1.658  -8.072
  100    HB1  ALA  12           3HB      ALA  12   1.474  -3.777  -9.020
  101    HB2  ALA  12           1HB      ALA  12   1.390  -2.486 -10.218
  102    HB3  ALA  12           2HB      ALA  12  -0.082  -3.051  -9.424
  103    H    GLN  13           H        GLN  13  -1.320  -1.295  -8.324
  104    HA   GLN  13           HA       GLN  13  -1.319   1.018  -9.912
  105    HB2  GLN  13           2HB      GLN  13  -3.351   0.184  -7.831
  106    HB3  GLN  13           3HB      GLN  13  -3.616   1.387  -9.085
  107    HG2  GLN  13           2HG      GLN  13  -3.303  -0.353 -10.798
  108    HG3  GLN  13           3HG      GLN  13  -3.088  -1.552  -9.525
  109   HE21  GLN  13          1HE2      GLN  13  -5.379   1.097  -9.419
  110   HE22  GLN  13          2HE2      GLN  13  -6.798   0.116  -9.495
  111    H    ALA  14           H        ALA  14  -1.329   0.695  -6.364
  112    HA   ALA  14           HA       ALA  14  -1.503   3.404  -5.690
  113    HB1  ALA  14           3HB      ALA  14  -1.730   1.592  -4.063
  114    HB2  ALA  14           1HB      ALA  14  -0.519   2.763  -3.542
  115    HB3  ALA  14           2HB      ALA  14  -0.015   1.217  -4.227
  116    H    LEU  15           H        LEU  15   1.422   1.408  -6.146
  117    HA   LEU  15           HA       LEU  15   3.333   3.418  -5.766
  118    HB2  LEU  15           2HB      LEU  15   3.476   0.948  -7.507
  119    HB3  LEU  15           3HB      LEU  15   4.857   1.941  -7.070
  120    HG   LEU  15           HG       LEU  15   3.135   0.389  -5.121
  121   HD11  LEU  15          1HD1      LEU  15   4.497  -1.074  -6.531
  122   HD12  LEU  15          2HD1      LEU  15   5.071  -1.070  -4.865
  123   HD13  LEU  15          3HD1      LEU  15   5.942  -0.156  -6.098
  124   HD21  LEU  15          3HD2      LEU  15   4.063   2.420  -4.124
  125   HD22  LEU  15          1HD2      LEU  15   5.678   1.961  -4.669
  126   HD23  LEU  15          2HD2      LEU  15   4.838   0.980  -3.468
  127    H    GLN  16           H        GLN  16   1.552   2.496  -8.684
  128    HA   GLN  16           HA       GLN  16   3.088   4.213 -10.411
  129    HB2  GLN  16           2HB      GLN  16   0.444   2.819 -10.891
  130    HB3  GLN  16           3HB      GLN  16   1.389   3.648 -12.122
  131    HG2  GLN  16           2HG      GLN  16   2.135   1.157 -10.606
  132    HG3  GLN  16           3HG      GLN  16   1.800   1.314 -12.329
  133   HE21  GLN  16          1HE2      GLN  16   4.127   1.821  -9.813
  134   HE22  GLN  16          2HE2      GLN  16   5.462   2.185 -10.843
  135    H    THR  17           H        THR  17   0.242   4.611  -8.453
  136    HA   THR  17           HA       THR  17  -0.625   7.062  -9.713
  137    HB   THR  17           HB       THR  17  -1.342   5.957  -6.977
  138    HG1  THR  17           HG1      THR  17  -2.211   4.526  -8.354
  139   HG21  THR  17          3HG2      THR  17  -1.812   8.371  -7.163
  140   HG22  THR  17          1HG2      THR  17  -3.303   7.429  -7.098
  141   HG23  THR  17          2HG2      THR  17  -2.734   8.076  -8.637
  142    H    HIS  18           H        HIS  18   1.347   6.192  -6.916
  143    HA   HIS  18           HA       HIS  18   2.678   8.772  -7.045
  144    HB2  HIS  18           2HB      HIS  18   0.941   7.955  -4.754
  145    HB3  HIS  18           3HB      HIS  18   2.460   8.751  -4.369
  146    HD1  HIS  18           HD1      HIS  18  -0.865   9.378  -5.976
  147    HD2  HIS  18           HD2      HIS  18   2.559  11.474  -4.939
  148    HE1  HIS  18           HE1      HIS  18  -1.470  11.796  -6.203
  149    HE2  HIS  18           HE2      HIS  18   0.694  13.016  -5.842
  150    HA   PRO  19           HA       PRO  19   5.968   5.650  -6.436
  151    HB2  PRO  19           2HB      PRO  19   7.484   8.234  -6.463
  152    HB3  PRO  19           3HB      PRO  19   7.842   6.710  -7.285
  153    HG2  PRO  19           2HG      PRO  19   6.828   8.737  -8.655
  154    HG3  PRO  19           3HG      PRO  19   6.249   7.084  -8.949
  155    HD2  PRO  19           2HD      PRO  19   4.936   9.310  -7.427
  156    HD3  PRO  19           3HD      PRO  19   4.210   8.095  -8.499
  157    H    GLY  20           H        GLY  20   5.316   8.585  -4.597
  158    HA2  GLY  20           2HA      GLY  20   6.999   8.188  -2.390
  159    HA3  GLY  20           3HA      GLY  20   5.472   9.051  -2.354
  160    H    VAL  21           H        VAL  21   4.029   6.584  -3.254
  161    HA   VAL  21           HA       VAL  21   3.236   5.514  -0.811
  162    HB   VAL  21           HB       VAL  21   3.069   4.297  -3.581
  163   HG11  VAL  21          1HG1      VAL  21   2.864   2.518  -1.922
  164   HG12  VAL  21          2HG1      VAL  21   1.302   2.833  -2.679
  165   HG13  VAL  21          3HG1      VAL  21   1.636   3.441  -1.059
  166   HG21  VAL  21          3HG2      VAL  21   1.881   6.419  -3.340
  167   HG22  VAL  21          1HG2      VAL  21   1.026   5.795  -1.929
  168   HG23  VAL  21          2HG2      VAL  21   0.745   5.083  -3.520
  169    H    ALA  22           H        ALA  22   5.863   4.553  -2.944
  170    HA   ALA  22           HA       ALA  22   6.505   2.048  -1.909
  171    HB1  ALA  22           3HB      ALA  22   8.413   4.166  -2.906
  172    HB2  ALA  22           1HB      ALA  22   7.569   2.980  -3.901
  173    HB3  ALA  22           2HB      ALA  22   8.776   2.449  -2.730
  174    H    GLY  23           H        GLY  23   7.730   5.243  -0.842
  175    HA2  GLY  23           2HA      GLY  23   9.291   4.307   1.310
  176    HA3  GLY  23           3HA      GLY  23   8.638   5.930   1.157
  177    H    VAL  24           H        VAL  24   5.859   5.168   1.150
  178    HA   VAL  24           HA       VAL  24   5.340   5.002   3.937
  179    HB   VAL  24           HB       VAL  24   3.408   4.519   1.652
  180   HG11  VAL  24          1HG1      VAL  24   2.573   3.688   3.795
  181   HG12  VAL  24          2HG1      VAL  24   1.667   5.104   3.264
  182   HG13  VAL  24          3HG1      VAL  24   2.880   5.261   4.536
  183   HG21  VAL  24          3HG2      VAL  24   4.134   7.068   3.109
  184   HG22  VAL  24          1HG2      VAL  24   2.778   6.898   1.993
  185   HG23  VAL  24          2HG2      VAL  24   4.429   6.693   1.411
  186    H    LEU  25           H        LEU  25   4.750   2.616   1.323
  187    HA   LEU  25           HA       LEU  25   3.924   0.478   2.909
  188    HB2  LEU  25           2HB      LEU  25   5.549   0.371   0.357
  189    HB3  LEU  25           3HB      LEU  25   4.673  -0.979   1.059
  190    HG   LEU  25           HG       LEU  25   3.429   1.561  -0.019
  191   HD11  LEU  25          1HD1      LEU  25   3.378  -1.249  -1.119
  192   HD12  LEU  25          2HD1      LEU  25   4.317   0.094  -1.770
  193   HD13  LEU  25          3HD1      LEU  25   2.555   0.157  -1.797
  194   HD21  LEU  25          3HD2      LEU  25   2.125  -0.924   1.101
  195   HD22  LEU  25          1HD2      LEU  25   1.286   0.420   0.326
  196   HD23  LEU  25          2HD2      LEU  25   2.139   0.674   1.847
  197    H    ARG  26           H        ARG  26   7.224   1.393   1.934
  198    HA   ARG  26           HA       ARG  26   8.637  -0.619   3.291
  199    HB2  ARG  26           2HB      ARG  26   9.373   2.237   2.616
  200    HB3  ARG  26           3HB      ARG  26  10.510   1.116   3.354
  201    HG2  ARG  26           2HG      ARG  26  10.479  -0.307   1.449
  202    HG3  ARG  26           3HG      ARG  26   9.112   0.559   0.745
  203    HD2  ARG  26           2HD      ARG  26  11.347   1.086  -0.273
  204    HD3  ARG  26           3HD      ARG  26  10.443   2.482   0.312
  205    HE   ARG  26           HE       ARG  26  12.009   1.932   2.413
  206   HH11  ARG  26          1HH1      ARG  26  12.757   2.193  -0.945
  207   HH12  ARG  26          2HH1      ARG  26  14.345   2.809  -0.650
  208   HH21  ARG  26          1HH2      ARG  26  14.033   2.722   2.773
  209   HH22  ARG  26          2HH2      ARG  26  15.057   3.112   1.435
  210    H    SER  27           H        SER  27   7.483   2.542   4.426
  211    HA   SER  27           HA       SER  27   8.577   2.495   7.013
  212    HB2  SER  27           2HB      SER  27   7.597   4.522   6.048
  213    HB3  SER  27           3HB      SER  27   5.999   3.781   6.054
  214    HG   SER  27           HG       SER  27   6.542   5.247   7.854
  215    H    TYR  28           H        TYR  28   5.612   1.079   5.738
  216    HA   TYR  28           HA       TYR  28   4.916   0.026   8.389
  217    HB2  TYR  28           2HB      TYR  28   3.361   0.202   5.802
  218    HB3  TYR  28           3HB      TYR  28   2.775  -0.677   7.214
  219    HD1  TYR  28           HD1      TYR  28   3.746   2.697   5.991
  220    HD2  TYR  28           HD2      TYR  28   1.786   0.471   9.052
  221    HE1  TYR  28           HE1      TYR  28   2.860   4.785   6.932
  222    HE2  TYR  28           HE2      TYR  28   0.892   2.558   9.996
  223    HH   TYR  28           HH       TYR  28   1.382   4.913  10.017
  224    H    ASN  29           H        ASN  29   7.141  -1.028   6.624
  225    HA   ASN  29           HA       ASN  29   8.167  -3.049   6.410
  226    HB2  ASN  29           2HB      ASN  29   7.032  -3.238   8.740
  227    HB3  ASN  29           3HB      ASN  29   5.909  -4.331   7.943
  228   HD21  ASN  29          1HD2      ASN  29   7.736  -4.903  10.074
  229   HD22  ASN  29          2HD2      ASN  29   8.804  -6.133   9.505
  230    H    LEU  30           H        LEU  30   5.617  -2.287   4.698
  231    HA   LEU  30           HA       LEU  30   4.936  -4.892   3.597
  232    HB2  LEU  30           2HB      LEU  30   4.098  -2.114   2.741
  233    HB3  LEU  30           3HB      LEU  30   3.476  -3.609   2.066
  234    HG   LEU  30           HG       LEU  30   3.123  -2.701   4.932
  235   HD11  LEU  30          1HD1      LEU  30   0.774  -2.418   4.319
  236   HD12  LEU  30          2HD1      LEU  30   1.151  -2.846   2.650
  237   HD13  LEU  30          3HD1      LEU  30   1.818  -1.373   3.355
  238   HD21  LEU  30          3HD2      LEU  30   1.596  -4.607   5.129
  239   HD22  LEU  30          1HD2      LEU  30   3.237  -5.136   4.762
  240   HD23  LEU  30          2HD2      LEU  30   2.012  -5.115   3.492
  241    H    GLY  31           H        GLY  31   7.584  -3.039   3.257
  242    HA2  GLY  31           2HA      GLY  31   7.981  -2.609   0.533
  243    HA3  GLY  31           3HA      GLY  31   9.264  -2.902   1.693
  244    H    CYS  32           H        CYS  32   8.072  -5.626   2.269
  245    HA   CYS  32           HA       CYS  32   9.685  -7.050   0.389
  246    HB2  CYS  32           2HB      CYS  32   7.816  -8.100   2.523
  247    HB3  CYS  32           3HB      CYS  32   9.008  -9.056   1.648
  248    HG   CYS  32           HG       CYS  32  10.846  -6.762   2.758
  249    H    ILE  33           H        ILE  33   6.630  -5.863  -0.037
  250    HA   ILE  33           HA       ILE  33   5.142  -7.924  -1.178
  251    HB   ILE  33           HB       ILE  33   4.085  -6.173  -2.635
  252   HG12  ILE  33          2HG1      ILE  33   6.067  -4.346  -1.241
  253   HG13  ILE  33          3HG1      ILE  33   6.066  -4.747  -2.955
  254   HG21  ILE  33          1HG2      ILE  33   4.323  -5.513   0.299
  255   HG22  ILE  33          2HG2      ILE  33   3.209  -6.671  -0.425
  256   HG23  ILE  33          3HG2      ILE  33   3.047  -4.952  -0.780
  257   HD11  ILE  33          3HD1      ILE  33   3.944  -3.204  -1.479
  258   HD12  ILE  33          1HD1      ILE  33   3.882  -3.652  -3.186
  259   HD13  ILE  33          2HD1      ILE  33   5.135  -2.557  -2.606
  260    H    GLY  34           H        GLY  34   7.871  -6.167  -2.517
  261    HA2  GLY  34           2HA      GLY  34   7.610  -6.995  -5.214
  262    HA3  GLY  34           3HA      GLY  34   9.101  -6.487  -4.435
  263    H    CYS  35           H        CYS  35   9.549  -8.362  -2.550
  264    HA   CYS  35           HA       CYS  35  10.679 -10.490  -3.999
  265    HB2  CYS  35           2HB      CYS  35  11.575  -9.733  -1.847
  266    HB3  CYS  35           3HB      CYS  35  10.125 -10.303  -1.030
  267    HG   CYS  35           HG       CYS  35  10.967 -12.679  -0.589
  268    H    MET  36           H        MET  36   7.595 -10.266  -2.306
  269    HA   MET  36           HA       MET  36   7.036 -13.098  -2.824
  270    HB2  MET  36           2HB      MET  36   5.013 -12.775  -1.490
  271    HB3  MET  36           3HB      MET  36   6.432 -12.215  -0.619
  272    HG2  MET  36           2HG      MET  36   5.880  -9.907  -1.184
  273    HG3  MET  36           3HG      MET  36   4.467 -10.460  -2.080
  274    HE1  MET  36           3HE      MET  36   2.328 -11.581  -0.938
  275    HE2  MET  36           1HE      MET  36   2.230 -11.951   0.784
  276    HE3  MET  36           2HE      MET  36   3.381 -12.812  -0.238
  277    H    GLY  37           H        GLY  37   6.841 -10.374  -4.618
  278    HA2  GLY  37           2HA      GLY  37   5.812  -9.907  -6.618
  279    HA3  GLY  37           3HA      GLY  37   5.210 -11.555  -6.607
  280    H    ALA  38           H        ALA  38   4.381  -9.451  -3.962
  281    HA   ALA  38           HA       ALA  38   1.587  -9.846  -4.462
  282    HB1  ALA  38           3HB      ALA  38   2.498  -9.835  -2.197
  283    HB2  ALA  38           1HB      ALA  38   1.236  -8.617  -2.387
  284    HB3  ALA  38           2HB      ALA  38   2.934  -8.136  -2.376
  285    H    GLN  39           H        GLN  39   3.285  -8.023  -6.305
  286    HA   GLN  39           HA       GLN  39   2.368  -5.376  -6.112
  287    HB2  GLN  39           2HB      GLN  39   3.197  -6.998  -8.530
  288    HB3  GLN  39           3HB      GLN  39   2.901  -5.267  -8.574
  289    HG2  GLN  39           2HG      GLN  39   4.983  -6.604  -6.848
  290    HG3  GLN  39           3HG      GLN  39   5.297  -5.871  -8.420
  291   HE21  GLN  39          1HE2      GLN  39   4.549  -5.268  -5.087
  292   HE22  GLN  39          2HE2      GLN  39   4.874  -3.576  -5.113
  293    H    ASN  40           H        ASN  40   0.848  -8.247  -7.414
  294    HA   ASN  40           HA       ASN  40  -1.273  -6.719  -8.732
  295    HB2  ASN  40           2HB      ASN  40  -0.950  -9.726  -8.590
  296    HB3  ASN  40           3HB      ASN  40  -1.942  -8.809  -9.723
  297   HD21  ASN  40          1HD2      ASN  40   1.266  -9.818  -8.893
  298   HD22  ASN  40          2HD2      ASN  40   2.014  -9.337 -10.376
  299    H    GLU  41           H        GLU  41  -0.820  -7.397  -5.644
  300    HA   GLU  41           HA       GLU  41  -3.526  -8.428  -5.117
  301    HB2  GLU  41           2HB      GLU  41  -1.607  -9.664  -4.133
  302    HB3  GLU  41           3HB      GLU  41  -1.178  -8.226  -3.218
  303    HG2  GLU  41           2HG      GLU  41  -3.139  -8.356  -1.905
  304    HG3  GLU  41           3HG      GLU  41  -3.864  -9.553  -2.977
  305    H    SER  42           H        SER  42  -4.968  -7.325  -3.823
  306    HA   SER  42           HA       SER  42  -4.846  -4.499  -3.859
  307    HB2  SER  42           2HB      SER  42  -6.710  -6.288  -2.275
  308    HB3  SER  42           3HB      SER  42  -6.953  -4.569  -2.581
  309    HG   SER  42           HG       SER  42  -7.552  -4.992  -4.577
  310    H    LEU  43           H        LEU  43  -4.802  -2.994  -2.141
  311    HA   LEU  43           HA       LEU  43  -2.652  -3.219  -0.433
  312    HB2  LEU  43           2HB      LEU  43  -5.080  -1.448  -0.151
  313    HB3  LEU  43           3HB      LEU  43  -3.594  -1.238   0.758
  314    HG   LEU  43           HG       LEU  43  -3.847  -1.038  -2.253
  315   HD11  LEU  43          1HD1      LEU  43  -4.925   0.827  -1.090
  316   HD12  LEU  43          2HD1      LEU  43  -3.475   1.342  -1.948
  317   HD13  LEU  43          3HD1      LEU  43  -3.436   1.132  -0.197
  318   HD21  LEU  43          3HD2      LEU  43  -1.542  -0.162  -2.146
  319   HD22  LEU  43          1HD2      LEU  43  -1.652  -1.844  -1.627
  320   HD23  LEU  43          2HD2      LEU  43  -1.488  -0.560  -0.428
  321    H    GLU  44           H        GLU  44  -6.095  -3.688   0.498
  322    HA   GLU  44           HA       GLU  44  -5.583  -4.038   3.243
  323    HB2  GLU  44           2HB      GLU  44  -7.828  -3.561   2.390
  324    HB3  GLU  44           3HB      GLU  44  -7.890  -5.142   1.625
  325    HG2  GLU  44           2HG      GLU  44  -7.933  -6.257   3.732
  326    HG3  GLU  44           3HG      GLU  44  -7.554  -4.770   4.596
  327    H    GLN  45           H        GLN  45  -5.665  -6.406   0.614
  328    HA   GLN  45           HA       GLN  45  -5.556  -8.727   2.218
  329    HB2  GLN  45           2HB      GLN  45  -4.592  -8.272  -0.613
  330    HB3  GLN  45           3HB      GLN  45  -4.689  -9.849   0.155
  331    HG2  GLN  45           2HG      GLN  45  -7.131  -9.530   0.427
  332    HG3  GLN  45           3HG      GLN  45  -6.993  -7.998  -0.432
  333   HE21  GLN  45          1HE2      GLN  45  -6.671  -8.014  -2.654
  334   HE22  GLN  45          2HE2      GLN  45  -6.853  -9.439  -3.609
  335    H    GLY  46           H        GLY  46  -2.900  -7.012   0.520
  336    HA2  GLY  46           2HA      GLY  46  -0.772  -8.525   1.581
  337    HA3  GLY  46           3HA      GLY  46  -0.642  -6.884   0.972
  338    H    ALA  47           H        ALA  47  -2.355  -5.601   2.831
  339    HA   ALA  47           HA       ALA  47  -0.694  -5.123   5.035
  340    HB1  ALA  47           3HB      ALA  47  -2.416  -3.546   4.291
  341    HB2  ALA  47           1HB      ALA  47  -2.600  -3.923   6.004
  342    HB3  ALA  47           2HB      ALA  47  -3.675  -4.663   4.818
  343    H    ASN  48           H        ASN  48  -3.659  -7.096   4.819
  344    HA   ASN  48           HA       ASN  48  -3.643  -8.060   7.467
  345    HB2  ASN  48           2HB      ASN  48  -4.817  -9.171   4.915
  346    HB3  ASN  48           3HB      ASN  48  -5.017  -9.980   6.466
  347   HD21  ASN  48          1HD2      ASN  48  -4.934  -6.494   6.158
  348   HD22  ASN  48          2HD2      ASN  48  -6.596  -6.245   6.535
  349    H    ALA  49           H        ALA  49  -2.058  -9.252   4.541
  350    HA   ALA  49           HA       ALA  49  -1.094 -11.699   5.483
  351    HB1  ALA  49           3HB      ALA  49   0.234  -9.813   3.529
  352    HB2  ALA  49           1HB      ALA  49  -0.980 -11.030   3.133
  353    HB3  ALA  49           2HB      ALA  49   0.605 -11.526   3.728
  354    H    HIS  50           H        HIS  50   0.110  -8.429   6.035
  355    HA   HIS  50           HA       HIS  50   2.327  -9.490   7.663
  356    HB2  HIS  50           2HB      HIS  50   1.725  -6.710   6.635
  357    HB3  HIS  50           3HB      HIS  50   3.001  -7.039   7.804
  358    HD1  HIS  50           HD1      HIS  50   5.226  -7.388   6.775
  359    HD2  HIS  50           HD2      HIS  50   2.153  -8.403   4.167
  360    HE1  HIS  50           HE1      HIS  50   6.351  -8.023   4.630
  361    HE2  HIS  50           HE2      HIS  50   4.492  -8.832   3.149
  362    H    GLY  51           H        GLY  51  -0.794  -8.982   8.212
  363    HA2  GLY  51           2HA      GLY  51  -2.038  -8.767  10.129
  364    HA3  GLY  51           3HA      GLY  51  -0.535  -8.843  11.032
  365    H    LEU  52           H        LEU  52  -1.593  -6.430   8.650
  366    HA   LEU  52           HA       LEU  52  -1.489  -4.376  10.778
  367    HB2  LEU  52           2HB      LEU  52  -0.616  -4.096   7.893
  368    HB3  LEU  52           3HB      LEU  52  -0.653  -2.793   9.068
  369    HG   LEU  52           HG       LEU  52   1.094  -5.257   9.261
  370   HD11  LEU  52          1HD1      LEU  52   2.947  -3.752   8.748
  371   HD12  LEU  52          2HD1      LEU  52   1.812  -2.422   8.510
  372   HD13  LEU  52          3HD1      LEU  52   1.784  -3.814   7.425
  373   HD21  LEU  52          3HD2      LEU  52   0.993  -2.760  10.962
  374   HD22  LEU  52          1HD2      LEU  52   2.211  -4.030  11.081
  375   HD23  LEU  52          2HD2      LEU  52   0.527  -4.388  11.455
  376    H    ASN  53           H        ASN  53  -2.990  -2.674  10.663
  377    HA   ASN  53           HA       ASN  53  -5.428  -3.256   9.222
  378    HB2  ASN  53           2HB      ASN  53  -5.562  -2.404  11.511
  379    HB3  ASN  53           3HB      ASN  53  -4.719  -0.931  11.032
  380   HD21  ASN  53          1HD2      ASN  53  -6.507   0.315  11.729
  381   HD22  ASN  53          2HD2      ASN  53  -7.961   0.401  10.796
  382    H    VAL  54           H        VAL  54  -5.745  -2.673   7.200
  383    HA   VAL  54           HA       VAL  54  -4.031  -1.087   5.677
  384    HB   VAL  54           HB       VAL  54  -5.588  -2.769   4.735
  385   HG11  VAL  54          1HG1      VAL  54  -7.583  -2.264   6.025
  386   HG12  VAL  54          2HG1      VAL  54  -7.936  -2.152   4.301
  387   HG13  VAL  54          3HG1      VAL  54  -7.713  -0.684   5.253
  388   HG21  VAL  54          3HG2      VAL  54  -4.533  -1.119   3.264
  389   HG22  VAL  54          1HG2      VAL  54  -5.881  -0.012   3.525
  390   HG23  VAL  54          2HG2      VAL  54  -6.145  -1.541   2.686
  391    H    GLU  55           H        GLU  55  -6.790  -0.140   7.615
  392    HA   GLU  55           HA       GLU  55  -7.477   2.282   6.380
  393    HB2  GLU  55           2HB      GLU  55  -7.628   1.644   9.334
  394    HB3  GLU  55           3HB      GLU  55  -8.541   2.886   8.488
  395    HG2  GLU  55           2HG      GLU  55  -9.650   1.125   7.162
  396    HG3  GLU  55           3HG      GLU  55  -8.780  -0.094   8.091
  397    H    ASP  56           H        ASP  56  -5.044   1.647   8.903
  398    HA   ASP  56           HA       ASP  56  -4.379   4.396   9.289
  399    HB2  ASP  56           2HB      ASP  56  -3.940   2.560  10.955
  400    HB3  ASP  56           3HB      ASP  56  -2.640   1.993   9.907
  401    H    ILE  57           H        ILE  57  -3.217   1.861   7.162
  402    HA   ILE  57           HA       ILE  57  -0.968   3.252   6.111
  403    HB   ILE  57           HB       ILE  57  -2.647   1.128   4.748
  404   HG12  ILE  57          2HG1      ILE  57  -0.167   0.780   6.463
  405   HG13  ILE  57          3HG1      ILE  57  -1.810   0.439   6.998
  406   HG21  ILE  57          1HG2      ILE  57  -1.151   2.322   3.219
  407   HG22  ILE  57          2HG2      ILE  57  -0.622   0.656   3.452
  408   HG23  ILE  57          3HG2      ILE  57   0.219   1.971   4.275
  409   HD11  ILE  57          3HD1      ILE  57  -2.009  -1.310   5.335
  410   HD12  ILE  57          1HD1      ILE  57  -0.596  -1.581   6.355
  411   HD13  ILE  57          2HD1      ILE  57  -0.398  -0.939   4.724
  412    H    LEU  58           H        LEU  58  -4.314   2.858   4.920
  413    HA   LEU  58           HA       LEU  58  -4.152   4.402   2.615
  414    HB2  LEU  58           2HB      LEU  58  -6.502   4.067   4.492
  415    HB3  LEU  58           3HB      LEU  58  -6.607   4.755   2.881
  416    HG   LEU  58           HG       LEU  58  -5.811   1.911   3.543
  417   HD11  LEU  58          1HD1      LEU  58  -8.311   3.005   2.255
  418   HD12  LEU  58          2HD1      LEU  58  -8.188   2.335   3.883
  419   HD13  LEU  58          3HD1      LEU  58  -7.922   1.299   2.481
  420   HD21  LEU  58          3HD2      LEU  58  -5.846   1.533   1.125
  421   HD22  LEU  58          1HD2      LEU  58  -4.628   2.730   1.561
  422   HD23  LEU  58          2HD2      LEU  58  -6.158   3.247   0.851
  423    H    ARG  59           H        ARG  59  -4.809   5.444   5.946
  424    HA   ARG  59           HA       ARG  59  -5.266   8.150   5.592
  425    HB2  ARG  59           2HB      ARG  59  -5.406   7.210   7.792
  426    HB3  ARG  59           3HB      ARG  59  -3.729   6.681   7.741
  427    HG2  ARG  59           2HG      ARG  59  -3.123   9.162   7.605
  428    HG3  ARG  59           3HG      ARG  59  -4.795   9.477   8.068
  429    HD2  ARG  59           2HD      ARG  59  -3.161   9.457   9.973
  430    HD3  ARG  59           3HD      ARG  59  -4.510   8.333  10.150
  431    HE   ARG  59           HE       ARG  59  -3.011   6.618  10.155
  432   HH11  ARG  59          1HH1      ARG  59  -1.412   9.372   8.812
  433   HH12  ARG  59          2HH1      ARG  59   0.077   8.523   8.592
  434   HH21  ARG  59          1HH2      ARG  59  -1.107   5.574   9.891
  435   HH22  ARG  59          2HH2      ARG  59   0.243   6.388   9.177
  436    H    ASP  60           H        ASP  60  -2.102   6.546   5.962
  437    HA   ASP  60           HA       ASP  60  -0.597   8.943   5.673
  438    HB2  ASP  60           2HB      ASP  60  -0.042   6.519   6.701
  439    HB3  ASP  60           3HB      ASP  60   0.688   6.310   5.113
  440    H    LEU  61           H        LEU  61  -1.695   6.467   3.425
  441    HA   LEU  61           HA       LEU  61  -0.121   7.262   1.191
  442    HB2  LEU  61           2HB      LEU  61  -2.771   5.812   1.301
  443    HB3  LEU  61           3HB      LEU  61  -1.798   5.993  -0.147
  444    HG   LEU  61           HG       LEU  61  -0.999   4.478   2.348
  445   HD11  LEU  61          1HD1      LEU  61  -2.708   3.331   1.028
  446   HD12  LEU  61          2HD1      LEU  61  -1.159   2.496   0.932
  447   HD13  LEU  61          3HD1      LEU  61  -1.710   3.492  -0.417
  448   HD21  LEU  61          3HD2      LEU  61   0.963   3.779   1.051
  449   HD22  LEU  61          1HD2      LEU  61   0.937   5.524   1.303
  450   HD23  LEU  61          2HD2      LEU  61   0.476   4.852  -0.262
  451    H    ASN  62           H        ASN  62  -3.548   7.955   1.999
  452    HA   ASN  62           HA       ASN  62  -3.966   9.705  -0.186
  453    HB2  ASN  62           2HB      ASN  62  -5.450   9.345   2.418
  454    HB3  ASN  62           3HB      ASN  62  -5.947  10.532   1.217
  455   HD21  ASN  62          1HD2      ASN  62  -5.815   7.183   2.021
  456   HD22  ASN  62          2HD2      ASN  62  -6.746   6.613   0.686
  457    H    ALA  63           H        ALA  63  -2.536  10.208   2.956
  458    HA   ALA  63           HA       ALA  63  -2.599  12.995   3.122
  459    HB1  ALA  63           3HB      ALA  63  -0.325  11.182   3.941
  460    HB2  ALA  63           1HB      ALA  63  -1.759  11.524   4.909
  461    HB3  ALA  63           2HB      ALA  63  -0.623  12.819   4.526
  462    H    LEU  64           H        LEU  64  -0.657  10.906   1.073
  463    HA   LEU  64           HA       LEU  64   1.177  12.878   0.137
  464    HB2  LEU  64           2HB      LEU  64   0.222  10.336  -1.194
  465    HB3  LEU  64           3HB      LEU  64   1.606  11.286  -1.706
  466    HG   LEU  64           HG       LEU  64   1.373   9.871   0.962
  467   HD11  LEU  64          1HD1      LEU  64   3.009   8.293   0.047
  468   HD12  LEU  64          2HD1      LEU  64   2.920   9.103  -1.517
  469   HD13  LEU  64          3HD1      LEU  64   1.505   8.273  -0.873
  470   HD21  LEU  64          3HD2      LEU  64   3.721  11.253  -0.349
  471   HD22  LEU  64          1HD2      LEU  64   3.757  10.366   1.177
  472   HD23  LEU  64          2HD2      LEU  64   2.812  11.849   1.041
  473    H    ALA  65           H        ALA  65  -2.132  12.283  -0.524
  474    HA   ALA  65           HA       ALA  65  -2.091  13.744  -3.068
  475    HB1  ALA  65           3HB      ALA  65  -4.387  12.359  -1.673
  476    HB2  ALA  65           1HB      ALA  65  -3.392  11.664  -2.953
  477    HB3  ALA  65           2HB      ALA  65  -4.420  13.056  -3.293
  478    H    LEU  66           H        LEU  66  -3.678  13.902   0.118
  479    HA   LEU  66           HA       LEU  66  -4.972  16.388  -0.275
  480    HB2  LEU  66           2HB      LEU  66  -4.099  15.087   2.313
  481    HB3  LEU  66           3HB      LEU  66  -5.273  16.382   2.162
  482    HG   LEU  66           HG       LEU  66  -5.601  13.584   1.055
  483   HD11  LEU  66          1HD1      LEU  66  -7.284  13.294   2.795
  484   HD12  LEU  66          2HD1      LEU  66  -6.929  14.902   3.425
  485   HD13  LEU  66          3HD1      LEU  66  -5.702  13.636   3.497
  486   HD21  LEU  66          3HD2      LEU  66  -6.750  15.233  -0.316
  487   HD22  LEU  66          1HD2      LEU  66  -7.528  15.914   1.116
  488   HD23  LEU  66          2HD2      LEU  66  -7.916  14.275   0.593
  489    H    GLU  67           H        GLU  67  -1.926  15.564   1.374
  490    HA   GLU  67           HA       GLU  67  -0.024  16.718   1.780
  491    HB2  GLU  67           2HB      GLU  67  -0.974  18.399  -0.546
  492    HB3  GLU  67           3HB      GLU  67   0.663  18.391   0.101
  493    HG2  GLU  67           2HG      GLU  67   0.834  15.987  -0.469
  494    HG3  GLU  67           3HG      GLU  67  -0.766  16.076  -1.202
  495    H    HIS  68           H        HIS  68  -2.663  17.795   3.005
  496    HA   HIS  68           HA       HIS  68  -1.976  20.581   3.486
  497    HB2  HIS  68           2HB      HIS  68  -4.143  18.866   4.737
  498    HB3  HIS  68           3HB      HIS  68  -3.957  20.601   4.972
  499    HD1  HIS  68           HD1      HIS  68  -4.208  22.064   2.689
  500    HD2  HIS  68           HD2      HIS  68  -5.685  18.178   2.605
  501    HE1  HIS  68           HE1      HIS  68  -5.747  21.971   0.709
  502    HE2  HIS  68           HE2      HIS  68  -6.594  19.602   0.645
  503    H    HIS  69           H        HIS  69  -0.969  17.639   4.680
  504    HA   HIS  69           HA       HIS  69   0.619  17.104   6.196
  505    HB2  HIS  69           2HB      HIS  69   1.481  19.434   5.530
  506    HB3  HIS  69           3HB      HIS  69   0.791  19.994   7.048
  507    HD1  HIS  69           HD1      HIS  69   3.760  18.447   5.620
  508    HD2  HIS  69           HD2      HIS  69   2.023  18.722   9.382
  509    HE1  HIS  69           HE1      HIS  69   5.555  17.771   7.235
  510    HE2  HIS  69           HE2      HIS  69   4.525  18.081   9.508
  511    H    HIS  70           H        HIS  70  -0.993  19.795   7.877
  512    HA   HIS  70           HA       HIS  70  -2.017  20.052   9.836
  513    HB2  HIS  70           2HB      HIS  70  -3.761  18.610  10.475
  514    HB3  HIS  70           3HB      HIS  70  -3.671  18.520   8.728
  515    HD1  HIS  70           HD1      HIS  70  -2.825  16.486  11.805
  516    HD2  HIS  70           HD2      HIS  70  -3.427  15.971   7.724
  517    HE1  HIS  70           HE1      HIS  70  -2.855  14.005  11.437
  518    HE2  HIS  70           HE2      HIS  70  -3.429  13.726   9.007
  519    H    HIS  71           H        HIS  71  -0.525  16.779  10.071
  520    HA   HIS  71           HA       HIS  71  -0.013  17.054  12.859
  521    HB2  HIS  71           2HB      HIS  71  -0.260  14.860  11.750
  522    HB3  HIS  71           3HB      HIS  71   1.213  15.156  10.835
  523    HD1  HIS  71           HD1      HIS  71  -0.012  13.821  14.031
  524    HD2  HIS  71           HD2      HIS  71   3.606  15.162  12.483
  525    HE1  HIS  71           HE1      HIS  71   1.759  12.940  15.580
  526    HE2  HIS  71           HE2      HIS  71   3.927  13.809  14.663
  527    H    HIS  72           H        HIS  72   1.194  18.898  13.314
  528    HA   HIS  72           HA       HIS  72   3.939  18.921  12.216
  529    HB2  HIS  72           2HB      HIS  72   3.867  21.458  12.607
  530    HB3  HIS  72           3HB      HIS  72   2.987  20.817  11.227
  531    HD1  HIS  72           HD1      HIS  72   2.339  22.110  14.733
  532    HD2  HIS  72           HD2      HIS  72   0.347  21.466  11.148
  533    HE1  HIS  72           HE1      HIS  72   0.068  23.135  15.030
  534    HE2  HIS  72           HE2      HIS  72  -1.184  22.532  12.934
  535    H    HIS  73           H        HIS  73   4.307  17.523  14.079
  536    HA   HIS  73           HA       HIS  73   5.507  19.124  16.196
  537    HB2  HIS  73           2HB      HIS  73   3.492  16.936  16.747
  538    HB3  HIS  73           3HB      HIS  73   4.717  17.375  17.927
  539    HD1  HIS  73           HD1      HIS  73   4.560  19.830  18.920
  540    HD2  HIS  73           HD2      HIS  73   1.300  18.595  16.657
  541    HE1  HIS  73           HE1      HIS  73   2.709  21.433  19.472
  542    HE2  HIS  73           HE2      HIS  73   0.795  20.748  17.991
  Start of MODEL   19
    1    H1   MET   1           1H       MET   1 -18.731   8.167  -2.894
    2    H2   MET   1           2H       MET   1 -19.333   9.572  -2.170
    3    H3   MET   1           3H       MET   1 -18.600   8.381  -1.222
    4    HA   MET   1           HA       MET   1 -17.237   9.978  -3.313
    5    HB2  MET   1           2HB      MET   1 -17.871  11.313  -1.307
    6    HB3  MET   1           3HB      MET   1 -17.007  10.166  -0.293
    7    HG2  MET   1           2HG      MET   1 -14.914  10.748  -1.464
    8    HG3  MET   1           3HG      MET   1 -15.801  11.942  -2.409
    9    HE1  MET   1           3HE      MET   1 -14.312  10.968   1.045
   10    HE2  MET   1           1HE      MET   1 -16.025  10.983   1.457
   11    HE3  MET   1           2HE      MET   1 -14.949  12.213   2.119
   12    H    THR   2           H        THR   2 -15.121   9.393  -3.739
   13    HA   THR   2           HA       THR   2 -14.106   6.993  -2.320
   14    HB   THR   2           HB       THR   2 -14.700   6.363  -4.578
   15    HG1  THR   2           HG1      THR   2 -12.138   6.291  -5.231
   16   HG21  THR   2          3HG2      THR   2 -12.874   8.601  -5.481
   17   HG22  THR   2          1HG2      THR   2 -14.630   8.555  -5.656
   18   HG23  THR   2          2HG2      THR   2 -13.624   7.405  -6.537
   19    H    GLN   3           H        GLN   3 -11.885   6.819  -1.944
   20    HA   GLN   3           HA       GLN   3 -10.442   9.360  -1.805
   21    HB2  GLN   3           2HB      GLN   3  -9.690   6.622  -0.738
   22    HB3  GLN   3           3HB      GLN   3  -8.849   8.129  -0.394
   23    HG2  GLN   3           2HG      GLN   3 -10.792   8.976   0.786
   24    HG3  GLN   3           3HG      GLN   3 -11.701   7.521   0.379
   25   HE21  GLN   3          1HE2      GLN   3  -9.388   5.767   0.819
   26   HE22  GLN   3          2HE2      GLN   3  -9.197   5.672   2.530
   27    H    LYS   4           H        LYS   4  -8.122   9.412  -2.443
   28    HA   LYS   4           HA       LYS   4  -7.695   8.413  -5.070
   29    HB2  LYS   4           2HB      LYS   4  -5.837   9.718  -3.077
   30    HB3  LYS   4           3HB      LYS   4  -5.303   9.214  -4.677
   31    HG2  LYS   4           2HG      LYS   4  -7.454  11.242  -4.061
   32    HG3  LYS   4           3HG      LYS   4  -5.833  11.577  -4.678
   33    HD2  LYS   4           2HD      LYS   4  -8.006  10.020  -6.103
   34    HD3  LYS   4           3HD      LYS   4  -7.479  11.660  -6.485
   35    HE2  LYS   4           2HE      LYS   4  -5.289  10.852  -7.121
   36    HE3  LYS   4           3HE      LYS   4  -5.711   9.216  -6.611
   37    HZ1  LYS   4           3HZ      LYS   4  -6.983  10.717  -8.834
   38    HZ2  LYS   4           1HZ      LYS   4  -7.396   9.153  -8.339
   39    HZ3  LYS   4           2HZ      LYS   4  -5.871   9.454  -8.996
   40    H    PHE   5           H        PHE   5  -6.716   7.294  -1.892
   41    HA   PHE   5           HA       PHE   5  -5.705   4.819  -3.153
   42    HB2  PHE   5           2HB      PHE   5  -4.788   6.090  -0.555
   43    HB3  PHE   5           3HB      PHE   5  -4.238   4.534  -1.171
   44    HD1  PHE   5           HD1      PHE   5  -2.829   4.419  -3.185
   45    HD2  PHE   5           HD2      PHE   5  -3.958   8.155  -1.469
   46    HE1  PHE   5           HE1      PHE   5  -1.076   5.547  -4.488
   47    HE2  PHE   5           HE2      PHE   5  -2.204   9.284  -2.771
   48    HZ   PHE   5           HZ       PHE   5  -0.761   7.980  -4.285
   49    H    THR   6           H        THR   6  -6.929   3.102  -2.780
   50    HA   THR   6           HA       THR   6  -8.678   3.066  -0.389
   51    HB   THR   6           HB       THR   6 -10.097   3.399  -2.299
   52    HG1  THR   6           HG1      THR   6 -11.401   1.577  -2.073
   53   HG21  THR   6          3HG2      THR   6 -10.127   1.848  -4.210
   54   HG22  THR   6          1HG2      THR   6  -8.744   0.989  -3.530
   55   HG23  THR   6          2HG2      THR   6  -8.569   2.662  -4.062
   56    H    LYS   7           H        LYS   7  -9.509   0.808   0.085
   57    HA   LYS   7           HA       LYS   7  -7.274  -0.924   0.550
   58    HB2  LYS   7           2HB      LYS   7  -8.981  -2.406   1.601
   59    HB3  LYS   7           3HB      LYS   7  -9.004  -0.761   2.217
   60    HG2  LYS   7           2HG      LYS   7 -10.986  -0.238   0.998
   61    HG3  LYS   7           3HG      LYS   7 -10.893  -1.744   0.081
   62    HD2  LYS   7           2HD      LYS   7 -12.600  -1.837   1.861
   63    HD3  LYS   7           3HD      LYS   7 -11.327  -3.036   2.090
   64    HE2  LYS   7           2HE      LYS   7 -10.233  -1.448   3.694
   65    HE3  LYS   7           3HE      LYS   7 -11.655  -0.415   3.552
   66    HZ1  LYS   7           3HZ      LYS   7 -13.011  -2.248   4.373
   67    HZ2  LYS   7           1HZ      LYS   7 -11.806  -1.836   5.488
   68    HZ3  LYS   7           2HZ      LYS   7 -11.632  -3.218   4.528
   69    H    ASP   8           H        ASP   8  -9.510  -0.617  -1.999
   70    HA   ASP   8           HA       ASP   8  -9.571  -3.391  -2.791
   71    HB2  ASP   8           2HB      ASP   8 -11.509  -1.977  -3.155
   72    HB3  ASP   8           3HB      ASP   8 -10.559  -0.871  -4.141
   73    H    MET   9           H        MET   9  -7.795  -0.514  -3.807
   74    HA   MET   9           HA       MET   9  -6.861  -1.541  -6.281
   75    HB2  MET   9           2HB      MET   9  -5.336   0.378  -6.283
   76    HB3  MET   9           3HB      MET   9  -6.966   0.856  -5.826
   77    HG2  MET   9           2HG      MET   9  -6.192   0.686  -3.418
   78    HG3  MET   9           3HG      MET   9  -4.553   0.568  -4.056
   79    HE1  MET   9           3HE      MET   9  -4.817   2.506  -6.627
   80    HE2  MET   9           1HE      MET   9  -3.423   2.517  -5.549
   81    HE3  MET   9           2HE      MET   9  -4.245   4.027  -5.943
   82    H    THR  10           H        THR  10  -4.727  -2.197  -6.876
   83    HA   THR  10           HA       THR  10  -3.509  -3.931  -4.887
   84    HB   THR  10           HB       THR  10  -2.210  -4.873  -6.701
   85    HG1  THR  10           HG1      THR  10  -2.620  -3.948  -8.873
   86   HG21  THR  10          3HG2      THR  10  -5.050  -4.368  -7.610
   87   HG22  THR  10          1HG2      THR  10  -4.546  -5.627  -6.480
   88   HG23  THR  10          2HG2      THR  10  -3.998  -5.674  -8.157
   89    H    PHE  11           H        PHE  11  -1.155  -4.071  -4.621
   90    HA   PHE  11           HA       PHE  11   0.058  -1.664  -3.893
   91    HB2  PHE  11           2HB      PHE  11   1.287  -4.355  -4.525
   92    HB3  PHE  11           3HB      PHE  11   2.202  -3.009  -3.857
   93    HD1  PHE  11           HD2      PHE  11   1.798  -2.237  -1.573
   94    HD2  PHE  11           HD1      PHE  11  -0.262  -5.615  -3.164
   95    HE1  PHE  11           HE2      PHE  11   1.137  -2.902   0.700
   96    HE2  PHE  11           HE1      PHE  11  -0.925  -6.280  -0.890
   97    HZ   PHE  11           HZ       PHE  11  -0.227  -4.926   1.044
   98    H    ALA  12           H        ALA  12   0.430  -3.538  -6.905
   99    HA   ALA  12           HA       ALA  12   2.465  -2.032  -8.092
  100    HB1  ALA  12           3HB      ALA  12   1.711  -4.181  -8.979
  101    HB2  ALA  12           1HB      ALA  12   1.678  -2.936 -10.228
  102    HB3  ALA  12           2HB      ALA  12   0.178  -3.454  -9.458
  103    H    GLN  13           H        GLN  13  -1.074  -1.616  -8.332
  104    HA   GLN  13           HA       GLN  13  -1.099   0.642  -9.992
  105    HB2  GLN  13           2HB      GLN  13  -3.038  -0.112  -7.788
  106    HB3  GLN  13           3HB      GLN  13  -3.344   1.100  -9.026
  107    HG2  GLN  13           2HG      GLN  13  -3.241  -0.599 -10.758
  108    HG3  GLN  13           3HG      GLN  13  -2.840  -1.824  -9.557
  109   HE21  GLN  13          1HE2      GLN  13  -5.196   0.718  -9.037
  110   HE22  GLN  13          2HE2      GLN  13  -6.575  -0.319  -9.000
  111    H    ALA  14           H        ALA  14  -1.142   0.484  -6.419
  112    HA   ALA  14           HA       ALA  14  -1.165   3.218  -5.884
  113    HB1  ALA  14           3HB      ALA  14  -1.546   1.506  -4.178
  114    HB2  ALA  14           1HB      ALA  14  -0.299   2.646  -3.671
  115    HB3  ALA  14           2HB      ALA  14   0.155   1.042  -4.251
  116    H    LEU  15           H        LEU  15   1.651   1.067  -6.279
  117    HA   LEU  15           HA       LEU  15   3.676   2.916  -5.766
  118    HB2  LEU  15           2HB      LEU  15   3.653   0.510  -7.591
  119    HB3  LEU  15           3HB      LEU  15   5.105   1.418  -7.211
  120    HG   LEU  15           HG       LEU  15   3.395  -0.036  -5.180
  121   HD11  LEU  15          1HD1      LEU  15   4.555  -1.583  -6.686
  122   HD12  LEU  15          2HD1      LEU  15   5.224  -1.639  -5.056
  123   HD13  LEU  15          3HD1      LEU  15   6.085  -0.780  -6.333
  124   HD21  LEU  15          3HD2      LEU  15   4.524   1.904  -4.227
  125   HD22  LEU  15          1HD2      LEU  15   6.064   1.356  -4.898
  126   HD23  LEU  15          2HD2      LEU  15   5.258   0.410  -3.646
  127    H    GLN  16           H        GLN  16   1.860   2.355  -8.736
  128    HA   GLN  16           HA       GLN  16   3.539   4.249 -10.210
  129    HB2  GLN  16           2HB      GLN  16   1.207   2.554 -11.133
  130    HB3  GLN  16           3HB      GLN  16   2.203   3.563 -12.173
  131    HG2  GLN  16           2HG      GLN  16   3.182   1.202 -10.571
  132    HG3  GLN  16           3HG      GLN  16   2.839   1.202 -12.300
  133   HE21  GLN  16          1HE2      GLN  16   5.018   2.304  -9.816
  134   HE22  GLN  16          2HE2      GLN  16   6.300   2.768 -10.875
  135    H    THR  17           H        THR  17   0.832   4.449  -8.246
  136    HA   THR  17           HA       THR  17  -0.537   6.563  -9.669
  137    HB   THR  17           HB       THR  17  -0.825   5.700  -6.771
  138    HG1  THR  17           HG1      THR  17  -1.453   4.287  -8.732
  139   HG21  THR  17          3HG2      THR  17  -1.615   7.989  -7.064
  140   HG22  THR  17          1HG2      THR  17  -2.992   6.902  -6.870
  141   HG23  THR  17          2HG2      THR  17  -2.562   7.505  -8.471
  142    H    HIS  18           H        HIS  18   1.437   6.439  -6.689
  143    HA   HIS  18           HA       HIS  18   2.474   9.119  -7.309
  144    HB2  HIS  18           2HB      HIS  18   0.885   8.370  -4.917
  145    HB3  HIS  18           3HB      HIS  18   2.341   9.299  -4.589
  146    HD1  HIS  18           HD1      HIS  18  -0.075   9.802  -7.498
  147    HD2  HIS  18           HD2      HIS  18   1.310  11.758  -4.104
  148    HE1  HIS  18           HE1      HIS  18  -1.036  12.110  -7.614
  149    HE2  HIS  18           HE2      HIS  18  -0.099  13.308  -5.613
  150    HA   PRO  19           HA       PRO  19   6.368   7.092  -6.551
  151    HB2  PRO  19           2HB      PRO  19   7.859   9.339  -5.935
  152    HB3  PRO  19           3HB      PRO  19   7.475   8.808  -7.574
  153    HG2  PRO  19           2HG      PRO  19   6.127  10.893  -5.897
  154    HG3  PRO  19           3HG      PRO  19   6.544  10.939  -7.621
  155    HD2  PRO  19           2HD      PRO  19   4.036  10.440  -6.816
  156    HD3  PRO  19           3HD      PRO  19   4.731   9.603  -8.223
  157    H    GLY  20           H        GLY  20   5.160   9.442  -4.162
  158    HA2  GLY  20           2HA      GLY  20   6.935   8.771  -2.061
  159    HA3  GLY  20           3HA      GLY  20   5.381   9.563  -1.874
  160    H    VAL  21           H        VAL  21   4.208   7.059  -3.280
  161    HA   VAL  21           HA       VAL  21   3.218   5.802  -0.987
  162    HB   VAL  21           HB       VAL  21   3.332   4.745  -3.825
  163   HG11  VAL  21          1HG1      VAL  21   2.956   2.903  -2.273
  164   HG12  VAL  21          2HG1      VAL  21   1.484   3.258  -3.177
  165   HG13  VAL  21          3HG1      VAL  21   1.641   3.795  -1.504
  166   HG21  VAL  21          3HG2      VAL  21   1.019   5.555  -3.967
  167   HG22  VAL  21          1HG2      VAL  21   2.147   6.866  -3.626
  168   HG23  VAL  21          2HG2      VAL  21   1.146   6.205  -2.333
  169    H    ALA  22           H        ALA  22   5.904   4.856  -3.111
  170    HA   ALA  22           HA       ALA  22   6.442   2.313  -2.183
  171    HB1  ALA  22           3HB      ALA  22   8.735   2.661  -2.952
  172    HB2  ALA  22           1HB      ALA  22   8.467   4.405  -2.995
  173    HB3  ALA  22           2HB      ALA  22   7.577   3.349  -4.090
  174    H    GLY  23           H        GLY  23   7.941   5.325  -0.951
  175    HA2  GLY  23           2HA      GLY  23   9.356   4.182   1.181
  176    HA3  GLY  23           3HA      GLY  23   8.841   5.860   1.095
  177    H    VAL  24           H        VAL  24   6.032   5.433   1.086
  178    HA   VAL  24           HA       VAL  24   5.474   5.218   3.843
  179    HB   VAL  24           HB       VAL  24   3.559   4.979   1.506
  180   HG11  VAL  24          1HG1      VAL  24   2.581   4.070   3.551
  181   HG12  VAL  24          2HG1      VAL  24   1.811   5.596   3.114
  182   HG13  VAL  24          3HG1      VAL  24   2.994   5.548   4.421
  183   HG21  VAL  24          3HG2      VAL  24   4.792   7.092   1.505
  184   HG22  VAL  24          1HG2      VAL  24   4.329   7.378   3.184
  185   HG23  VAL  24          2HG2      VAL  24   3.099   7.359   1.920
  186    H    LEU  25           H        LEU  25   4.900   2.904   1.181
  187    HA   LEU  25           HA       LEU  25   3.781   0.841   2.699
  188    HB2  LEU  25           2HB      LEU  25   5.528   0.636   0.240
  189    HB3  LEU  25           3HB      LEU  25   4.572  -0.679   0.900
  190    HG   LEU  25           HG       LEU  25   3.507   1.892  -0.293
  191   HD11  LEU  25          1HD1      LEU  25   2.560   0.409  -2.004
  192   HD12  LEU  25          2HD1      LEU  25   3.354  -0.970  -1.243
  193   HD13  LEU  25          3HD1      LEU  25   4.321   0.318  -1.958
  194   HD21  LEU  25          3HD2      LEU  25   1.996  -0.437   0.908
  195   HD22  LEU  25          1HD2      LEU  25   1.275   0.923   0.043
  196   HD23  LEU  25          2HD2      LEU  25   2.101   1.192   1.577
  197    H    ARG  26           H        ARG  26   7.206   1.453   1.903
  198    HA   ARG  26           HA       ARG  26   8.283  -0.731   3.325
  199    HB2  ARG  26           2HB      ARG  26   9.578   1.959   2.822
  200    HB3  ARG  26           3HB      ARG  26  10.412   0.462   3.220
  201    HG2  ARG  26           2HG      ARG  26   9.565  -0.517   1.098
  202    HG3  ARG  26           3HG      ARG  26   8.867   1.054   0.700
  203    HD2  ARG  26           2HD      ARG  26  10.949   0.924  -0.436
  204    HD3  ARG  26           3HD      ARG  26  11.182   2.026   0.922
  205    HE   ARG  26           HE       ARG  26  11.937  -0.790   1.227
  206   HH11  ARG  26          1HH1      ARG  26  12.892   2.505   0.953
  207   HH12  ARG  26          2HH1      ARG  26  14.507   2.189   1.469
  208   HH21  ARG  26          1HH2      ARG  26  13.991  -1.192   1.847
  209   HH22  ARG  26          2HH2      ARG  26  15.136   0.100   1.954
  210    H    SER  27           H        SER  27   7.315   2.491   4.381
  211    HA   SER  27           HA       SER  27   8.381   2.440   6.990
  212    HB2  SER  27           2HB      SER  27   7.487   4.504   6.073
  213    HB3  SER  27           3HB      SER  27   5.876   3.799   5.950
  214    HG   SER  27           HG       SER  27   5.736   4.826   7.823
  215    H    TYR  28           H        TYR  28   5.478   0.981   5.649
  216    HA   TYR  28           HA       TYR  28   4.693  -0.064   8.278
  217    HB2  TYR  28           2HB      TYR  28   3.349  -0.154   5.572
  218    HB3  TYR  28           3HB      TYR  28   2.731  -1.010   6.980
  219    HD1  TYR  28           HD1      TYR  28   2.175   0.388   9.067
  220    HD2  TYR  28           HD2      TYR  28   2.751   2.106   5.205
  221    HE1  TYR  28           HE1      TYR  28   0.934   2.390   9.775
  222    HE2  TYR  28           HE2      TYR  28   1.518   4.113   5.913
  223    HH   TYR  28           HH       TYR  28  -0.313   4.608   7.718
  224    H    ASN  29           H        ASN  29   7.069  -0.948   6.462
  225    HA   ASN  29           HA       ASN  29   8.232  -2.857   6.066
  226    HB2  ASN  29           2HB      ASN  29   7.610  -3.273   8.463
  227    HB3  ASN  29           3HB      ASN  29   6.225  -4.200   7.899
  228   HD21  ASN  29          1HD2      ASN  29   6.956  -6.092   8.861
  229   HD22  ASN  29          2HD2      ASN  29   8.318  -6.971   8.258
  230    H    LEU  30           H        LEU  30   6.122  -2.139   4.264
  231    HA   LEU  30           HA       LEU  30   5.179  -4.737   3.246
  232    HB2  LEU  30           2HB      LEU  30   4.431  -1.912   2.466
  233    HB3  LEU  30           3HB      LEU  30   3.774  -3.358   1.720
  234    HG   LEU  30           HG       LEU  30   3.447  -2.667   4.646
  235   HD11  LEU  30          1HD1      LEU  30   1.153  -2.056   4.093
  236   HD12  LEU  30          2HD1      LEU  30   1.479  -2.327   2.381
  237   HD13  LEU  30          3HD1      LEU  30   2.301  -1.025   3.242
  238   HD21  LEU  30          3HD2      LEU  30   1.755  -4.415   4.635
  239   HD22  LEU  30          1HD2      LEU  30   3.315  -5.063   4.137
  240   HD23  LEU  30          2HD2      LEU  30   2.072  -4.736   2.930
  241    H    GLY  31           H        GLY  31   7.970  -3.291   2.988
  242    HA2  GLY  31           2HA      GLY  31   8.331  -2.609   0.263
  243    HA3  GLY  31           3HA      GLY  31   9.609  -3.006   1.398
  244    H    CYS  32           H        CYS  32   8.226  -5.703   1.828
  245    HA   CYS  32           HA       CYS  32   9.821  -7.114  -0.095
  246    HB2  CYS  32           2HB      CYS  32   9.533  -7.894   2.239
  247    HB3  CYS  32           3HB      CYS  32   7.837  -8.225   1.904
  248    HG   CYS  32           HG       CYS  32   8.757 -10.712   1.790
  249    H    ILE  33           H        ILE  33   6.857  -5.732  -0.509
  250    HA   ILE  33           HA       ILE  33   5.205  -7.647  -1.640
  251    HB   ILE  33           HB       ILE  33   4.288  -5.802  -3.092
  252   HG12  ILE  33          2HG1      ILE  33   6.404  -4.168  -1.657
  253   HG13  ILE  33          3HG1      ILE  33   6.358  -4.512  -3.382
  254   HG21  ILE  33          1HG2      ILE  33   4.581  -5.243  -0.141
  255   HG22  ILE  33          2HG2      ILE  33   3.381  -6.293  -0.892
  256   HG23  ILE  33          3HG2      ILE  33   3.348  -4.557  -1.199
  257   HD11  ILE  33          3HD1      ILE  33   5.597  -2.271  -2.962
  258   HD12  ILE  33          1HD1      ILE  33   4.376  -2.856  -1.832
  259   HD13  ILE  33          2HD1      ILE  33   4.252  -3.249  -3.548
  260    H    GLY  34           H        GLY  34   8.090  -6.228  -3.031
  261    HA2  GLY  34           2HA      GLY  34   7.687  -7.134  -5.705
  262    HA3  GLY  34           3HA      GLY  34   9.227  -6.691  -4.980
  263    H    CYS  35           H        CYS  35   9.566  -8.498  -2.988
  264    HA   CYS  35           HA       CYS  35  10.413 -10.813  -4.404
  265    HB2  CYS  35           2HB      CYS  35  11.625  -9.976  -2.445
  266    HB3  CYS  35           3HB      CYS  35  10.247 -10.352  -1.416
  267    HG   CYS  35           HG       CYS  35  11.521 -12.920  -3.200
  268    H    MET  36           H        MET  36   7.747 -10.287  -2.097
  269    HA   MET  36           HA       MET  36   6.845 -13.018  -2.297
  270    HB2  MET  36           2HB      MET  36   4.990 -12.351  -0.875
  271    HB3  MET  36           3HB      MET  36   6.502 -11.735  -0.227
  272    HG2  MET  36           2HG      MET  36   5.995  -9.524  -1.128
  273    HG3  MET  36           3HG      MET  36   4.488 -10.140  -1.801
  274    HE1  MET  36           3HE      MET  36   3.525 -12.113   0.572
  275    HE2  MET  36           1HE      MET  36   2.460 -11.022  -0.319
  276    HE3  MET  36           2HE      MET  36   2.458 -11.018   1.445
  277    H    GLY  37           H        GLY  37   6.697 -10.599  -4.491
  278    HA2  GLY  37           2HA      GLY  37   5.517 -10.308  -6.434
  279    HA3  GLY  37           3HA      GLY  37   4.916 -11.939  -6.199
  280    H    ALA  38           H        ALA  38   4.296  -9.362  -3.899
  281    HA   ALA  38           HA       ALA  38   1.454  -9.820  -4.110
  282    HB1  ALA  38           3HB      ALA  38   2.505  -9.474  -1.935
  283    HB2  ALA  38           1HB      ALA  38   1.267  -8.256  -2.239
  284    HB3  ALA  38           2HB      ALA  38   2.974  -7.842  -2.410
  285    H    GLN  39           H        GLN  39   3.076  -8.359  -6.306
  286    HA   GLN  39           HA       GLN  39   2.157  -5.687  -6.439
  287    HB2  GLN  39           2HB      GLN  39   2.989  -7.528  -8.695
  288    HB3  GLN  39           3HB      GLN  39   2.828  -5.780  -8.810
  289    HG2  GLN  39           2HG      GLN  39   4.791  -7.259  -7.059
  290    HG3  GLN  39           3HG      GLN  39   5.160  -6.460  -8.586
  291   HE21  GLN  39          1HE2      GLN  39   4.388  -5.995  -5.229
  292   HE22  GLN  39          2HE2      GLN  39   4.790  -4.318  -5.168
  293    H    ASN  40           H        ASN  40   0.676  -8.718  -7.301
  294    HA   ASN  40           HA       ASN  40  -1.496  -7.441  -8.786
  295    HB2  ASN  40           2HB      ASN  40  -0.969 -10.353  -8.132
  296    HB3  ASN  40           3HB      ASN  40  -2.277  -9.769  -9.158
  297   HD21  ASN  40          1HD2      ASN  40   0.056 -11.525  -9.711
  298   HD22  ASN  40          2HD2      ASN  40   0.837 -10.798 -11.070
  299    H    GLU  41           H        GLU  41  -0.810  -8.046  -5.585
  300    HA   GLU  41           HA       GLU  41  -3.524  -8.786  -4.798
  301    HB2  GLU  41           2HB      GLU  41  -1.693 -10.010  -3.777
  302    HB3  GLU  41           3HB      GLU  41  -0.959  -8.516  -3.216
  303    HG2  GLU  41           2HG      GLU  41  -2.564  -8.196  -1.564
  304    HG3  GLU  41           3HG      GLU  41  -3.711  -9.299  -2.325
  305    H    SER  42           H        SER  42  -4.778  -7.559  -3.315
  306    HA   SER  42           HA       SER  42  -4.592  -4.719  -3.752
  307    HB2  SER  42           2HB      SER  42  -6.712  -4.567  -2.593
  308    HB3  SER  42           3HB      SER  42  -6.766  -5.941  -3.697
  309    HG   SER  42           HG       SER  42  -7.602  -6.514  -1.674
  310    H    LEU  43           H        LEU  43  -4.555  -3.087  -2.107
  311    HA   LEU  43           HA       LEU  43  -2.517  -3.294  -0.239
  312    HB2  LEU  43           2HB      LEU  43  -4.888  -1.415  -0.182
  313    HB3  LEU  43           3HB      LEU  43  -3.412  -1.202   0.741
  314    HG   LEU  43           HG       LEU  43  -3.642  -1.137  -2.277
  315   HD11  LEU  43          1HD1      LEU  43  -3.113   1.063  -0.281
  316   HD12  LEU  43          2HD1      LEU  43  -4.578   0.847  -1.240
  317   HD13  LEU  43          3HD1      LEU  43  -3.052   1.233  -2.036
  318   HD21  LEU  43          3HD2      LEU  43  -1.285  -0.458  -2.255
  319   HD22  LEU  43          1HD2      LEU  43  -1.497  -2.079  -1.594
  320   HD23  LEU  43          2HD2      LEU  43  -1.226  -0.712  -0.511
  321    H    GLU  44           H        GLU  44  -6.000  -3.762   0.253
  322    HA   GLU  44           HA       GLU  44  -5.914  -4.027   3.065
  323    HB2  GLU  44           2HB      GLU  44  -7.997  -3.574   1.926
  324    HB3  GLU  44           3HB      GLU  44  -7.895  -5.092   1.048
  325    HG2  GLU  44           2HG      GLU  44  -8.177  -6.337   3.121
  326    HG3  GLU  44           3HG      GLU  44  -8.210  -4.830   4.036
  327    H    GLN  45           H        GLN  45  -5.934  -6.534   0.505
  328    HA   GLN  45           HA       GLN  45  -5.841  -8.746   2.240
  329    HB2  GLN  45           2HB      GLN  45  -4.815  -8.468  -0.594
  330    HB3  GLN  45           3HB      GLN  45  -4.968  -9.998   0.261
  331    HG2  GLN  45           2HG      GLN  45  -7.376  -9.686   0.428
  332    HG3  GLN  45           3HG      GLN  45  -7.242  -8.123  -0.375
  333   HE21  GLN  45          1HE2      GLN  45  -8.586  -8.760  -2.057
  334   HE22  GLN  45          2HE2      GLN  45  -8.073  -9.871  -3.276
  335    H    GLY  46           H        GLY  46  -3.194  -6.967   0.643
  336    HA2  GLY  46           2HA      GLY  46  -1.050  -8.423   1.743
  337    HA3  GLY  46           3HA      GLY  46  -0.971  -6.757   1.189
  338    H    ALA  47           H        ALA  47  -2.877  -5.661   3.027
  339    HA   ALA  47           HA       ALA  47  -1.309  -5.140   5.293
  340    HB1  ALA  47           3HB      ALA  47  -3.097  -3.646   4.535
  341    HB2  ALA  47           1HB      ALA  47  -3.291  -4.072   6.236
  342    HB3  ALA  47           2HB      ALA  47  -4.303  -4.843   5.013
  343    H    ASN  48           H        ASN  48  -4.247  -7.181   5.047
  344    HA   ASN  48           HA       ASN  48  -4.193  -8.250   7.627
  345    HB2  ASN  48           2HB      ASN  48  -5.188  -9.449   5.035
  346    HB3  ASN  48           3HB      ASN  48  -5.407 -10.237   6.594
  347   HD21  ASN  48          1HD2      ASN  48  -6.410  -7.658   4.535
  348   HD22  ASN  48          2HD2      ASN  48  -7.770  -7.168   5.481
  349    H    ALA  49           H        ALA  49  -2.534  -9.392   4.694
  350    HA   ALA  49           HA       ALA  49  -1.418 -11.742   5.763
  351    HB1  ALA  49           3HB      ALA  49   0.135 -11.653   3.887
  352    HB2  ALA  49           1HB      ALA  49  -0.285  -9.963   3.599
  353    HB3  ALA  49           2HB      ALA  49  -1.493 -11.226   3.362
  354    H    HIS  50           H        HIS  50  -0.171  -8.410   5.721
  355    HA   HIS  50           HA       HIS  50   2.251  -9.230   7.134
  356    HB2  HIS  50           2HB      HIS  50   1.348  -6.589   5.979
  357    HB3  HIS  50           3HB      HIS  50   2.818  -6.757   6.931
  358    HD1  HIS  50           HD1      HIS  50   4.831  -7.032   5.540
  359    HD2  HIS  50           HD2      HIS  50   1.464  -8.590   3.667
  360    HE1  HIS  50           HE1      HIS  50   5.619  -7.830   3.302
  361    HE2  HIS  50           HE2      HIS  50   3.624  -8.986   2.302
  362    H    GLY  51           H        GLY  51  -0.742  -8.801   8.220
  363    HA2  GLY  51           2HA      GLY  51  -1.641  -8.368  10.292
  364    HA3  GLY  51           3HA      GLY  51   0.000  -8.387  10.910
  365    H    LEU  52           H        LEU  52  -1.772  -6.189   8.718
  366    HA   LEU  52           HA       LEU  52  -1.081  -3.941  10.510
  367    HB2  LEU  52           2HB      LEU  52  -1.064  -3.944   7.487
  368    HB3  LEU  52           3HB      LEU  52  -0.767  -2.543   8.499
  369    HG   LEU  52           HG       LEU  52   0.981  -5.011   8.416
  370   HD11  LEU  52          1HD1      LEU  52   2.572  -3.607   7.208
  371   HD12  LEU  52          2HD1      LEU  52   1.399  -2.289   7.180
  372   HD13  LEU  52          3HD1      LEU  52   1.066  -3.788   6.310
  373   HD21  LEU  52          3HD2      LEU  52   1.381  -2.334   9.763
  374   HD22  LEU  52          1HD2      LEU  52   2.567  -3.639   9.687
  375   HD23  LEU  52          2HD2      LEU  52   1.059  -3.870  10.571
  376    H    ASN  53           H        ASN  53  -2.406  -1.938   9.968
  377    HA   ASN  53           HA       ASN  53  -5.214  -2.679   9.483
  378    HB2  ASN  53           2HB      ASN  53  -4.662  -1.453  11.592
  379    HB3  ASN  53           3HB      ASN  53  -4.098  -0.097  10.623
  380   HD21  ASN  53          1HD2      ASN  53  -6.176  -0.006  12.544
  381   HD22  ASN  53          2HD2      ASN  53  -7.635   0.399  11.722
  382    H    VAL  54           H        VAL  54  -5.804  -2.469   7.399
  383    HA   VAL  54           HA       VAL  54  -4.446  -1.006   5.450
  384    HB   VAL  54           HB       VAL  54  -5.994  -2.821   4.895
  385   HG11  VAL  54          1HG1      VAL  54  -7.758  -2.348   6.518
  386   HG12  VAL  54          2HG1      VAL  54  -8.410  -2.487   4.886
  387   HG13  VAL  54          3HG1      VAL  54  -8.207  -0.895   5.620
  388   HG21  VAL  54          3HG2      VAL  54  -5.377  -1.190   3.169
  389   HG22  VAL  54          1HG2      VAL  54  -6.779  -0.206   3.593
  390   HG23  VAL  54          2HG2      VAL  54  -7.005  -1.820   2.915
  391    H    GLU  55           H        GLU  55  -7.103  -0.007   7.553
  392    HA   GLU  55           HA       GLU  55  -7.776   2.397   6.228
  393    HB2  GLU  55           2HB      GLU  55  -8.061   1.598   9.133
  394    HB3  GLU  55           3HB      GLU  55  -8.781   3.041   8.438
  395    HG2  GLU  55           2HG      GLU  55 -10.084   1.644   6.898
  396    HG3  GLU  55           3HG      GLU  55  -9.369   0.200   7.612
  397    H    ASP  56           H        ASP  56  -5.358   1.660   8.698
  398    HA   ASP  56           HA       ASP  56  -4.608   4.395   9.128
  399    HB2  ASP  56           2HB      ASP  56  -4.298   2.356  10.708
  400    HB3  ASP  56           3HB      ASP  56  -2.845   2.035   9.765
  401    H    ILE  57           H        ILE  57  -3.338   1.719   7.173
  402    HA   ILE  57           HA       ILE  57  -1.071   3.018   6.127
  403    HB   ILE  57           HB       ILE  57  -2.831   0.963   4.762
  404   HG12  ILE  57          2HG1      ILE  57  -0.323   0.575   6.432
  405   HG13  ILE  57          3HG1      ILE  57  -1.962   0.211   6.960
  406   HG21  ILE  57          1HG2      ILE  57  -1.383   2.102   3.170
  407   HG22  ILE  57          2HG2      ILE  57  -0.831   0.447   3.418
  408   HG23  ILE  57          3HG2      ILE  57   0.023   1.785   4.187
  409   HD11  ILE  57          3HD1      ILE  57  -2.150  -1.493   5.232
  410   HD12  ILE  57          1HD1      ILE  57  -0.772  -1.796   6.289
  411   HD13  ILE  57          2HD1      ILE  57  -0.516  -1.121   4.681
  412    H    LEU  58           H        LEU  58  -4.386   2.774   4.801
  413    HA   LEU  58           HA       LEU  58  -4.040   4.423   2.569
  414    HB2  LEU  58           2HB      LEU  58  -6.514   4.021   4.259
  415    HB3  LEU  58           3HB      LEU  58  -6.498   4.773   2.673
  416    HG   LEU  58           HG       LEU  58  -5.793   1.898   3.293
  417   HD11  LEU  58          1HD1      LEU  58  -8.138   3.079   1.805
  418   HD12  LEU  58          2HD1      LEU  58  -8.186   2.378   3.423
  419   HD13  LEU  58          3HD1      LEU  58  -7.807   1.361   2.035
  420   HD21  LEU  58          3HD2      LEU  58  -5.647   1.624   0.846
  421   HD22  LEU  58          1HD2      LEU  58  -4.404   2.702   1.479
  422   HD23  LEU  58          2HD2      LEU  58  -5.813   3.369   0.655
  423    H    ARG  59           H        ARG  59  -4.697   5.254   5.934
  424    HA   ARG  59           HA       ARG  59  -5.302   7.960   5.699
  425    HB2  ARG  59           2HB      ARG  59  -5.438   6.808   7.831
  426    HB3  ARG  59           3HB      ARG  59  -3.704   6.520   7.831
  427    HG2  ARG  59           2HG      ARG  59  -3.317   8.948   7.991
  428    HG3  ARG  59           3HG      ARG  59  -5.062   9.206   8.049
  429    HD2  ARG  59           2HD      ARG  59  -4.116   9.275  10.287
  430    HD3  ARG  59           3HD      ARG  59  -5.181   7.880  10.114
  431    HE   ARG  59           HE       ARG  59  -2.905   6.690   9.646
  432   HH11  ARG  59          1HH1      ARG  59  -3.488   9.170  11.969
  433   HH12  ARG  59          2HH1      ARG  59  -2.256   8.600  13.037
  434   HH21  ARG  59          1HH2      ARG  59  -1.343   5.965  11.034
  435   HH22  ARG  59          2HH2      ARG  59  -1.054   6.818  12.514
  436    H    ASP  60           H        ASP  60  -2.086   6.441   5.987
  437    HA   ASP  60           HA       ASP  60  -0.639   8.883   5.792
  438    HB2  ASP  60           2HB      ASP  60   0.079   6.533   6.705
  439    HB3  ASP  60           3HB      ASP  60   0.546   6.225   5.036
  440    H    LEU  61           H        LEU  61  -1.566   6.409   3.432
  441    HA   LEU  61           HA       LEU  61  -0.111   7.372   1.223
  442    HB2  LEU  61           2HB      LEU  61  -2.683   5.796   1.343
  443    HB3  LEU  61           3HB      LEU  61  -1.786   6.086  -0.136
  444    HG   LEU  61           HG       LEU  61  -0.754   4.561   2.266
  445   HD11  LEU  61          1HD1      LEU  61  -2.488   3.322   1.103
  446   HD12  LEU  61          2HD1      LEU  61  -0.909   2.592   0.814
  447   HD13  LEU  61          3HD1      LEU  61  -1.667   3.578  -0.438
  448   HD21  LEU  61          3HD2      LEU  61   1.134   3.975   0.824
  449   HD22  LEU  61          1HD2      LEU  61   1.034   5.719   1.071
  450   HD23  LEU  61          2HD2      LEU  61   0.490   5.011  -0.450
  451    H    ASN  62           H        ASN  62  -3.562   7.950   2.058
  452    HA   ASN  62           HA       ASN  62  -3.984   9.779  -0.076
  453    HB2  ASN  62           2HB      ASN  62  -5.532   9.280   2.472
  454    HB3  ASN  62           3HB      ASN  62  -6.036  10.468   1.274
  455   HD21  ASN  62          1HD2      ASN  62  -5.807   7.112   2.031
  456   HD22  ASN  62          2HD2      ASN  62  -6.671   6.532   0.655
  457    H    ALA  63           H        ALA  63  -2.680  10.161   3.139
  458    HA   ALA  63           HA       ALA  63  -2.868  12.945   3.429
  459    HB1  ALA  63           3HB      ALA  63  -2.133  11.436   5.226
  460    HB2  ALA  63           1HB      ALA  63  -0.993  12.757   4.973
  461    HB3  ALA  63           2HB      ALA  63  -0.626  11.147   4.358
  462    H    LEU  64           H        LEU  64  -0.800  11.005   1.382
  463    HA   LEU  64           HA       LEU  64   1.151  12.963   0.750
  464    HB2  LEU  64           2HB      LEU  64   0.134  10.696  -0.975
  465    HB3  LEU  64           3HB      LEU  64   1.627  11.582  -1.222
  466    HG   LEU  64           HG       LEU  64   1.024   9.813   1.159
  467   HD11  LEU  64          1HD1      LEU  64   2.693   8.301   0.180
  468   HD12  LEU  64          2HD1      LEU  64   2.799   9.343  -1.240
  469   HD13  LEU  64          3HD1      LEU  64   1.291   8.504  -0.870
  470   HD21  LEU  64          3HD2      LEU  64   3.553  11.257   0.356
  471   HD22  LEU  64          1HD2      LEU  64   3.407  10.103   1.684
  472   HD23  LEU  64          2HD2      LEU  64   2.529  11.630   1.743
  473    H    ALA  65           H        ALA  65  -2.115  12.484  -0.334
  474    HA   ALA  65           HA       ALA  65  -1.826  14.358  -2.566
  475    HB1  ALA  65           3HB      ALA  65  -4.114  13.718  -3.146
  476    HB2  ALA  65           1HB      ALA  65  -4.229  12.758  -1.672
  477    HB3  ALA  65           2HB      ALA  65  -3.092  12.295  -2.939
  478    H    LEU  66           H        LEU  66  -3.428  14.108   0.576
  479    HA   LEU  66           HA       LEU  66  -4.814  16.627   0.300
  480    HB2  LEU  66           2HB      LEU  66  -4.374  14.919   2.758
  481    HB3  LEU  66           3HB      LEU  66  -5.504  16.255   2.626
  482    HG   LEU  66           HG       LEU  66  -5.664  13.637   1.112
  483   HD11  LEU  66          1HD1      LEU  66  -7.383  14.752   3.332
  484   HD12  LEU  66          2HD1      LEU  66  -6.243  13.413   3.469
  485   HD13  LEU  66          3HD1      LEU  66  -7.674  13.251   2.452
  486   HD21  LEU  66          3HD2      LEU  66  -7.822  14.461   0.295
  487   HD22  LEU  66          1HD2      LEU  66  -6.494  15.485  -0.248
  488   HD23  LEU  66          2HD2      LEU  66  -7.532  16.014   1.077
  489    H    GLU  67           H        GLU  67  -2.104  15.467   2.296
  490    HA   GLU  67           HA       GLU  67  -0.370  16.495   3.326
  491    HB2  GLU  67           2HB      GLU  67  -0.755  18.520   1.113
  492    HB3  GLU  67           3HB      GLU  67   0.690  18.348   2.102
  493    HG2  GLU  67           2HG      GLU  67   1.033  16.091   1.220
  494    HG3  GLU  67           3HG      GLU  67  -0.422  16.253   0.239
  495    H    HIS  68           H        HIS  68  -3.251  17.469   3.959
  496    HA   HIS  68           HA       HIS  68  -3.153  20.136   4.793
  497    HB2  HIS  68           2HB      HIS  68  -5.049  19.639   6.209
  498    HB3  HIS  68           3HB      HIS  68  -5.227  18.764   4.694
  499    HD1  HIS  68           HD1      HIS  68  -5.334  18.302   8.275
  500    HD2  HIS  68           HD2      HIS  68  -4.497  15.906   4.980
  501    HE1  HIS  68           HE1      HIS  68  -5.537  15.936   9.093
  502    HE2  HIS  68           HE2      HIS  68  -5.042  14.503   7.086
  503    H    HIS  69           H        HIS  69  -2.415  21.160   6.615
  504    HA   HIS  69           HA       HIS  69  -0.151  19.971   7.840
  505    HB2  HIS  69           2HB      HIS  69  -1.581  22.571   8.428
  506    HB3  HIS  69           3HB      HIS  69  -0.037  22.106   9.140
  507    HD1  HIS  69           HD1      HIS  69   2.045  22.440   7.728
  508    HD2  HIS  69           HD2      HIS  69  -1.468  23.064   5.596
  509    HE1  HIS  69           HE1      HIS  69   2.756  23.405   5.523
  510    HE2  HIS  69           HE2      HIS  69   0.633  23.595   4.191
  511    H    HIS  70           H        HIS  70   0.257  19.861  10.188
  512    HA   HIS  70           HA       HIS  70  -1.788  18.165  11.313
  513    HB2  HIS  70           2HB      HIS  70   1.020  18.819  12.212
  514    HB3  HIS  70           3HB      HIS  70  -0.042  17.699  13.062
  515    HD1  HIS  70           HD1      HIS  70   2.042  18.018   9.956
  516    HD2  HIS  70           HD2      HIS  70  -0.423  15.224  11.805
  517    HE1  HIS  70           HE1      HIS  70   2.437  15.860   8.742
  518    HE2  HIS  70           HE2      HIS  70   0.872  14.208   9.812
  519    H    HIS  71           H        HIS  71  -3.456  19.310  12.148
  520    HA   HIS  71           HA       HIS  71  -2.868  20.666  14.696
  521    HB2  HIS  71           2HB      HIS  71  -4.601  21.644  12.467
  522    HB3  HIS  71           3HB      HIS  71  -5.182  21.894  14.109
  523    HD1  HIS  71           HD1      HIS  71  -3.102  23.440  11.600
  524    HD2  HIS  71           HD2      HIS  71  -3.160  23.323  15.752
  525    HE1  HIS  71           HE1      HIS  71  -1.718  25.391  12.350
  526    HE2  HIS  71           HE2      HIS  71  -1.852  25.364  14.859
  527    H    HIS  72           H        HIS  72  -3.981  19.882  16.400
  528    HA   HIS  72           HA       HIS  72  -5.932  17.722  15.837
  529    HB2  HIS  72           2HB      HIS  72  -5.033  16.550  17.797
  530    HB3  HIS  72           3HB      HIS  72  -3.758  16.873  16.625
  531    HD1  HIS  72           HD1      HIS  72  -4.889  17.743  20.073
  532    HD2  HIS  72           HD2      HIS  72  -1.815  18.746  17.463
  533    HE1  HIS  72           HE1      HIS  72  -3.215  19.001  21.456
  534    HE2  HIS  72           HE2      HIS  72  -1.452  19.734  19.819
  535    H    HIS  73           H        HIS  73  -7.293  17.152  17.793
  536    HA   HIS  73           HA       HIS  73  -8.058  19.573  19.314
  537    HB2  HIS  73           2HB      HIS  73  -9.712  17.114  18.673
  538    HB3  HIS  73           3HB      HIS  73 -10.261  18.477  19.643
  539    HD1  HIS  73           HD1      HIS  73 -10.448  20.813  18.327
  540    HD2  HIS  73           HD2      HIS  73 -10.042  17.412  15.974
  541    HE1  HIS  73           HE1      HIS  73 -11.183  21.496  16.024
  542    HE2  HIS  73           HE2      HIS  73 -10.795  19.465  14.593
  Start of MODEL   20
    1    H1   MET   1           1H       MET   1 -18.045  11.331  -2.265
    2    H2   MET   1           2H       MET   1 -18.401  10.986  -3.877
    3    H3   MET   1           3H       MET   1 -18.439  12.585  -3.332
    4    HA   MET   1           HA       MET   1 -16.441  12.257  -4.582
    5    HB2  MET   1           2HB      MET   1 -15.883  12.310  -1.601
    6    HB3  MET   1           3HB      MET   1 -14.770  12.840  -2.856
    7    HG2  MET   1           2HG      MET   1 -16.330  14.609  -3.501
    8    HG3  MET   1           3HG      MET   1 -17.452  14.077  -2.250
    9    HE1  MET   1           3HE      MET   1 -15.418  14.846   1.024
   10    HE2  MET   1           1HE      MET   1 -15.436  13.327   0.130
   11    HE3  MET   1           2HE      MET   1 -16.934  14.229   0.366
   12    H    THR   2           H        THR   2 -14.006  11.302  -3.857
   13    HA   THR   2           HA       THR   2 -14.212   8.523  -3.008
   14    HB   THR   2           HB       THR   2 -14.647   8.219  -5.371
   15    HG1  THR   2           HG1      THR   2 -11.896   7.568  -5.064
   16   HG21  THR   2          3HG2      THR   2 -12.069   9.715  -5.876
   17   HG22  THR   2          1HG2      THR   2 -13.691  10.330  -6.200
   18   HG23  THR   2          2HG2      THR   2 -13.076   8.941  -7.098
   19    H    GLN   3           H        GLN   3 -12.272   7.623  -2.308
   20    HA   GLN   3           HA       GLN   3 -10.137   9.435  -1.664
   21    HB2  GLN   3           2HB      GLN   3 -10.229   6.416  -1.425
   22    HB3  GLN   3           3HB      GLN   3  -9.039   7.470  -0.676
   23    HG2  GLN   3           2HG      GLN   3 -10.850   8.514   0.645
   24    HG3  GLN   3           3HG      GLN   3 -11.988   7.366  -0.058
   25   HE21  GLN   3          1HE2      GLN   3 -11.798   5.166   0.486
   26   HE22  GLN   3          2HE2      GLN   3 -10.960   4.660   1.908
   27    H    LYS   4           H        LYS   4  -7.925   9.245  -2.375
   28    HA   LYS   4           HA       LYS   4  -7.609   8.479  -5.141
   29    HB2  LYS   4           2HB      LYS   4  -5.640   9.517  -3.088
   30    HB3  LYS   4           3HB      LYS   4  -5.211   9.170  -4.757
   31    HG2  LYS   4           2HG      LYS   4  -7.259  11.196  -3.852
   32    HG3  LYS   4           3HG      LYS   4  -5.624  11.554  -4.408
   33    HD2  LYS   4           2HD      LYS   4  -7.809  10.253  -6.048
   34    HD3  LYS   4           3HD      LYS   4  -7.275  11.928  -6.185
   35    HE2  LYS   4           2HE      LYS   4  -5.050  11.174  -6.870
   36    HE3  LYS   4           3HE      LYS   4  -5.555   9.494  -6.697
   37    HZ1  LYS   4           3HZ      LYS   4  -6.712  11.450  -8.604
   38    HZ2  LYS   4           1HZ      LYS   4  -7.175   9.832  -8.444
   39    HZ3  LYS   4           2HZ      LYS   4  -5.624  10.216  -8.995
   40    H    PHE   5           H        PHE   5  -6.906   7.123  -2.019
   41    HA   PHE   5           HA       PHE   5  -5.901   4.683  -3.334
   42    HB2  PHE   5           2HB      PHE   5  -4.957   5.855  -0.703
   43    HB3  PHE   5           3HB      PHE   5  -4.468   4.287  -1.342
   44    HD1  PHE   5           HD2      PHE   5  -4.156   7.924  -1.718
   45    HD2  PHE   5           HD1      PHE   5  -2.927   4.122  -3.200
   46    HE1  PHE   5           HE2      PHE   5  -2.350   9.004  -2.988
   47    HE2  PHE   5           HE1      PHE   5  -1.121   5.201  -4.474
   48    HZ   PHE   5           HZ       PHE   5  -0.836   7.643  -4.370
   49    H    THR   6           H        THR   6  -7.128   2.973  -2.987
   50    HA   THR   6           HA       THR   6  -8.843   2.862  -0.572
   51    HB   THR   6           HB       THR   6 -10.314   3.227  -2.436
   52    HG1  THR   6           HG1      THR   6 -11.506   1.751  -1.494
   53   HG21  THR   6          3HG2      THR   6 -10.351   1.766  -4.409
   54   HG22  THR   6          1HG2      THR   6  -8.950   0.888  -3.795
   55   HG23  THR   6          2HG2      THR   6  -8.798   2.584  -4.255
   56    H    LYS   7           H        LYS   7  -9.553   0.600  -0.021
   57    HA   LYS   7           HA       LYS   7  -7.336  -1.124   0.304
   58    HB2  LYS   7           2HB      LYS   7  -8.924  -2.729   1.212
   59    HB3  LYS   7           3HB      LYS   7  -9.290  -1.117   1.815
   60    HG2  LYS   7           2HG      LYS   7 -11.171  -0.905   0.374
   61    HG3  LYS   7           3HG      LYS   7 -10.716  -2.345  -0.540
   62    HD2  LYS   7           2HD      LYS   7 -12.566  -2.839   0.962
   63    HD3  LYS   7           3HD      LYS   7 -11.123  -3.730   1.448
   64    HE2  LYS   7           2HE      LYS   7 -10.681  -2.050   3.182
   65    HE3  LYS   7           3HE      LYS   7 -12.135  -1.175   2.700
   66    HZ1  LYS   7           3HZ      LYS   7 -12.571  -2.556   4.607
   67    HZ2  LYS   7           1HZ      LYS   7 -12.037  -3.936   3.787
   68    HZ3  LYS   7           2HZ      LYS   7 -13.440  -3.137   3.279
   69    H    ASP   8           H        ASP   8  -9.723  -0.854  -2.203
   70    HA   ASP   8           HA       ASP   8  -9.566  -3.509  -3.217
   71    HB2  ASP   8           2HB      ASP   8 -11.535  -2.120  -3.570
   72    HB3  ASP   8           3HB      ASP   8 -10.584  -0.951  -4.482
   73    H    MET   9           H        MET   9  -7.832  -0.532  -4.007
   74    HA   MET   9           HA       MET   9  -6.732  -1.522  -6.454
   75    HB2  MET   9           2HB      MET   9  -5.325   0.467  -6.432
   76    HB3  MET   9           3HB      MET   9  -6.987   0.882  -6.035
   77    HG2  MET   9           2HG      MET   9  -6.290   0.809  -3.609
   78    HG3  MET   9           3HG      MET   9  -4.626   0.715  -4.181
   79    HE1  MET   9           3HE      MET   9  -3.482   2.643  -5.679
   80    HE2  MET   9           1HE      MET   9  -4.319   4.121  -6.151
   81    HE3  MET   9           2HE      MET   9  -4.829   2.567  -6.814
   82    H    THR  10           H        THR  10  -4.590  -2.159  -6.896
   83    HA   THR  10           HA       THR  10  -3.453  -3.789  -4.788
   84    HB   THR  10           HB       THR  10  -2.043  -4.759  -6.499
   85    HG1  THR  10           HG1      THR  10  -2.224  -3.914  -8.689
   86   HG21  THR  10          3HG2      THR  10  -3.742  -5.620  -8.028
   87   HG22  THR  10          1HG2      THR  10  -4.833  -4.309  -7.580
   88   HG23  THR  10          2HG2      THR  10  -4.380  -5.527  -6.386
   89    H    PHE  11           H        PHE  11  -1.119  -3.870  -4.373
   90    HA   PHE  11           HA       PHE  11   0.036  -1.466  -3.621
   91    HB2  PHE  11           2HB      PHE  11   1.364  -4.096  -4.309
   92    HB3  PHE  11           3HB      PHE  11   2.205  -2.748  -3.552
   93    HD1  PHE  11           HD1      PHE  11   1.408  -1.945  -1.287
   94    HD2  PHE  11           HD2      PHE  11   0.110  -5.615  -3.022
   95    HE1  PHE  11           HE1      PHE  11   0.704  -2.743   0.930
   96    HE2  PHE  11           HE2      PHE  11  -0.597  -6.413  -0.806
   97    HZ   PHE  11           HZ       PHE  11  -0.303  -4.979   1.171
   98    H    ALA  12           H        ALA  12   0.502  -3.274  -6.647
   99    HA   ALA  12           HA       ALA  12   2.480  -1.688  -7.819
  100    HB1  ALA  12           3HB      ALA  12   1.754  -3.847  -8.728
  101    HB2  ALA  12           1HB      ALA  12   1.724  -2.584  -9.958
  102    HB3  ALA  12           2HB      ALA  12   0.220  -3.126  -9.212
  103    H    GLN  13           H        GLN  13  -1.075  -1.376  -8.086
  104    HA   GLN  13           HA       GLN  13  -1.139   0.892  -9.721
  105    HB2  GLN  13           2HB      GLN  13  -3.093   0.054  -7.566
  106    HB3  GLN  13           3HB      GLN  13  -3.409   1.287  -8.779
  107    HG2  GLN  13           2HG      GLN  13  -3.163  -0.413 -10.546
  108    HG3  GLN  13           3HG      GLN  13  -2.908  -1.641  -9.308
  109   HE21  GLN  13          1HE2      GLN  13  -5.178   1.007  -9.008
  110   HE22  GLN  13          2HE2      GLN  13  -6.599   0.030  -9.054
  111    H    ALA  14           H        ALA  14  -1.056   0.660  -6.175
  112    HA   ALA  14           HA       ALA  14  -1.299   3.369  -5.553
  113    HB1  ALA  14           3HB      ALA  14  -1.451   1.590  -3.885
  114    HB2  ALA  14           1HB      ALA  14  -0.269   2.807  -3.406
  115    HB3  ALA  14           2HB      ALA  14   0.273   1.263  -4.064
  116    H    LEU  15           H        LEU  15   1.677   1.470  -6.082
  117    HA   LEU  15           HA       LEU  15   3.529   3.551  -5.702
  118    HB2  LEU  15           2HB      LEU  15   3.756   1.117  -7.485
  119    HB3  LEU  15           3HB      LEU  15   5.098   2.126  -6.970
  120    HG   LEU  15           HG       LEU  15   3.349   0.485  -5.124
  121   HD11  LEU  15          1HD1      LEU  15   4.764  -0.920  -6.539
  122   HD12  LEU  15          2HD1      LEU  15   5.282  -0.964  -4.854
  123   HD13  LEU  15          3HD1      LEU  15   6.186  -0.005  -6.030
  124   HD21  LEU  15          3HD2      LEU  15   4.218   2.489  -4.040
  125   HD22  LEU  15          1HD2      LEU  15   5.855   2.074  -4.554
  126   HD23  LEU  15          2HD2      LEU  15   4.998   1.041  -3.409
  127    H    GLN  16           H        GLN  16   1.793   2.505  -8.619
  128    HA   GLN  16           HA       GLN  16   3.148   4.322 -10.375
  129    HB2  GLN  16           2HB      GLN  16   0.500   2.895 -10.730
  130    HB3  GLN  16           3HB      GLN  16   1.384   3.728 -12.002
  131    HG2  GLN  16           2HG      GLN  16   2.300   1.284 -10.491
  132    HG3  GLN  16           3HG      GLN  16   1.720   1.334 -12.154
  133   HE21  GLN  16          1HE2      GLN  16   4.348   2.085 -10.020
  134   HE22  GLN  16          2HE2      GLN  16   5.525   2.371 -11.246
  135    H    THR  17           H        THR  17   0.513   4.656  -8.173
  136    HA   THR  17           HA       THR  17  -0.614   7.008  -9.424
  137    HB   THR  17           HB       THR  17  -1.105   5.881  -6.648
  138    HG1  THR  17           HG1      THR  17  -1.834   4.471  -8.273
  139   HG21  THR  17          3HG2      THR  17  -1.687   8.258  -6.758
  140   HG22  THR  17          1HG2      THR  17  -3.146   7.267  -6.686
  141   HG23  THR  17          2HG2      THR  17  -2.632   7.969  -8.220
  142    H    HIS  18           H        HIS  18   1.223   6.429  -6.401
  143    HA   HIS  18           HA       HIS  18   2.391   9.121  -6.671
  144    HB2  HIS  18           2HB      HIS  18   0.887   8.059  -4.300
  145    HB3  HIS  18           3HB      HIS  18   2.243   9.141  -4.024
  146    HD1  HIS  18           HD1      HIS  18  -0.306   9.543  -6.806
  147    HD2  HIS  18           HD2      HIS  18   0.861  11.373  -3.276
  148    HE1  HIS  18           HE1      HIS  18  -1.600  11.675  -6.708
  149    HE2  HIS  18           HE2      HIS  18  -0.660  12.881  -4.718
  150    HA   PRO  19           HA       PRO  19   6.121   6.623  -6.175
  151    HB2  PRO  19           2HB      PRO  19   7.286   9.321  -5.658
  152    HB3  PRO  19           3HB      PRO  19   7.817   8.065  -6.781
  153    HG2  PRO  19           2HG      PRO  19   6.564  10.224  -7.689
  154    HG3  PRO  19           3HG      PRO  19   6.210   8.626  -8.375
  155    HD2  PRO  19           2HD      PRO  19   4.615  10.246  -6.422
  156    HD3  PRO  19           3HD      PRO  19   4.053   9.256  -7.785
  157    H    GLY  20           H        GLY  20   5.217   9.209  -3.911
  158    HA2  GLY  20           2HA      GLY  20   6.894   8.562  -1.767
  159    HA3  GLY  20           3HA      GLY  20   5.341   9.362  -1.621
  160    H    VAL  21           H        VAL  21   4.118   6.841  -2.905
  161    HA   VAL  21           HA       VAL  21   3.262   5.578  -0.548
  162    HB   VAL  21           HB       VAL  21   3.192   4.570  -3.404
  163   HG11  VAL  21          1HG1      VAL  21   1.428   3.033  -2.644
  164   HG12  VAL  21          2HG1      VAL  21   1.714   3.536  -0.978
  165   HG13  VAL  21          3HG1      VAL  21   2.976   2.688  -1.875
  166   HG21  VAL  21          3HG2      VAL  21   1.982   6.664  -3.041
  167   HG22  VAL  21          1HG2      VAL  21   1.082   5.925  -1.718
  168   HG23  VAL  21          2HG2      VAL  21   0.868   5.337  -3.368
  169    H    ALA  22           H        ALA  22   5.963   4.860  -2.695
  170    HA   ALA  22           HA       ALA  22   6.587   2.261  -1.909
  171    HB1  ALA  22           3HB      ALA  22   8.531   4.460  -2.630
  172    HB2  ALA  22           1HB      ALA  22   7.676   3.426  -3.776
  173    HB3  ALA  22           2HB      ALA  22   8.856   2.726  -2.667
  174    H    GLY  23           H        GLY  23   7.803   5.319  -0.514
  175    HA2  GLY  23           2HA      GLY  23   9.297   4.210   1.593
  176    HA3  GLY  23           3HA      GLY  23   8.620   5.831   1.569
  177    H    VAL  24           H        VAL  24   5.879   5.170   1.461
  178    HA   VAL  24           HA       VAL  24   5.233   4.777   4.168
  179    HB   VAL  24           HB       VAL  24   3.412   4.326   1.786
  180   HG11  VAL  24          1HG1      VAL  24   2.464   3.469   3.853
  181   HG12  VAL  24          2HG1      VAL  24   1.608   4.925   3.349
  182   HG13  VAL  24          3HG1      VAL  24   2.783   5.004   4.663
  183   HG21  VAL  24          3HG2      VAL  24   4.463   6.513   1.645
  184   HG22  VAL  24          1HG2      VAL  24   3.994   6.867   3.308
  185   HG23  VAL  24          2HG2      VAL  24   2.759   6.677   2.064
  186    H    LEU  25           H        LEU  25   4.761   2.533   1.418
  187    HA   LEU  25           HA       LEU  25   3.833   0.345   2.868
  188    HB2  LEU  25           2HB      LEU  25   5.496   0.329   0.343
  189    HB3  LEU  25           3HB      LEU  25   4.566  -1.027   0.949
  190    HG   LEU  25           HG       LEU  25   3.450   1.600  -0.046
  191   HD11  LEU  25          1HD1      LEU  25   2.470   0.217  -1.825
  192   HD12  LEU  25          2HD1      LEU  25   3.330  -1.187  -1.191
  193   HD13  LEU  25          3HD1      LEU  25   4.233   0.181  -1.845
  194   HD21  LEU  25          3HD2      LEU  25   1.987  -0.824   1.006
  195   HD22  LEU  25          1HD2      LEU  25   1.241   0.594   0.268
  196   HD23  LEU  25          2HD2      LEU  25   2.098   0.746   1.801
  197    H    ARG  26           H        ARG  26   7.191   1.075   1.881
  198    HA   ARG  26           HA       ARG  26   8.357  -1.202   3.058
  199    HB2  ARG  26           2HB      ARG  26   9.594   1.500   2.479
  200    HB3  ARG  26           3HB      ARG  26  10.499   0.045   2.879
  201    HG2  ARG  26           2HG      ARG  26   9.608  -1.048   0.856
  202    HG3  ARG  26           3HG      ARG  26   8.751   0.440   0.447
  203    HD2  ARG  26           2HD      ARG  26  10.833   0.263  -0.814
  204    HD3  ARG  26           3HD      ARG  26  10.892   1.628   0.303
  205    HE   ARG  26           HE       ARG  26  11.995  -0.673   1.514
  206   HH11  ARG  26          1HH1      ARG  26  12.717   1.651  -0.922
  207   HH12  ARG  26          2HH1      ARG  26  14.421   1.531  -0.678
  208   HH21  ARG  26          1HH2      ARG  26  14.169  -0.844   1.795
  209   HH22  ARG  26          2HH2      ARG  26  15.242   0.103   0.821
  210    H    SER  27           H        SER  27   7.548   1.944   4.442
  211    HA   SER  27           HA       SER  27   8.948   1.695   6.884
  212    HB2  SER  27           2HB      SER  27   7.981   3.833   6.192
  213    HB3  SER  27           3HB      SER  27   6.356   3.161   6.303
  214    HG   SER  27           HG       SER  27   6.823   4.328   8.171
  215    H    TYR  28           H        TYR  28   5.764   0.557   5.876
  216    HA   TYR  28           HA       TYR  28   5.194  -0.594   8.497
  217    HB2  TYR  28           2HB      TYR  28   3.627  -0.468   5.917
  218    HB3  TYR  28           3HB      TYR  28   3.066  -1.352   7.330
  219    HD1  TYR  28           HD2      TYR  28   4.218   2.072   6.339
  220    HD2  TYR  28           HD1      TYR  28   1.713  -0.258   8.874
  221    HE1  TYR  28           HE2      TYR  28   3.200   4.130   7.213
  222    HE2  TYR  28           HE1      TYR  28   0.688   1.796   9.757
  223    HH   TYR  28           HH       TYR  28   1.202   4.154   9.992
  224    H    ASN  29           H        ASN  29   7.280  -1.581   6.345
  225    HA   ASN  29           HA       ASN  29   8.224  -3.545   5.708
  226    HB2  ASN  29           2HB      ASN  29   7.825  -4.067   8.175
  227    HB3  ASN  29           3HB      ASN  29   6.391  -4.950   7.665
  228   HD21  ASN  29          1HD2      ASN  29   8.827  -5.905   8.977
  229   HD22  ASN  29          2HD2      ASN  29   9.463  -7.136   7.949
  230    H    LEU  30           H        LEU  30   6.238  -2.602   4.085
  231    HA   LEU  30           HA       LEU  30   4.947  -5.060   3.072
  232    HB2  LEU  30           2HB      LEU  30   4.292  -2.154   2.519
  233    HB3  LEU  30           3HB      LEU  30   3.480  -3.521   1.782
  234    HG   LEU  30           HG       LEU  30   3.466  -2.931   4.750
  235   HD11  LEU  30          1HD1      LEU  30   1.153  -2.206   4.413
  236   HD12  LEU  30          2HD1      LEU  30   1.338  -2.414   2.671
  237   HD13  LEU  30          3HD1      LEU  30   2.283  -1.188   3.518
  238   HD21  LEU  30          3HD2      LEU  30   1.678  -4.592   4.829
  239   HD22  LEU  30          1HD2      LEU  30   3.167  -5.298   4.205
  240   HD23  LEU  30          2HD2      LEU  30   1.856  -4.884   3.099
  241    H    GLY  31           H        GLY  31   7.780  -3.787   2.711
  242    HA2  GLY  31           2HA      GLY  31   7.909  -2.960  -0.036
  243    HA3  GLY  31           3HA      GLY  31   9.273  -3.268   1.023
  244    H    CYS  32           H        CYS  32   8.234  -6.030   1.584
  245    HA   CYS  32           HA       CYS  32   9.747  -7.410  -0.352
  246    HB2  CYS  32           2HB      CYS  32   9.404  -8.283   1.909
  247    HB3  CYS  32           3HB      CYS  32   7.691  -8.517   1.578
  248    HG   CYS  32           HG       CYS  32   8.957 -11.011   1.556
  249    H    ILE  33           H        ILE  33   6.607  -6.200  -0.637
  250    HA   ILE  33           HA       ILE  33   5.152  -8.032  -2.072
  251    HB   ILE  33           HB       ILE  33   4.153  -6.098  -3.320
  252   HG12  ILE  33          2HG1      ILE  33   6.193  -4.496  -1.742
  253   HG13  ILE  33          3HG1      ILE  33   6.184  -4.711  -3.488
  254   HG21  ILE  33          1HG2      ILE  33   4.428  -5.795  -0.327
  255   HG22  ILE  33          2HG2      ILE  33   3.247  -6.791  -1.181
  256   HG23  ILE  33          3HG2      ILE  33   3.183  -5.035  -1.320
  257   HD11  ILE  33          3HD1      ILE  33   5.331  -2.537  -2.868
  258   HD12  ILE  33          1HD1      ILE  33   4.085  -3.283  -1.869
  259   HD13  ILE  33          2HD1      ILE  33   4.064  -3.504  -3.620
  260    H    GLY  34           H        GLY  34   7.817  -6.027  -3.281
  261    HA2  GLY  34           2HA      GLY  34   7.595  -6.798  -6.013
  262    HA3  GLY  34           3HA      GLY  34   9.023  -6.122  -5.242
  263    H    CYS  35           H        CYS  35   9.469  -8.121  -3.306
  264    HA   CYS  35           HA       CYS  35  10.968  -9.987  -4.818
  265    HB2  CYS  35           2HB      CYS  35  10.234 -10.066  -1.879
  266    HB3  CYS  35           3HB      CYS  35  11.485 -11.040  -2.646
  267    HG   CYS  35           HG       CYS  35  13.166  -9.308  -1.668
  268    H    MET  36           H        MET  36   8.062 -10.459  -2.789
  269    HA   MET  36           HA       MET  36   7.755 -13.200  -3.600
  270    HB2  MET  36           2HB      MET  36   5.652 -13.123  -2.314
  271    HB3  MET  36           3HB      MET  36   7.013 -12.498  -1.395
  272    HG2  MET  36           2HG      MET  36   6.288 -10.206  -1.910
  273    HG3  MET  36           3HG      MET  36   4.895 -10.857  -2.773
  274    HE1  MET  36           3HE      MET  36   4.076 -13.332  -0.955
  275    HE2  MET  36           1HE      MET  36   2.895 -12.182  -1.581
  276    HE3  MET  36           2HE      MET  36   2.900 -12.596   0.134
  277    H    GLY  37           H        GLY  37   7.006 -10.295  -5.137
  278    HA2  GLY  37           2HA      GLY  37   5.973  -9.918  -7.169
  279    HA3  GLY  37           3HA      GLY  37   5.605 -11.633  -7.259
  280    H    ALA  38           H        ALA  38   4.635  -9.591  -4.582
  281    HA   ALA  38           HA       ALA  38   1.842 -10.265  -5.041
  282    HB1  ALA  38           3HB      ALA  38   2.753 -10.452  -2.786
  283    HB2  ALA  38           1HB      ALA  38   1.462  -9.250  -2.838
  284    HB3  ALA  38           2HB      ALA  38   3.148  -8.734  -2.787
  285    H    GLN  39           H        GLN  39   3.102  -8.419  -6.929
  286    HA   GLN  39           HA       GLN  39   2.404  -5.735  -6.409
  287    HB2  GLN  39           2HB      GLN  39   2.757  -7.193  -9.032
  288    HB3  GLN  39           3HB      GLN  39   2.575  -5.449  -8.895
  289    HG2  GLN  39           2HG      GLN  39   4.807  -7.096  -7.706
  290    HG3  GLN  39           3HG      GLN  39   4.916  -6.091  -9.150
  291   HE21  GLN  39          1HE2      GLN  39   4.774  -6.120  -5.691
  292   HE22  GLN  39          2HE2      GLN  39   5.173  -4.458  -5.459
  293    H    ASN  40           H        ASN  40   0.555  -8.409  -7.755
  294    HA   ASN  40           HA       ASN  40  -1.726  -6.694  -8.368
  295    HB2  ASN  40           2HB      ASN  40  -1.361  -9.687  -8.664
  296    HB3  ASN  40           3HB      ASN  40  -2.770  -8.778  -9.212
  297   HD21  ASN  40          1HD2      ASN  40   0.580  -9.476  -9.775
  298   HD22  ASN  40          2HD2      ASN  40   0.655  -8.774 -11.353
  299    H    GLU  41           H        GLU  41  -0.651  -7.574  -5.546
  300    HA   GLU  41           HA       GLU  41  -3.125  -8.639  -4.417
  301    HB2  GLU  41           2HB      GLU  41  -0.969  -9.519  -3.624
  302    HB3  GLU  41           3HB      GLU  41  -0.493  -7.912  -3.100
  303    HG2  GLU  41           2HG      GLU  41  -2.068  -7.898  -1.349
  304    HG3  GLU  41           3HG      GLU  41  -2.931  -9.289  -2.005
  305    H    SER  42           H        SER  42  -4.600  -7.441  -3.279
  306    HA   SER  42           HA       SER  42  -4.515  -4.591  -3.588
  307    HB2  SER  42           2HB      SER  42  -6.720  -4.564  -2.596
  308    HB3  SER  42           3HB      SER  42  -6.629  -5.927  -3.708
  309    HG   SER  42           HG       SER  42  -7.593  -6.538  -1.751
  310    H    LEU  43           H        LEU  43  -4.720  -3.018  -1.888
  311    HA   LEU  43           HA       LEU  43  -2.636  -3.138  -0.062
  312    HB2  LEU  43           2HB      LEU  43  -5.094  -1.386   0.057
  313    HB3  LEU  43           3HB      LEU  43  -3.603  -1.101   0.938
  314    HG   LEU  43           HG       LEU  43  -3.921  -1.051  -2.076
  315   HD11  LEU  43          1HD1      LEU  43  -3.400   1.184  -0.114
  316   HD12  LEU  43          2HD1      LEU  43  -4.913   0.890  -0.972
  317   HD13  LEU  43          3HD1      LEU  43  -3.464   1.337  -1.872
  318   HD21  LEU  43          3HD2      LEU  43  -1.593  -0.270  -2.112
  319   HD22  LEU  43          1HD2      LEU  43  -1.724  -1.899  -1.450
  320   HD23  LEU  43          2HD2      LEU  43  -1.481  -0.526  -0.370
  321    H    GLU  44           H        GLU  44  -6.077  -3.842   0.506
  322    HA   GLU  44           HA       GLU  44  -5.864  -4.071   3.329
  323    HB2  GLU  44           2HB      GLU  44  -8.027  -3.715   2.258
  324    HB3  GLU  44           3HB      GLU  44  -7.914  -5.270   1.448
  325    HG2  GLU  44           2HG      GLU  44  -8.033  -6.429   3.578
  326    HG3  GLU  44           3HG      GLU  44  -8.033  -4.891   4.439
  327    H    GLN  45           H        GLN  45  -5.767  -6.539   0.749
  328    HA   GLN  45           HA       GLN  45  -5.588  -8.812   2.355
  329    HB2  GLN  45           2HB      GLN  45  -4.353  -8.270  -0.356
  330    HB3  GLN  45           3HB      GLN  45  -4.408  -9.859   0.395
  331    HG2  GLN  45           2HG      GLN  45  -6.842  -9.803   0.374
  332    HG3  GLN  45           3HG      GLN  45  -6.810  -8.188  -0.332
  333   HE21  GLN  45          1HE2      GLN  45  -7.938  -8.850  -2.156
  334   HE22  GLN  45          2HE2      GLN  45  -7.231  -9.836  -3.381
  335    H    GLY  46           H        GLY  46  -2.890  -6.895   0.994
  336    HA2  GLY  46           2HA      GLY  46  -0.816  -8.268   2.331
  337    HA3  GLY  46           3HA      GLY  46  -0.716  -6.634   1.699
  338    H    ALA  47           H        ALA  47  -2.761  -5.475   3.345
  339    HA   ALA  47           HA       ALA  47  -1.306  -4.688   5.582
  340    HB1  ALA  47           3HB      ALA  47  -3.203  -3.422   4.663
  341    HB2  ALA  47           1HB      ALA  47  -3.360  -3.674   6.401
  342    HB3  ALA  47           2HB      ALA  47  -4.314  -4.646   5.279
  343    H    ASN  48           H        ASN  48  -4.170  -6.854   5.614
  344    HA   ASN  48           HA       ASN  48  -3.934  -7.633   8.305
  345    HB2  ASN  48           2HB      ASN  48  -5.171  -9.148   5.990
  346    HB3  ASN  48           3HB      ASN  48  -5.398  -9.547   7.689
  347   HD21  ASN  48          1HD2      ASN  48  -6.217  -7.373   5.137
  348   HD22  ASN  48          2HD2      ASN  48  -7.450  -6.518   5.989
  349    H    ALA  49           H        ALA  49  -2.563  -9.067   5.374
  350    HA   ALA  49           HA       ALA  49  -1.524 -11.424   6.467
  351    HB1  ALA  49           3HB      ALA  49  -0.035 -11.463   4.533
  352    HB2  ALA  49           1HB      ALA  49  -0.410  -9.770   4.201
  353    HB3  ALA  49           2HB      ALA  49  -1.671 -10.996   4.067
  354    H    HIS  50           H        HIS  50  -0.281  -8.139   6.597
  355    HA   HIS  50           HA       HIS  50   2.202  -9.075   7.885
  356    HB2  HIS  50           2HB      HIS  50   1.449  -6.370   6.758
  357    HB3  HIS  50           3HB      HIS  50   2.968  -6.711   7.578
  358    HD1  HIS  50           HD1      HIS  50   4.791  -7.017   5.950
  359    HD2  HIS  50           HD2      HIS  50   1.185  -8.466   4.476
  360    HE1  HIS  50           HE1      HIS  50   5.298  -7.873   3.647
  361    HE2  HIS  50           HE2      HIS  50   3.071  -8.577   2.714
  362    H    GLY  51           H        GLY  51  -0.784  -8.376   8.920
  363    HA2  GLY  51           2HA      GLY  51  -1.550  -8.068  11.084
  364    HA3  GLY  51           3HA      GLY  51   0.105  -7.809  11.604
  365    H    LEU  52           H        LEU  52  -1.538  -5.966   9.094
  366    HA   LEU  52           HA       LEU  52  -1.302  -3.543  10.771
  367    HB2  LEU  52           2HB      LEU  52  -1.090  -3.746   7.763
  368    HB3  LEU  52           3HB      LEU  52  -0.845  -2.302   8.728
  369    HG   LEU  52           HG       LEU  52   0.906  -4.758   8.924
  370   HD11  LEU  52          1HD1      LEU  52   2.541  -3.520   7.598
  371   HD12  LEU  52          2HD1      LEU  52   1.377  -2.214   7.369
  372   HD13  LEU  52          3HD1      LEU  52   1.062  -3.809   6.684
  373   HD21  LEU  52          3HD2      LEU  52   1.268  -1.934   9.943
  374   HD22  LEU  52          1HD2      LEU  52   2.455  -3.235  10.064
  375   HD23  LEU  52          2HD2      LEU  52   0.919  -3.361  10.921
  376    H    ASN  53           H        ASN  53  -2.827  -1.773  10.199
  377    HA   ASN  53           HA       ASN  53  -5.448  -2.808   9.353
  378    HB2  ASN  53           2HB      ASN  53  -5.287  -1.543  11.512
  379    HB3  ASN  53           3HB      ASN  53  -4.793  -0.121  10.599
  380   HD21  ASN  53          1HD2      ASN  53  -7.099  -0.393  12.276
  381   HD22  ASN  53          2HD2      ASN  53  -8.482  -0.133  11.274
  382    H    VAL  54           H        VAL  54  -6.084  -2.475   7.316
  383    HA   VAL  54           HA       VAL  54  -4.666  -1.098   5.375
  384    HB   VAL  54           HB       VAL  54  -6.352  -2.760   4.808
  385   HG11  VAL  54          1HG1      VAL  54  -8.037  -2.235   6.496
  386   HG12  VAL  54          2HG1      VAL  54  -8.754  -2.256   4.885
  387   HG13  VAL  54          3HG1      VAL  54  -8.406  -0.717   5.674
  388   HG21  VAL  54          3HG2      VAL  54  -6.957  -0.055   3.602
  389   HG22  VAL  54          1HG2      VAL  54  -7.415  -1.609   2.905
  390   HG23  VAL  54          2HG2      VAL  54  -5.711  -1.185   3.072
  391    H    GLU  55           H        GLU  55  -7.294   0.105   7.425
  392    HA   GLU  55           HA       GLU  55  -7.720   2.569   6.126
  393    HB2  GLU  55           2HB      GLU  55  -8.090   1.893   9.058
  394    HB3  GLU  55           3HB      GLU  55  -8.794   3.274   8.227
  395    HG2  GLU  55           2HG      GLU  55 -10.064   1.734   6.779
  396    HG3  GLU  55           3HG      GLU  55  -9.389   0.371   7.667
  397    H    ASP  56           H        ASP  56  -5.571   1.691   8.814
  398    HA   ASP  56           HA       ASP  56  -4.583   4.267   9.376
  399    HB2  ASP  56           2HB      ASP  56  -4.332   2.320  10.884
  400    HB3  ASP  56           3HB      ASP  56  -3.203   1.591   9.744
  401    H    ILE  57           H        ILE  57  -3.620   1.852   7.012
  402    HA   ILE  57           HA       ILE  57  -1.260   3.218   6.123
  403    HB   ILE  57           HB       ILE  57  -2.913   1.122   4.684
  404   HG12  ILE  57          2HG1      ILE  57  -0.443   0.784   6.415
  405   HG13  ILE  57          3HG1      ILE  57  -2.083   0.381   6.909
  406   HG21  ILE  57          1HG2      ILE  57  -0.885   0.690   3.381
  407   HG22  ILE  57          2HG2      ILE  57  -0.059   2.004   4.218
  408   HG23  ILE  57          3HG2      ILE  57  -1.434   2.353   3.170
  409   HD11  ILE  57          3HD1      ILE  57  -0.536  -0.913   4.673
  410   HD12  ILE  57          1HD1      ILE  57  -2.187  -1.312   5.148
  411   HD13  ILE  57          2HD1      ILE  57  -0.856  -1.600   6.266
  412    H    LEU  58           H        LEU  58  -4.546   2.860   4.726
  413    HA   LEU  58           HA       LEU  58  -4.283   4.534   2.520
  414    HB2  LEU  58           2HB      LEU  58  -6.712   4.125   4.274
  415    HB3  LEU  58           3HB      LEU  58  -6.743   4.872   2.687
  416    HG   LEU  58           HG       LEU  58  -6.000   2.001   3.285
  417   HD11  LEU  58          1HD1      LEU  58  -8.418   3.189   1.923
  418   HD12  LEU  58          2HD1      LEU  58  -8.385   2.432   3.516
  419   HD13  LEU  58          3HD1      LEU  58  -8.063   1.469   2.075
  420   HD21  LEU  58          3HD2      LEU  58  -5.928   1.720   0.851
  421   HD22  LEU  58          1HD2      LEU  58  -4.706   2.867   1.403
  422   HD23  LEU  58          2HD2      LEU  58  -6.185   3.452   0.640
  423    H    ARG  59           H        ARG  59  -4.799   5.334   5.878
  424    HA   ARG  59           HA       ARG  59  -5.466   8.003   5.843
  425    HB2  ARG  59           2HB      ARG  59  -5.300   6.857   7.919
  426    HB3  ARG  59           3HB      ARG  59  -3.625   6.417   7.631
  427    HG2  ARG  59           2HG      ARG  59  -3.147   8.942   7.732
  428    HG3  ARG  59           3HG      ARG  59  -4.758   9.076   8.443
  429    HD2  ARG  59           2HD      ARG  59  -2.971   8.917  10.147
  430    HD3  ARG  59           3HD      ARG  59  -4.125   7.585  10.246
  431    HE   ARG  59           HE       ARG  59  -2.428   6.237   9.020
  432   HH11  ARG  59          1HH1      ARG  59  -1.456   8.959  10.896
  433   HH12  ARG  59          2HH1      ARG  59   0.163   8.386  11.077
  434   HH21  ARG  59          1HH2      ARG  59  -0.348   5.508   9.280
  435   HH22  ARG  59          2HH2      ARG  59   0.782   6.463  10.179
  436    H    ASP  60           H        ASP  60  -2.126   6.712   5.833
  437    HA   ASP  60           HA       ASP  60  -0.957   9.289   5.428
  438    HB2  ASP  60           2HB      ASP  60   0.108   7.262   6.583
  439    HB3  ASP  60           3HB      ASP  60   0.420   6.640   4.965
  440    H    LEU  61           H        LEU  61  -1.683   6.527   3.320
  441    HA   LEU  61           HA       LEU  61  -0.363   7.341   1.005
  442    HB2  LEU  61           2HB      LEU  61  -2.965   5.826   1.252
  443    HB3  LEU  61           3HB      LEU  61  -2.014   5.942  -0.216
  444    HG   LEU  61           HG       LEU  61  -1.187   4.581   2.354
  445   HD11  LEU  61          1HD1      LEU  61  -2.825   3.323   1.058
  446   HD12  LEU  61          2HD1      LEU  61  -1.247   2.541   1.002
  447   HD13  LEU  61          3HD1      LEU  61  -1.820   3.470  -0.384
  448   HD21  LEU  61          3HD2      LEU  61   0.744   5.636   1.329
  449   HD22  LEU  61          1HD2      LEU  61   0.340   4.916  -0.230
  450   HD23  LEU  61          2HD2      LEU  61   0.821   3.887   1.120
  451    H    ASN  62           H        ASN  62  -3.788   7.971   1.877
  452    HA   ASN  62           HA       ASN  62  -4.242   9.695  -0.339
  453    HB2  ASN  62           2HB      ASN  62  -5.748   9.315   2.255
  454    HB3  ASN  62           3HB      ASN  62  -6.270  10.448   1.012
  455   HD21  ASN  62          1HD2      ASN  62  -6.059   7.134   1.934
  456   HD22  ASN  62          2HD2      ASN  62  -6.931   6.487   0.591
  457    H    ALA  63           H        ALA  63  -3.075  10.236   2.936
  458    HA   ALA  63           HA       ALA  63  -3.189  13.039   3.006
  459    HB1  ALA  63           3HB      ALA  63  -1.148  11.231   4.305
  460    HB2  ALA  63           1HB      ALA  63  -2.711  11.685   4.985
  461    HB3  ALA  63           2HB      ALA  63  -1.468  12.912   4.738
  462    H    LEU  64           H        LEU  64  -1.005  10.897   1.321
  463    HA   LEU  64           HA       LEU  64   1.024  12.796   0.704
  464    HB2  LEU  64           2HB      LEU  64   0.155  10.325  -0.808
  465    HB3  LEU  64           3HB      LEU  64   1.628  11.224  -1.120
  466    HG   LEU  64           HG       LEU  64   0.992   9.775   1.459
  467   HD11  LEU  64          1HD1      LEU  64   2.685   8.172   0.761
  468   HD12  LEU  64          2HD1      LEU  64   2.891   9.032  -0.766
  469   HD13  LEU  64          3HD1      LEU  64   1.361   8.231  -0.403
  470   HD21  LEU  64          3HD2      LEU  64   3.525  11.135   0.533
  471   HD22  LEU  64          1HD2      LEU  64   3.330  10.213   2.024
  472   HD23  LEU  64          2HD2      LEU  64   2.439  11.717   1.796
  473    H    ALA  65           H        ALA  65  -2.041  11.960  -0.829
  474    HA   ALA  65           HA       ALA  65  -1.561  13.506  -3.216
  475    HB1  ALA  65           3HB      ALA  65  -4.141  12.331  -2.170
  476    HB2  ALA  65           1HB      ALA  65  -3.006  11.527  -3.255
  477    HB3  ALA  65           2HB      ALA  65  -3.871  12.965  -3.794
  478    H    LEU  66           H        LEU  66  -3.128  14.046  -0.136
  479    HA   LEU  66           HA       LEU  66  -4.273  16.596  -0.960
  480    HB2  LEU  66           2HB      LEU  66  -4.258  15.213   1.729
  481    HB3  LEU  66           3HB      LEU  66  -5.177  16.655   1.335
  482    HG   LEU  66           HG       LEU  66  -5.578  13.950   0.036
  483   HD11  LEU  66          1HD1      LEU  66  -7.243  15.347   2.133
  484   HD12  LEU  66          2HD1      LEU  66  -6.239  13.920   2.390
  485   HD13  LEU  66          3HD1      LEU  66  -7.643  13.829   1.327
  486   HD21  LEU  66          3HD2      LEU  66  -7.612  14.954  -0.888
  487   HD22  LEU  66          1HD2      LEU  66  -6.168  15.806  -1.434
  488   HD23  LEU  66          2HD2      LEU  66  -7.178  16.506  -0.168
  489    H    GLU  67           H        GLU  67  -1.818  15.447   1.336
  490    HA   GLU  67           HA       GLU  67  -0.185  16.439   2.524
  491    HB2  GLU  67           2HB      GLU  67  -0.362  18.504   0.329
  492    HB3  GLU  67           3HB      GLU  67   0.852  18.546   1.602
  493    HG2  GLU  67           2HG      GLU  67   1.566  16.254   0.879
  494    HG3  GLU  67           3HG      GLU  67   0.482  16.423  -0.503
  495    H    HIS  68           H        HIS  68  -1.191  16.792   4.429
  496    HA   HIS  68           HA       HIS  68  -2.423  19.450   4.854
  497    HB2  HIS  68           2HB      HIS  68  -3.716  18.496   6.668
  498    HB3  HIS  68           3HB      HIS  68  -3.949  17.515   5.229
  499    HD1  HIS  68           HD1      HIS  68  -3.817  16.955   8.601
  500    HD2  HIS  68           HD2      HIS  68  -1.637  15.333   5.462
  501    HE1  HIS  68           HE1      HIS  68  -2.900  14.791   9.469
  502    HE2  HIS  68           HE2      HIS  68  -1.371  13.983   7.649
  503    H    HIS  69           H        HIS  69  -1.365  20.847   6.137
  504    HA   HIS  69           HA       HIS  69   0.967  19.914   7.631
  505    HB2  HIS  69           2HB      HIS  69  -0.023  22.720   7.065
  506    HB3  HIS  69           3HB      HIS  69   1.486  22.320   7.886
  507    HD1  HIS  69           HD1      HIS  69   0.032  22.797   4.565
  508    HD2  HIS  69           HD2      HIS  69   3.396  20.953   6.164
  509    HE1  HIS  69           HE1      HIS  69   1.565  22.390   2.618
  510    HE2  HIS  69           HE2      HIS  69   3.509  21.123   3.587
  511    H    HIS  70           H        HIS  70   1.056  19.738   9.794
  512    HA   HIS  70           HA       HIS  70  -1.449  19.905  11.222
  513    HB2  HIS  70           2HB      HIS  70   0.129  17.979  11.425
  514    HB3  HIS  70           3HB      HIS  70   1.263  19.041  12.251
  515    HD1  HIS  70           HD1      HIS  70  -2.075  17.373  12.696
  516    HD2  HIS  70           HD2      HIS  70   0.714  19.481  14.939
  517    HE1  HIS  70           HE1      HIS  70  -2.815  17.134  15.075
  518    HE2  HIS  70           HE2      HIS  70  -0.989  18.220  16.420
  519    H    HIS  71           H        HIS  71   1.553  21.729  11.185
  520    HA   HIS  71           HA       HIS  71   1.031  23.170  13.617
  521    HB2  HIS  71           2HB      HIS  71   2.928  23.756  11.325
  522    HB3  HIS  71           3HB      HIS  71   2.875  24.671  12.829
  523    HD1  HIS  71           HD1      HIS  71   5.412  23.126  11.883
  524    HD2  HIS  71           HD2      HIS  71   2.604  21.670  14.579
  525    HE1  HIS  71           HE1      HIS  71   6.612  21.384  13.229
  526    HE2  HIS  71           HE2      HIS  71   4.866  20.436  14.770
  527    H    HIS  72           H        HIS  72  -0.167  24.975  13.925
  528    HA   HIS  72           HA       HIS  72  -1.923  25.874  11.886
  529    HB2  HIS  72           2HB      HIS  72  -1.307  27.003  14.619
  530    HB3  HIS  72           3HB      HIS  72  -2.551  27.656  13.559
  531    HD1  HIS  72           HD1      HIS  72  -2.502  25.777  16.415
  532    HD2  HIS  72           HD2      HIS  72  -4.163  25.054  12.673
  533    HE1  HIS  72           HE1      HIS  72  -4.324  24.093  16.796
  534    HE2  HIS  72           HE2      HIS  72  -5.397  23.776  14.546
  535    H    HIS  73           H        HIS  73  -0.878  26.732  10.128
  536    HA   HIS  73           HA       HIS  73   0.423  29.355  10.554
  537    HB2  HIS  73           2HB      HIS  73   0.761  27.395   8.268
  538    HB3  HIS  73           3HB      HIS  73   1.416  29.028   8.270
  539    HD1  HIS  73           HD1      HIS  73   3.417  29.496   9.867
  540    HD2  HIS  73           HD2      HIS  73   2.182  25.532   9.783
  541    HE1  HIS  73           HE1      HIS  73   5.263  28.199  10.960
  542    HE2  HIS  73           HE2      HIS  73   4.550  25.795  10.788