*HEADER   CALCIUM-BINDING PROTEIN                 04-FEB-97   1SMG    
*TITLE    CALCIUM-BOUND E41A MUTANT OF THE N-DOMAIN OF CHICKEN        
*TITLE   2 TROPONIN C, NMR, 40 STRUCTURES                             
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: TROPONIN C;                                      
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 FRAGMENT: N-DOMAIN;                                        
*COMPND  5 SYNONYM: TNC;                                              
*COMPND  6 ENGINEERED: YES;                                           
*COMPND  7 MUTATION: E41A;                                            
*COMPND  8 BIOLOGICAL_UNIT: MONOMER;                                  
*COMPND  9 OTHER_DETAILS: 2 CALCIUM IONS BOUND IN SOLUTION            
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: GALLUS GALLUS;                        
*SOURCE  3 ORGANISM_COMMON: CHICKEN;                                  
*SOURCE  4 ORGAN: SKELETAL;                                           
*SOURCE  5 TISSUE: MUSCLE;                                            
*SOURCE  6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  7 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3) PLYS S;               
*SOURCE  8 EXPRESSION_SYSTEM_VECTOR: PET3A                            
*KEYWDS   CALCIUM-BINDING PROTEIN, MUSCLE PROTEIN, TROPONIN C         
*EXPDTA   NMR, 40 STRUCTURES                                          
*AUTHOR   S.M.GAGNE,M.X.LI,B.D.SYKES                                  
*REVDAT  1   12-AUG-97 1SMG    0                                      


!
!  PHI DIHEDRAL RESTRAINTS
!
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assign (resid  41 and name    C) (resid  42 and name    N)
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assign (resid  42 and name    C) (resid  43 and name    N)
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assign (resid  43 and name    C) (resid  44 and name    N)
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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    C) (resid  47 and name    N)
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assign (resid  47 and name    C) (resid  48 and name    N)
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assign (resid  57 and name    C) (resid  58 and name    N)
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assign (resid  58 and name    C) (resid  59 and name    N)
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assign (resid  59 and name    C) (resid  60 and name    N)
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assign (resid  65 and name    C) (resid  66 and name    N)
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assign (resid  66 and name    C) (resid  67 and name    N)
       (resid  67 and name   CA) (resid  67 and name    C)  1.0  -57.0   10.0 2
assign (resid  67 and name    C) (resid  68 and name    N)
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assign (resid  69 and name    C) (resid  70 and name    N)
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assign (resid  70 and name    C) (resid  71 and name    N)
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assign (resid  71 and name    C) (resid  72 and name    N)
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assign (resid  72 and name    C) (resid  73 and name    N)
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assign (resid  73 and name    C) (resid  74 and name    N)
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assign (resid  74 and name    C) (resid  75 and name    N)
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assign (resid  75 and name    C) (resid  76 and name    N)
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assign (resid  76 and name    C) (resid  77 and name    N)
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assign (resid  77 and name    C) (resid  78 and name    N)
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assign (resid  78 and name    C) (resid  79 and name    N)
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assign (resid  79 and name    C) (resid  80 and name    N)
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assign (resid  80 and name    C) (resid  81 and name    N)
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assign (resid  81 and name    C) (resid  82 and name    N)
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assign (resid  82 and name    C) (resid  83 and name    N)
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assign (resid  83 and name    C) (resid  84 and name    N)
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!
! NOE RESTRAINTS
!
class intra
assign (resid   3 and name   HN) (resid   3 and name  HB*)  3.50  1.80  1.79
assign (resid   3 and name   HN) (resid   3 and name  HG*)  3.85  2.15  2.15
assign (resid   3 and name   HN) (resid   3 and name   HA)  2.69  0.99  0.98
assign (resid   4 and name   HN) (resid   4 and name   HA)  2.71  1.01  1.01
assign (resid   4 and name   HN) (resid   4 and name HG2*)  2.84  1.14  1.14
assign (resid   5 and name   HN) (resid   5 and name   HA)  2.71  1.01  1.00
assign (resid   5 and name   HN) (resid   5 and name  HB*)  2.73  1.03  1.02
assign (resid   6 and name   HN) (resid   6 and name  HG*)  3.00  1.30  1.30
assign (resid   6 and name   HN) (resid   6 and name   HA)  2.70  1.00  1.00
assign (resid   7 and name   HN) (resid   7 and name  HG*)  2.72  1.02  1.02
assign (resid   7 and name   HN) (resid   7 and name   HA)  2.70  1.00  1.00
assign (resid   7 and name   HN) (resid   7 and name  HB*)  2.79  1.09  1.08
assign (resid   8 and name   HN) (resid   8 and name   HA)  2.70  1.00  1.00
assign (resid   8 and name   HN) (resid   8 and name  HB*)  2.75  1.05  1.04
assign (resid  10 and name   HN) (resid  10 and name  HB*)  3.06  1.36  1.35
assign (resid  11 and name   HN) (resid  11 and name   HA)  2.69  0.99  1.00
assign (resid  11 and name   HN) (resid  11 and name  HG*)  3.59  1.89  1.89
assign (resid  11 and name   HN) (resid  11 and name  HD*)  3.67  1.97  1.96
assign (resid  11 and name   HE) (resid  11 and name  HD*)  3.75  2.05  2.05
assign (resid  12 and name   HN) (resid  12 and name   HA)  2.69  0.99  1.00
assign (resid  12 and name   HN) (resid  12 and name  HB*)  2.69  0.99  1.00
assign (resid  13 and name   HN) (resid  13 and name  HD*)  3.21  1.51  1.50
assign (resid  13 and name   HN) (resid  13 and name   HA)  2.69  0.99  0.99
assign (resid  14 and name   HN) (resid  14 and name  HB*)  2.57  0.87  0.87
assign (resid  14 and name   HN) (resid  14 and name   HA)  2.70  1.00  1.00
assign (resid  14 and name   HN) (resid  14 and name   HG)  2.50  0.80  0.79
assign (resid  14 and name   HN) (resid  14 and name HD1*)  3.19  1.49  1.49
assign (resid  14 and name   HN) (resid  14 and name HD2*)  3.34  1.64  1.64
assign (resid  15 and name   HN) (resid  15 and name  HB*)  3.21  1.51  1.51
assign (resid  15 and name   HN) (resid  15 and name   HA)  2.71  1.01  1.00
assign (resid  16 and name   HN) (resid  16 and name  HG*)  3.00  1.30  1.30
assign (resid  16 and name   HN) (resid  16 and name   HA)  2.69  0.99  1.00
assign (resid  16 and name   HN) (resid  16 and name  HB*)  2.67  0.97  0.98
assign (resid  17 and name   HN) (resid  17 and name   HA)  2.69  0.99  1.00
assign (resid  17 and name   HN) (resid  17 and name  HB*)  2.82  1.12  1.12
assign (resid  17 and name   HN) (resid  17 and name  HG*)  3.17  1.47  1.47
assign (resid  18 and name   HN) (resid  18 and name  HB*)  3.19  1.49  1.48
assign (resid  19 and name   HN) (resid  19 and name   HA)  2.70  1.00  1.00
assign (resid  20 and name   HN) (resid  20 and name  HB*)  2.77  1.07  1.06
assign (resid  20 and name   HN) (resid  20 and name   HA)  2.69  0.99  0.99
assign (resid  21 and name   HN) (resid  21 and name  HG*)  3.18  1.48  1.48
assign (resid  22 and name   HN) (resid  22 and name  HD*)  2.81  1.11  1.11
assign (resid  22 and name   HN) (resid  22 and name  HB*)  2.67  0.97  0.97
assign (resid  22 and name   HN) (resid  22 and name   HA)  2.69  0.99  1.00
assign (resid  23 and name   HN) (resid  23 and name  HG*)  3.12  1.42  1.42
assign (resid  23 and name   HN) (resid  23 and name  HB*)  2.52  0.82  0.81
assign (resid  23 and name   HN) (resid  23 and name   HA)  2.70  1.00  1.00
assign (resid  24 and name   HN) (resid  24 and name  HB*)  2.56  0.86  0.86
assign (resid  25 and name   HN) (resid  25 and name  HB*)  2.89  1.19  1.19
assign (resid  26 and name   HN) (resid  26 and name  HD*)  3.13  1.43  1.43
assign (resid  26 and name   HN) (resid  26 and name  HB*)  2.56  0.86  0.86
assign (resid  26 and name   HN) (resid  26 and name   HA)  2.71  1.01  1.02
assign (resid  27 and name   HN) (resid  27 and name   HA)  2.70  1.00  1.00
assign (resid  27 and name   HN) (resid  27 and name  HB*)  2.75  1.05  1.06
assign (resid  28 and name   HN) (resid  28 and name  HG*)  2.89  1.19  1.19
assign (resid  28 and name   HN) (resid  28 and name  HB*)  2.67  0.97  0.96
assign (resid  28 and name   HN) (resid  28 and name   HA)  2.69  0.99  1.00
assign (resid  28 and name   HN) (resid  28 and name  HE*)  3.85  2.15  2.15
assign (resid  29 and name   HN) (resid  29 and name  HD*)  2.63  0.93  0.93
assign (resid  29 and name   HN) (resid  29 and name  HB*)  2.65  0.95  0.94
assign (resid  29 and name   HN) (resid  29 and name   HA)  2.70  1.00  1.00
assign (resid  30 and name   HN) (resid  30 and name  HB*)  2.65  0.95  0.96
assign (resid  30 and name   HN) (resid  30 and name   HA)  2.71  1.01  1.00
assign (resid  31 and name   HN) (resid  31 and name  HB*)  2.77  1.07  1.06
assign (resid  31 and name   HN) (resid  31 and name   HA)  2.71  1.01  1.02
assign (resid  32 and name   HN) (resid  32 and name  HB*)  2.80  1.10  1.10
assign (resid  32 and name   HN) (resid  32 and name   HA)  2.70  1.00  1.00
assign (resid  34 and name   HN) (resid  34 and name  HA*)  2.90  1.20  1.19
assign (resid  35 and name   HN) (resid  35 and name  HA*)  3.23  1.53  1.52
assign (resid  36 and name   HN) (resid  36 and name  HB*)  2.91  1.21  1.21
assign (resid  36 and name   HN) (resid  36 and name   HA)  2.71  1.01  1.00
assign (resid  37 and name   HN) (resid  37 and name HG2*)  3.85  2.15  2.15
assign (resid  37 and name   HN) (resid  37 and name HG1*)  3.36  1.66  1.66
assign (resid  37 and name   HN) (resid  37 and name   HB)  3.51  1.81  1.81
assign (resid  37 and name   HN) (resid  37 and name HD1*)  3.85  2.15  2.15
assign (resid  38 and name   HN) (resid  38 and name  HB*)  2.54  0.84  0.84
assign (resid  38 and name   HN) (resid  38 and name   HA)  2.76  1.06  1.06
assign (resid  39 and name   HN) (resid  39 and name HG2*)  3.74  2.04  2.04
assign (resid  40 and name   HN) (resid  40 and name  HD*)  3.80  2.10  2.10
assign (resid  40 and name   HN) (resid  40 and name   HA)  2.69  0.99  1.00
assign (resid  40 and name   HN) (resid  40 and name  HG*)  2.85  1.15  1.15
assign (resid  40 and name   HN) (resid  40 and name  HB*)  2.62  0.92  0.92
assign (resid  41 and name   HN) (resid  41 and name  HB*)  2.78  1.08  1.08
assign (resid  41 and name   HN) (resid  41 and name   HA)  2.71  1.01  1.00
assign (resid  42 and name   HN) (resid  42 and name HD1*)  3.85  2.15  2.15
assign (resid  42 and name   HN) (resid  42 and name HD2*)  3.69  1.99  1.98
assign (resid  42 and name   HN) (resid  42 and name   HA)  2.69  0.99  1.00
assign (resid  42 and name   HN) (resid  42 and name  HB*)  2.56  0.86  0.86
assign (resid  43 and name   HN) (resid  43 and name  HA*)  2.81  1.11  1.12
assign (resid  44 and name   HN) (resid  44 and name   HB)  2.59  0.89  0.89
assign (resid  44 and name   HN) (resid  44 and name HG2*)  3.65  1.95  1.94
assign (resid  45 and name   HN) (resid  45 and name HG2*)  2.84  1.14  1.14
assign (resid  45 and name   HN) (resid  45 and name HG1*)  3.33  1.64  1.63
assign (resid  45 and name   HN) (resid  45 and name   HA)  2.69  0.99  1.00
assign (resid  46 and name   HN) (resid  46 and name  HG*)  2.63  0.93  0.93
assign (resid  46 and name   HN) (resid  46 and name  HB*)  2.54  0.84  0.83
assign (resid  47 and name   HN) (resid  47 and name   HA)  2.69  0.99  0.99
assign (resid  48 and name   HN) (resid  48 and name   HA)  2.69  0.99  1.00
assign (resid  48 and name   HN) (resid  48 and name  HG*)  2.83  1.13  1.13
assign (resid  48 and name   HN) (resid  48 and name  HE*)  3.85  2.15  2.15
assign (resid  49 and name   HN) (resid  49 and name HD2*)  3.83  2.12  2.12
assign (resid  49 and name   HN) (resid  49 and name   HG)  2.71  1.01  1.02
assign (resid  49 and name   HN) (resid  49 and name HD1*)  3.85  2.15  2.15
assign (resid  50 and name   HN) (resid  50 and name  HA*)  2.83  1.13  1.13
assign (resid  51 and name   HN) (resid  51 and name   HA)  2.70  1.00  1.00
assign (resid  51 and name   HN) (resid  51 and name  HB*)  2.61  0.91  0.92
assign (resid  52 and name   HN) (resid  52 and name  HB*)  2.79  1.09  1.09
assign (resid  52 and name   HN) (resid  52 and name   HA)  2.70  1.00  1.00
assign (resid  54 and name   HN) (resid  54 and name HG2*)  2.87  1.17  1.17
assign (resid  54 and name   HN) (resid  54 and name   HA)  2.70  1.00  1.00
assign (resid  55 and name   HN) (resid  55 and name  HB*)  2.57  0.87  0.87
assign (resid  55 and name   HN) (resid  55 and name   HA)  2.69  0.99  1.00
assign (resid  56 and name   HN) (resid  56 and name  HG*)  3.18  1.48  1.48
assign (resid  56 and name   HN) (resid  56 and name   HA)  2.69  0.99  0.99
assign (resid  56 and name   HN) (resid  56 and name  HB*)  2.60  0.91  0.90
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assign (resid  59 and name   HN) (resid  59 and name   HA)  2.69  0.99  0.99
assign (resid  60 and name   HN) (resid  60 and name  HB*)  2.75  1.05  1.04
assign (resid  60 and name   HN) (resid  60 and name   HA)  2.69  0.99  1.00
assign (resid  61 and name   HN) (resid  61 and name HG1*)  2.78  1.08  1.08
assign (resid  61 and name   HN) (resid  61 and name HD1*)  3.57  1.87  1.87
assign (resid  61 and name   HN) (resid  61 and name HG2*)  3.47  1.77  1.77
assign (resid  61 and name   HN) (resid  61 and name   HB)  2.50  0.80  0.80
assign (resid  61 and name   HN) (resid  61 and name   HA)  2.70  1.00  1.00
assign (resid  62 and name   HN) (resid  62 and name   HA)  2.70  1.00  1.00
assign (resid  62 and name   HN) (resid  62 and name HG1*)  2.48  0.78  0.77
assign (resid  62 and name   HN) (resid  62 and name   HB)  2.40  0.70  0.71
assign (resid  63 and name   HN) (resid  63 and name  HG*)  3.20  1.50  1.50
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assign (resid  63 and name   HN) (resid  63 and name   HA)  2.69  0.99  0.99
assign (resid  64 and name   HN) (resid  64 and name  HG*)  2.92  1.22  1.22
assign (resid  65 and name   HN) (resid  65 and name   HA)  2.69  0.99  1.00
assign (resid  66 and name   HN) (resid  66 and name  HB*)  2.48  0.78  0.78
assign (resid  66 and name   HN) (resid  66 and name   HA)  2.71  1.01  1.00
assign (resid  67 and name   HN) (resid  67 and name  HB*)  2.67  0.97  0.97
assign (resid  67 and name   HN) (resid  67 and name   HA)  2.69  0.99  1.00
assign (resid  67 and name   HN) (resid  67 and name  HG*)  2.70  1.00  1.00
assign (resid  68 and name   HN) (resid  68 and name   HA)  2.69  0.99  1.00
assign (resid  68 and name   HN) (resid  68 and name  HB*)  2.92  1.22  1.22
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assign (resid  71 and name   HN) (resid  71 and name  HA*)  2.87  1.17  1.17
assign (resid  72 and name   HN) (resid  72 and name   HA)  2.71  1.01  1.00
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assign (resid  73 and name   HN) (resid  73 and name   HB)  2.41  0.71  0.71
assign (resid  73 and name   HN) (resid  73 and name   HA)  2.74  1.04  1.04
assign (resid  73 and name   HN) (resid  73 and name HD1*)  3.55  1.85  1.85
assign (resid  74 and name   HN) (resid  74 and name  HB*)  2.79  1.09  1.10
assign (resid  74 and name   HN) (resid  74 and name   HA)  2.73  1.03  1.02
assign (resid  75 and name   HN) (resid  75 and name   HA)  2.71  1.01  1.01
assign (resid  75 and name   HN) (resid  75 and name  HB*)  2.50  0.80  0.79
assign (resid  75 and name   HN) (resid  75 and name  HD*)  3.07  1.37  1.37
assign (resid  76 and name   HN) (resid  76 and name  HB*)  2.65  0.95  0.95
assign (resid  76 and name   HN) (resid  76 and name  HG*)  2.68  0.98  0.98
assign (resid  76 and name   HN) (resid  76 and name   HA)  2.69  0.99  1.00
assign (resid  77 and name   HN) (resid  77 and name  HG*)  2.69  0.99  0.98
assign (resid  77 and name   HN) (resid  77 and name  HB*)  2.65  0.95  0.96
assign (resid  78 and name   HN) (resid  78 and name   HA)  2.70  1.00  1.00
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assign (resid  79 and name   HN) (resid  79 and name  HB*)  2.69  0.99  0.98
assign (resid  79 and name   HN) (resid  79 and name   HG)  2.56  0.86  0.87
assign (resid  79 and name   HN) (resid  79 and name   HA)  2.69  0.99  1.00
assign (resid  80 and name   HN) (resid  80 and name HG2*)  2.79  1.09  1.09
assign (resid  80 and name   HN) (resid  80 and name   HB)  2.50  0.80  0.79
assign (resid  80 and name   HN) (resid  80 and name   HA)  2.69  0.99  0.99
assign (resid  81 and name   HN) (resid  81 and name  HE*)  3.85  2.15  2.15
assign (resid  81 and name   HN) (resid  81 and name  HB*)  2.59  0.89  0.89
assign (resid  81 and name   HN) (resid  81 and name   HA)  2.69  0.99  1.00
assign (resid  81 and name   HN) (resid  81 and name  HG*)  3.04  1.34  1.34
assign (resid  82 and name   HN) (resid  82 and name  HB*)  2.66  0.96  0.96
assign (resid  82 and name   HN) (resid  82 and name   HA)  2.69  0.99  1.00
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assign (resid  83 and name   HN) (resid  83 and name   HB)  2.44  0.74  0.73
assign (resid  83 and name   HN) (resid  83 and name HG2*)  2.85  1.15  1.15
assign (resid  83 and name   HN) (resid  83 and name   HA)  2.69  0.99  1.00
assign (resid  83 and name   HN) (resid  83 and name HG1*)  3.29  1.59  1.59
assign (resid  84 and name   HN) (resid  84 and name  HG*)  3.04  1.34  1.34
assign (resid  84 and name   HN) (resid  84 and name   HA)  2.69  0.99  0.99
assign (resid  84 and name   HN) (resid  84 and name  HB*)  2.67  0.97  0.98
assign (resid  84 and name   HN) (resid  84 and name  HD*)  3.77  2.07  2.06
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assign (resid  85 and name   HN) (resid  85 and name  HB*)  2.64  0.94  0.94
assign (resid  85 and name   HN) (resid  85 and name  HG*)  2.91  1.21  1.21
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assign (resid  86 and name   HN) (resid  86 and name   HA)  2.69  0.99  0.99
assign (resid  87 and name   HN) (resid  87 and name   HA)  2.69  0.99  0.99
assign (resid  87 and name   HN) (resid  87 and name  HG*)  2.96  1.26  1.26
assign (resid  88 and name   HN) (resid  88 and name  HB*)  2.75  1.05  1.06
assign (resid  88 and name   HN) (resid  88 and name   HA)  2.69  0.99  1.00
assign (resid  89 and name   HN) (resid  89 and name  HB*)  3.39  1.69  1.69
assign (resid  90 and name   HN) (resid  90 and name   HA)  2.71  1.01  1.01
assign (resid  90 and name   HN) (resid  90 and name  HB*)  2.70  1.00  1.00
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assign (resid   6 and name HE21) (resid   6 and name HE22)  2.17  0.47  0.48
assign (resid   7 and name HE22) (resid   7 and name HE21)  2.18  0.48  0.48
assign (resid   7 and name HE21) (resid   7 and name  HG*)  3.04  1.34  1.34
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assign (resid  51 and name HE21) (resid  51 and name  HG*)  3.33  1.64  1.63
assign (resid  51 and name HE22) (resid  51 and name HE21)  2.17  0.47  0.48
assign (resid  52 and name HD22) (resid  52 and name HD21)  2.17  0.47  0.48
assign (resid  52 and name HD21) (resid  52 and name  HB*)  3.55  1.85  1.85
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assign (resid  85 and name HE21) (resid  85 and name  HG*)  3.44  1.74  1.74
assign (resid  85 and name HE22) (resid  85 and name HE21)  2.17  0.47  0.48
assign (resid  85 and name HE22) (resid  85 and name  HG*)  3.12  1.42  1.42
assign (resid  85 and name HE22) (resid  85 and name   HA)  3.54  1.84  1.83
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assign (resid   4 and name   HN) (resid   4 and name   HB)  4.10  2.40  2.40
assign (resid   6 and name   HN) (resid   6 and name  HB*)  4.10  2.40  2.40
assign (resid   6 and name HE21) (resid   6 and name  HB*)  4.10  2.40  2.40
assign (resid   6 and name HE22) (resid   6 and name  HB*)  4.10  2.40  2.40
assign (resid   9 and name   HN) (resid   9 and name  HG*)  4.10  2.40  2.40
assign (resid   9 and name   HN) (resid   9 and name  HB*)  4.10  2.40  2.40
assign (resid   9 and name   HN) (resid   9 and name   HA)  4.10  2.40  2.40
assign (resid  10 and name   HN) (resid  10 and name   HA)  4.10  2.40  2.40
assign (resid  11 and name   HN) (resid  11 and name  HB*)  4.10  2.40  2.40
assign (resid  13 and name   HN) (resid  13 and name  HB*)  4.10  2.40  2.40
assign (resid  21 and name   HN) (resid  21 and name  HB*)  4.10  2.40  2.40
assign (resid  22 and name   HN) (resid  22 and name  HE*)  4.10  2.40  2.40
assign (resid  23 and name   HN) (resid  23 and name  HD*)  4.10  2.40  2.40
assign (resid  33 and name   HN) (resid  33 and name  HA*)  4.10  2.40  2.40
assign (resid  37 and name   HN) (resid  37 and name   HA)  4.10  2.40  2.40
assign (resid  45 and name   HN) (resid  45 and name   HB)  4.10  2.40  2.40
assign (resid  46 and name   HN) (resid  46 and name   HA)  4.10  2.40  2.40
assign (resid  47 and name   HN) (resid  47 and name  HD*)  4.10  2.40  2.40
assign (resid  47 and name   HE) (resid  47 and name  HD*)  4.10  2.40  2.40
assign (resid  48 and name   HN) (resid  48 and name  HB*)  4.10  2.40  2.40
assign (resid  51 and name HE22) (resid  51 and name   HA)  4.10  2.40  2.40
assign (resid  58 and name   HN) (resid  58 and name   HG)  4.10  2.40  2.40
assign (resid  64 and name   HN) (resid  64 and name   HA)  4.10  2.40  2.40
assign (resid  69 and name   HN) (resid  69 and name  HA*)  4.10  2.40  2.40
assign (resid  79 and name   HN) (resid  79 and name HD1*)  4.35  2.65  2.65
assign (resid  79 and name   HN) (resid  79 and name HD2*)  4.35  2.65  2.65
assign (resid  80 and name   HN) (resid  80 and name HG1*)  4.35  2.65  2.65
assign (resid  84 and name   HE) (resid  84 and name  HB*)  4.10  2.40  2.40
assign (resid  84 and name   HE) (resid  84 and name  HG*)  4.10  2.40  2.40
assign (resid  85 and name HE21) (resid  85 and name   HA)  4.10  2.40  2.40
assign (resid  87 and name   HN) (resid  87 and name  HD*)  4.10  2.40  2.40
assign (resid  88 and name   HN) (resid  88 and name  HG*)  4.10  2.40  2.40
assign (resid  89 and name   HN) (resid  89 and name   HA)  4.10  2.40  2.40
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assign (resid  12 and name   HA) (resid  12 and name  HB*)  2.50  0.80  0.79
assign (resid  25 and name   HA) (resid  25 and name  HB*)  2.50  0.80  0.80
assign (resid  31 and name   HA) (resid  31 and name  HB*)  2.49  0.79  0.79
assign (resid  41 and name   HA) (resid  41 and name  HB*)  2.50  0.80  0.80
assign (resid   8 and name   HA) (resid   8 and name  HB*)  2.50  0.80  0.79
assign (resid  27 and name   HA) (resid  27 and name  HB*)  2.79  1.09  1.10
assign (resid  30 and name   HA) (resid  30 and name  HB*)  2.63  0.93  0.94
assign (resid  32 and name   HA) (resid  32 and name  HB*)  2.60  0.90  0.90
assign (resid  36 and name   HA) (resid  36 and name  HB*)  2.62  0.92  0.92
assign (resid   5 and name   HA) (resid   5 and name  HB*)  2.65  0.95  0.95
assign (resid  59 and name   HA) (resid  59 and name  HB*)  2.79  1.09  1.10
assign (resid  66 and name   HA) (resid  66 and name  HB*)  2.69  0.99  0.99
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assign (resid  74 and name   HA) (resid  74 and name  HB*)  2.65  0.95  0.94
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assign (resid  16 and name   HA) (resid  16 and name  HG*)  3.40  1.70  1.70
assign (resid  17 and name   HA) (resid  17 and name  HB*)  2.74  1.04  1.04
assign (resid  17 and name   HA) (resid  17 and name  HG*)  2.80  1.10  1.10
assign (resid  17 and name  HG*) (resid  17 and name  HB*)  2.77  1.07  1.06
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assign (resid  21 and name   HA) (resid  21 and name  HG*)  3.02  1.32  1.31
assign (resid  21 and name  HB*) (resid  21 and name  HG*)  2.75  1.05  1.06
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assign (resid  56 and name  HB*) (resid  56 and name  HG*)  2.77  1.07  1.07
assign (resid  57 and name  HB*) (resid  57 and name   HA)  2.60  0.90  0.90
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assign (resid  64 and name   HA) (resid  64 and name  HB*)  3.14  1.44  1.44
assign (resid  64 and name   HA) (resid  64 and name  HG*)  3.33  1.64  1.63
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assign (resid  67 and name  HG*) (resid  67 and name   HA)  3.32  1.62  1.62
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assign (resid  77 and name   HA) (resid  77 and name  HG*)  2.64  0.94  0.94
assign (resid  77 and name  HB*) (resid  77 and name  HG*)  2.31  0.61  0.62
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assign (resid   9 and name   HA) (resid   9 and name  HG*)  3.44  1.74  1.74
assign (resid  13 and name   HA) (resid  13 and name  HB*)  2.63  0.93  0.94
assign (resid  22 and name   HA) (resid  22 and name  HB*)  2.72  1.02  1.02
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assign (resid  29 and name   HA) (resid  29 and name  HB*)  2.69  0.99  1.00
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assign (resid  78 and name   HA) (resid  78 and name  HB*)  2.87  1.17  1.17
assign (resid  19 and name   HA) (resid  19 and name   HB)  2.77  1.07  1.08
assign (resid  19 and name   HA) (resid  19 and name HG1*)  2.33  0.64  0.64
assign (resid  19 and name   HA) (resid  19 and name HG2*)  2.69  0.99  0.99
assign (resid  19 and name   HB) (resid  19 and name HG2*)  2.59  0.89  0.89
assign (resid  19 and name HD1*) (resid  19 and name   HA)  3.08  1.38  1.38
assign (resid  19 and name HD1*) (resid  19 and name   HB)  2.68  0.98  0.98
assign (resid  19 and name HD1*) (resid  19 and name HG1*)  2.50  0.80  0.80
assign (resid  19 and name HD1*) (resid  19 and name HG2*)  2.81  1.11  1.12
assign (resid  19 and name HG1*) (resid  19 and name HG2*)  2.52  0.82  0.83
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assign (resid  37 and name   HA) (resid  37 and name HG2*)  3.18  1.48  1.48
assign (resid  37 and name   HB) (resid  37 and name HD1*)  3.10  1.40  1.40
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assign (resid  37 and name   HB) (resid  37 and name HG2*)  3.03  1.33  1.33
assign (resid  37 and name HD1*) (resid  37 and name HG1*)  2.59  0.89  0.89
assign (resid  37 and name HD1*) (resid  37 and name HG2*)  3.23  1.53  1.53
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assign (resid  61 and name   HA) (resid  61 and name HG1*)  2.65  0.95  0.94
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assign (resid  61 and name   HB) (resid  61 and name HG2*)  2.60  0.90  0.90
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assign (resid  61 and name HG1*) (resid  61 and name   HB)  2.64  0.94  0.94
assign (resid  61 and name HG1*) (resid  61 and name HG2*)  3.01  1.31  1.31
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assign (resid  62 and name HD1*) (resid  62 and name   HA)  3.23  1.53  1.53
assign (resid  62 and name HD1*) (resid  62 and name HG1*)  2.50  0.80  0.81
assign (resid  62 and name HG2*) (resid  62 and name   HA)  2.65  0.95  0.95
assign (resid  62 and name HG2*) (resid  62 and name   HB)  2.51  0.81  0.81
assign (resid  62 and name HG2*) (resid  62 and name HG1*)  2.91  1.21  1.21
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assign (resid  73 and name   HB) (resid  73 and name HG2*)  2.62  0.93  0.92
assign (resid  73 and name HD1*) (resid  73 and name   HB)  2.80  1.10  1.10
assign (resid  73 and name HD1*) (resid  73 and name HG1*)  2.60  0.90  0.90
assign (resid  73 and name HG2*) (resid  73 and name   HA)  3.38  1.68  1.68
assign (resid  73 and name HG2*) (resid  73 and name HD1*)  3.67  1.97  1.96
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assign (resid  23 and name   HA) (resid  23 and name  HD*)  2.77  1.07  1.07
assign (resid  23 and name   HA) (resid  23 and name  HG*)  3.60  1.90  1.90
assign (resid  23 and name  HB*) (resid  23 and name  HG*)  2.73  1.03  1.04
assign (resid  23 and name  HD*) (resid  23 and name  HE*)  3.10  1.40  1.40
assign (resid  23 and name  HD*) (resid  23 and name  HG*)  2.51  0.81  0.81
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assign (resid  40 and name   HA) (resid  40 and name  HD*)  3.65  1.95  1.94
assign (resid  40 and name   HA) (resid  40 and name  HG*)  3.00  1.30  1.30
assign (resid  40 and name  HD*) (resid  40 and name  HG*)  2.43  0.73  0.73
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assign (resid  40 and name  HG*) (resid  40 and name  HB*)  2.79  1.09  1.08
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assign (resid  55 and name  HB*) (resid  55 and name   HA)  2.56  0.86  0.85
assign (resid  55 and name  HB*) (resid  55 and name  HG*)  2.69  0.99  0.98
assign (resid  55 and name  HE*) (resid  55 and name  HD*)  3.34  1.64  1.64
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assign (resid  14 and name  HB*) (resid  14 and name HD1*)  2.75  1.05  1.04
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assign (resid  14 and name HD1*) (resid  14 and name   HA)  3.27  1.57  1.57
assign (resid  14 and name HD1*) (resid  14 and name HD2*)  3.04  1.34  1.33
assign (resid  14 and name HD1*) (resid  14 and name   HG)  2.63  0.93  0.94
assign (resid  14 and name   HG) (resid  14 and name   HA)  2.57  0.87  0.87
assign (resid  14 and name   HG) (resid  14 and name  HB*)  2.70  1.00  1.00
assign (resid  14 and name   HG) (resid  14 and name HD2*)  2.72  1.02  1.02
assign (resid  49 and name   HA) (resid  49 and name HD1*)  3.85  2.15  2.15
assign (resid  49 and name   HA) (resid  49 and name HD2*)  3.04  1.34  1.34
assign (resid  49 and name   HA) (resid  49 and name   HG)  3.34  1.64  1.64
assign (resid  49 and name HD1*) (resid  49 and name HD2*)  2.67  0.97  0.98
assign (resid  49 and name HD1*) (resid  49 and name   HG)  2.69  0.99  0.98
assign (resid  49 and name   HG) (resid  49 and name HD2*)  2.75  1.05  1.04
assign (resid  58 and name   HA) (resid  58 and name  HB*)  2.56  0.86  0.86
assign (resid  58 and name   HA) (resid  58 and name HD1*)  2.97  1.27  1.27
assign (resid  58 and name   HA) (resid  58 and name   HG)  3.10  1.40  1.40
assign (resid  58 and name  HB*) (resid  58 and name HD1*)  2.77  1.07  1.08
assign (resid  58 and name   HG) (resid  58 and name HD1*)  2.52  0.82  0.83
assign (resid  79 and name   HA) (resid  79 and name  HB*)  2.75  1.05  1.06
assign (resid  79 and name   HA) (resid  79 and name HD2*)  2.57  0.87  0.87
assign (resid  79 and name  HB*) (resid  79 and name HD1*)  2.82  1.12  1.12
assign (resid  79 and name  HB*) (resid  79 and name HD2*)  3.10  1.40  1.40
assign (resid  79 and name  HB*) (resid  79 and name   HG)  2.53  0.83  0.83
assign (resid  79 and name HD1*) (resid  79 and name   HG)  2.69  0.99  0.99
assign (resid  79 and name HD2*) (resid  79 and name HD1*)  2.50  0.80  0.81
assign (resid  79 and name HD2*) (resid  79 and name   HG)  2.69  0.99  0.98
assign (resid  18 and name   HA) (resid  18 and name  HB*)  3.42  1.72  1.72
assign (resid  18 and name   HA) (resid  18 and name  HG*)  2.85  1.15  1.15
assign (resid  18 and name  HB*) (resid  18 and name  HG*)  2.65  0.95  0.95
assign (resid  18 and name  HE*) (resid  18 and name   HA)  3.85  2.15  2.15
assign (resid  18 and name  HG*) (resid  18 and name  HE*)  2.85  1.16  1.15
assign (resid  28 and name   HA) (resid  28 and name  HB*)  2.75  1.05  1.04
assign (resid  28 and name   HA) (resid  28 and name  HE*)  3.85  2.15  2.15
assign (resid  28 and name   HA) (resid  28 and name  HG*)  3.39  1.69  1.69
assign (resid  28 and name  HG*) (resid  28 and name  HB*)  2.58  0.89  0.89
assign (resid   3 and name   HA) (resid   3 and name  HB*)  3.03  1.33  1.33
assign (resid   3 and name   HA) (resid   3 and name  HE*)  3.85  2.15  2.15
assign (resid   3 and name   HA) (resid   3 and name  HG*)  3.41  1.71  1.71
assign (resid   3 and name  HB*) (resid   3 and name  HE*)  3.36  1.66  1.66
assign (resid   3 and name  HB*) (resid   3 and name  HG*)  3.52  1.82  1.82
assign (resid   3 and name  HG*) (resid   3 and name  HE*)  3.85  2.15  2.15
assign (resid  46 and name   HA) (resid  46 and name  HB*)  2.79  1.09  1.08
assign (resid  46 and name   HA) (resid  46 and name  HG*)  2.73  1.03  1.02
assign (resid  46 and name  HB*) (resid  46 and name  HG*)  2.69  0.99  1.00
assign (resid  48 and name   HA) (resid  48 and name  HB*)  2.81  1.11  1.10
assign (resid  48 and name   HA) (resid  48 and name  HE*)  3.62  1.92  1.92
assign (resid  48 and name   HA) (resid  48 and name  HG*)  2.93  1.23  1.23
assign (resid  81 and name   HA) (resid  81 and name  HB*)  2.79  1.09  1.08
assign (resid  81 and name   HA) (resid  81 and name  HG*)  3.00  1.30  1.30
assign (resid  52 and name   HA) (resid  52 and name  HB*)  2.63  0.93  0.94
assign (resid  53 and name   HA) (resid  53 and name  HB*)  2.77  1.07  1.06
assign (resid  53 and name  HG*) (resid  53 and name  HD*)  3.81  2.11  2.10
assign (resid  51 and name   HA) (resid  51 and name  HB*)  2.65  0.95  0.94
assign (resid  51 and name   HA) (resid  51 and name  HG*)  2.98  1.28  1.27
assign (resid  51 and name  HG*) (resid  51 and name  HB*)  2.77  1.07  1.07
assign (resid   6 and name   HA) (resid   6 and name  HB*)  2.77  1.07  1.06
assign (resid   6 and name   HA) (resid   6 and name  HG*)  2.94  1.24  1.24
assign (resid   6 and name  HB*) (resid   6 and name  HG*)  2.61  0.91  0.92
assign (resid   7 and name   HA) (resid   7 and name  HB*)  2.75  1.05  1.06
assign (resid   7 and name   HA) (resid   7 and name  HG*)  3.34  1.64  1.64
assign (resid   7 and name  HB*) (resid   7 and name  HG*)  3.09  1.39  1.39
assign (resid  11 and name   HA) (resid  11 and name  HD*)  3.85  2.15  2.15
assign (resid  11 and name   HA) (resid  11 and name  HG*)  2.61  0.91  0.92
assign (resid  11 and name  HB*) (resid  11 and name   HA)  3.44  1.74  1.74
assign (resid  11 and name  HB*) (resid  11 and name  HD*)  3.77  2.07  2.07
assign (resid  11 and name  HD*) (resid  11 and name  HG*)  2.69  0.99  1.00
assign (resid  47 and name  HB*) (resid  47 and name   HA)  2.77  1.07  1.08
assign (resid  47 and name  HD*) (resid  47 and name  HG*)  2.75  1.05  1.06
assign (resid  47 and name  HG*) (resid  47 and name   HA)  2.77  1.07  1.06
assign (resid  84 and name   HA) (resid  84 and name  HD*)  3.85  2.15  2.15
assign (resid  84 and name   HA) (resid  84 and name  HG*)  3.38  1.68  1.68
assign (resid  84 and name  HB*) (resid  84 and name   HA)  3.23  1.53  1.52
assign (resid  84 and name  HB*) (resid  84 and name  HD*)  3.81  2.12  2.11
assign (resid  84 and name  HD*) (resid  84 and name  HG*)  3.61  1.91  1.91
assign (resid  84 and name  HG*) (resid  84 and name  HB*)  3.10  1.40  1.40
assign (resid  15 and name   HA) (resid  15 and name  HB*)  2.58  0.88  0.88
assign (resid   2 and name   HA) (resid   2 and name  HB*)  2.79  1.09  1.10
assign (resid  38 and name   HA) (resid  38 and name  HB*)  2.56  0.86  0.86
assign (resid  70 and name   HA) (resid  70 and name  HB*)  2.75  1.05  1.04
assign (resid  39 and name   HA) (resid  39 and name   HB)  2.62  0.92  0.92
assign (resid  39 and name   HA) (resid  39 and name HG2*)  2.79  1.09  1.09
assign (resid  39 and name   HB) (resid  39 and name HG2*)  2.63  0.93  0.94
assign (resid   4 and name   HA) (resid   4 and name   HB)  2.61  0.91  0.91
assign (resid   4 and name   HA) (resid   4 and name HG2*)  2.83  1.13  1.12
assign (resid   4 and name   HB) (resid   4 and name HG2*)  2.64  0.94  0.94
assign (resid  54 and name   HA) (resid  54 and name   HB)  2.60  0.90  0.90
assign (resid  54 and name   HA) (resid  54 and name HG2*)  2.86  1.16  1.16
assign (resid  54 and name   HB) (resid  54 and name HG2*)  2.65  0.95  0.96
assign (resid  72 and name   HA) (resid  72 and name   HB)  2.63  0.93  0.94
assign (resid  72 and name   HA) (resid  72 and name HG2*)  3.04  1.34  1.33
assign (resid  72 and name   HB) (resid  72 and name HG2*)  2.74  1.04  1.04
assign (resid  65 and name   HA) (resid  65 and name HG2*)  2.77  1.07  1.06
assign (resid  65 and name   HB) (resid  65 and name   HA)  2.75  1.05  1.06
assign (resid  65 and name HG1*) (resid  65 and name   HA)  2.56  0.86  0.86
assign (resid  65 and name HG1*) (resid  65 and name   HB)  2.52  0.82  0.81
assign (resid  65 and name HG2*) (resid  65 and name   HB)  2.52  0.82  0.81
assign (resid  80 and name   HA) (resid  80 and name   HB)  2.83  1.13  1.13
assign (resid  80 and name   HA) (resid  80 and name HG1*)  2.65  0.95  0.96
assign (resid  80 and name   HA) (resid  80 and name HG2*)  2.94  1.24  1.24
assign (resid  80 and name   HB) (resid  80 and name HG1*)  2.54  0.84  0.84
assign (resid  80 and name   HB) (resid  80 and name HG2*)  2.60  0.90  0.90
assign (resid  80 and name HG1*) (resid  80 and name HG2*)  3.04  1.34  1.34
assign (resid  83 and name   HA) (resid  83 and name   HB)  2.69  0.99  1.00
assign (resid  83 and name   HA) (resid  83 and name HG1*)  2.71  1.01  1.01
assign (resid  83 and name   HA) (resid  83 and name HG2*)  2.64  0.94  0.94
assign (resid  83 and name   HB) (resid  83 and name HG1*)  2.58  0.89  0.89
assign (resid  83 and name   HB) (resid  83 and name HG2*)  2.57  0.87  0.87
assign (resid  83 and name HG1*) (resid  83 and name HG2*)  2.68  0.98  0.98
assign (resid  13 and name  HD*) (resid  13 and name   HA)  2.97  1.27  1.27
assign (resid  13 and name  HD*) (resid  13 and name  HB*)  2.96  1.26  1.25
assign (resid  13 and name  HE*) (resid  13 and name   HA)  3.85  2.15  2.15
assign (resid  13 and name  HE*) (resid  13 and name  HD*)  2.58  0.88  0.88
assign (resid  26 and name  HD*) (resid  26 and name   HA)  2.95  1.25  1.25
assign (resid  26 and name  HD*) (resid  26 and name  HB*)  2.88  1.18  1.17
assign (resid  26 and name  HE*) (resid  26 and name  HD*)  2.66  0.96  0.96
assign (resid  26 and name  HE*) (resid  26 and name   HZ)  2.62  0.93  0.92
assign (resid  26 and name   HZ) (resid  26 and name  HD*)  3.41  1.71  1.71
assign (resid  29 and name  HD*) (resid  29 and name   HA)  2.68  0.98  0.98
assign (resid  29 and name  HD*) (resid  29 and name  HB*)  2.79  1.09  1.09
assign (resid  75 and name  HD*) (resid  75 and name   HA)  2.59  0.89  0.89
assign (resid  75 and name  HD*) (resid  75 and name  HB*)  2.67  0.97  0.97
assign (resid  75 and name  HD*) (resid  75 and name  HE*)  2.60  0.90  0.90
assign (resid  75 and name  HD*) (resid  75 and name   HZ)  3.04  1.34  1.34
assign (resid  75 and name  HE*) (resid  75 and name  HB*)  3.85  2.15  2.15
assign (resid  75 and name  HE*) (resid  75 and name   HZ)  2.68  0.98  0.98
assign (resid  78 and name  HD*) (resid  78 and name   HA)  2.76  1.06  1.06
assign (resid  78 and name  HD*) (resid  78 and name  HB*)  2.87  1.17  1.17
class sequ
assign (resid   3 and name   HN) (resid   2 and name  HB*)  3.85  2.15  2.15
assign (resid   3 and name   HN) (resid   4 and name   HN)  3.85  2.15  2.15
assign (resid   3 and name   HN) (resid   2 and name   HA)  3.02  1.32  1.32
assign (resid   4 and name   HN) (resid   3 and name   HA)  2.36  0.66  0.67
assign (resid   4 and name   HN) (resid   3 and name  HG*)  3.64  1.94  1.94
assign (resid   5 and name   HN) (resid   4 and name   HB)  2.48  0.78  0.78
assign (resid   5 and name   HN) (resid   4 and name   HN)  3.36  1.66  1.66
assign (resid   5 and name   HN) (resid   6 and name   HN)  2.81  1.11  1.10
assign (resid   5 and name   HN) (resid   4 and name   HA)  2.44  0.74  0.75
assign (resid   5 and name   HN) (resid   4 and name HG2*)  3.64  1.94  1.94
assign (resid   6 and name   HN) (resid   5 and name   HA)  2.89  1.19  1.19
assign (resid   6 and name   HN) (resid   5 and name  HB*)  2.84  1.14  1.14
assign (resid   6 and name   HN) (resid   7 and name   HN)  2.71  1.01  1.01
assign (resid   7 and name   HN) (resid   8 and name   HN)  2.65  0.95  0.94
assign (resid   7 and name   HN) (resid   6 and name   HA)  3.06  1.36  1.35
assign (resid   7 and name   HN) (resid   8 and name  HB*)  3.85  2.15  2.15
assign (resid   8 and name   HN) (resid   7 and name   HA)  3.12  1.42  1.42
assign (resid   8 and name   HN) (resid   9 and name   HN)  2.86  1.16  1.16
assign (resid   8 and name   HN) (resid   7 and name  HB*)  2.91  1.21  1.21
assign (resid   8 and name   HN) (resid   7 and name  HG*)  3.74  2.04  2.04
assign (resid   9 and name   HN) (resid   8 and name  HB*)  3.29  1.59  1.58
assign (resid   9 and name   HN) (resid  10 and name   HN)  2.97  1.27  1.27
assign (resid  10 and name   HN) (resid   9 and name  HB*)  3.21  1.51  1.50
assign (resid  11 and name   HN) (resid  12 and name   HN)  2.66  0.96  0.96
assign (resid  11 and name   HN) (resid  10 and name  HB*)  2.95  1.25  1.25
assign (resid  12 and name   HN) (resid  13 and name   HN)  2.77  1.07  1.06
assign (resid  12 and name   HN) (resid  11 and name   HA)  2.98  1.28  1.27
assign (resid  13 and name   HN) (resid  14 and name HD2*)  3.85  2.15  2.15
assign (resid  13 and name   HN) (resid  14 and name   HG)  3.20  1.50  1.50
assign (resid  13 and name   HN) (resid  12 and name   HA)  2.92  1.22  1.21
assign (resid  13 and name   HN) (resid  14 and name HD1*)  3.85  2.15  2.15
assign (resid  14 and name   HN) (resid  13 and name  HB*)  2.79  1.09  1.08
assign (resid  14 and name   HN) (resid  13 and name   HA)  2.71  1.01  1.01
assign (resid  14 and name   HN) (resid  13 and name   HN)  2.52  0.82  0.82
assign (resid  15 and name   HN) (resid  14 and name  HB*)  2.86  1.16  1.16
assign (resid  15 and name   HN) (resid  14 and name HD2*)  3.27  1.57  1.57
assign (resid  15 and name   HN) (resid  14 and name   HA)  2.29  0.59  0.58
assign (resid  16 and name   HN) (resid  15 and name  HB*)  2.75  1.05  1.04
assign (resid  16 and name   HN) (resid  17 and name   HN)  2.83  1.14  1.14
assign (resid  16 and name   HN) (resid  15 and name   HA)  2.42  0.72  0.73
assign (resid  16 and name   HN) (resid  15 and name   HN)  3.60  1.91  1.90
assign (resid  17 and name   HN) (resid  18 and name   HN)  2.87  1.17  1.17
assign (resid  17 and name   HN) (resid  16 and name   HA)  3.20  1.50  1.50
assign (resid  18 and name   HN) (resid  19 and name   HN)  2.77  1.07  1.06
assign (resid  19 and name   HN) (resid  18 and name  HB*)  2.89  1.19  1.19
assign (resid  20 and name   HN) (resid  19 and name HG2*)  3.56  1.86  1.86
assign (resid  20 and name   HN) (resid  19 and name   HN)  2.79  1.09  1.09
assign (resid  20 and name   HN) (resid  19 and name   HA)  3.35  1.65  1.65
assign (resid  21 and name   HN) (resid  22 and name   HN)  2.77  1.07  1.07
assign (resid  21 and name   HN) (resid  20 and name  HB*)  3.31  1.61  1.61
assign (resid  22 and name   HN) (resid  23 and name   HN)  2.66  0.96  0.96
assign (resid  23 and name   HN) (resid  22 and name  HB*)  2.87  1.17  1.17
assign (resid  23 and name   HN) (resid  24 and name   HN)  2.58  0.89  0.89
assign (resid  23 and name   HN) (resid  22 and name   HA)  3.10  1.41  1.40
assign (resid  24 and name   HN) (resid  23 and name  HB*)  2.77  1.07  1.07
assign (resid  24 and name   HN) (resid  23 and name  HG*)  3.73  2.04  2.03
assign (resid  24 and name   HN) (resid  25 and name   HN)  2.67  0.97  0.96
assign (resid  24 and name   HN) (resid  23 and name   HA)  3.08  1.38  1.38
assign (resid  25 and name   HN) (resid  26 and name   HN)  2.73  1.03  1.02
assign (resid  25 and name   HN) (resid  24 and name  HB*)  3.14  1.44  1.44
assign (resid  25 and name   HN) (resid  26 and name  HB*)  3.98  2.28  2.27
assign (resid  26 and name   HN) (resid  27 and name   HN)  2.79  1.09  1.08
assign (resid  26 and name   HN) (resid  25 and name  HB*)  2.99  1.29  1.29
assign (resid  27 and name   HN) (resid  28 and name   HN)  2.77  1.07  1.06
assign (resid  27 and name   HN) (resid  26 and name   HA)  3.19  1.49  1.48
assign (resid  27 and name   HN) (resid  26 and name  HD*)  3.08  1.38  1.38
assign (resid  27 and name   HN) (resid  26 and name  HB*)  2.68  0.98  0.98
assign (resid  28 and name   HN) (resid  29 and name   HN)  2.81  1.11  1.10
assign (resid  29 and name   HN) (resid  30 and name   HN)  2.53  0.83  0.83
assign (resid  29 and name   HN) (resid  28 and name  HB*)  2.90  1.20  1.19
assign (resid  29 and name   HN) (resid  28 and name  HG*)  3.65  1.95  1.95
assign (resid  30 and name   HN) (resid  29 and name   HA)  2.85  1.16  1.15
assign (resid  30 and name   HN) (resid  29 and name  HB*)  3.12  1.43  1.42
assign (resid  30 and name   HN) (resid  31 and name   HN)  3.14  1.44  1.44
assign (resid  30 and name   HN) (resid  29 and name  HD*)  3.35  1.65  1.65
assign (resid  31 and name   HN) (resid  32 and name   HN)  2.87  1.17  1.17
assign (resid  31 and name   HN) (resid  30 and name   HA)  2.56  0.86  0.85
assign (resid  32 and name   HN) (resid  33 and name   HN)  2.60  0.90  0.90
assign (resid  32 and name   HN) (resid  31 and name   HA)  2.97  1.27  1.27
assign (resid  32 and name   HN) (resid  31 and name  HB*)  3.10  1.41  1.40
assign (resid  33 and name   HN) (resid  32 and name   HA)  3.06  1.36  1.35
assign (resid  33 and name   HN) (resid  32 and name  HB*)  3.61  1.91  1.91
assign (resid  34 and name   HN) (resid  35 and name   HN)  3.16  1.46  1.46
assign (resid  34 and name   HN) (resid  33 and name   HN)  3.12  1.43  1.42
assign (resid  35 and name   HN) (resid  34 and name  HA*)  3.81  2.12  2.11
assign (resid  35 and name   HN) (resid  36 and name   HN)  2.78  1.08  1.08
assign (resid  36 and name   HN) (resid  35 and name  HA*)  2.77  1.07  1.08
assign (resid  37 and name   HN) (resid  36 and name   HN)  3.85  2.15  2.15
assign (resid  37 and name   HN) (resid  36 and name  HB*)  3.38  1.68  1.68
assign (resid  37 and name   HN) (resid  36 and name   HA)  3.02  1.32  1.32
assign (resid  38 and name   HN) (resid  37 and name   HB)  2.54  0.84  0.85
assign (resid  39 and name   HN) (resid  38 and name   HA)  3.02  1.32  1.31
assign (resid  39 and name   HN) (resid  40 and name   HN)  3.11  1.41  1.41
assign (resid  40 and name   HN) (resid  41 and name   HN)  2.66  0.96  0.96
assign (resid  40 and name   HN) (resid  41 and name  HB*)  3.85  2.15  2.15
assign (resid  40 and name   HN) (resid  39 and name HG2*)  3.85  2.15  2.15
assign (resid  41 and name   HN) (resid  40 and name  HG*)  3.27  1.57  1.57
assign (resid  41 and name   HN) (resid  42 and name   HN)  2.57  0.87  0.87
assign (resid  41 and name   HN) (resid  40 and name   HA)  2.89  1.19  1.19
assign (resid  42 and name   HN) (resid  41 and name   HA)  2.98  1.28  1.27
assign (resid  42 and name   HN) (resid  43 and name   HN)  3.02  1.32  1.31
assign (resid  42 and name   HN) (resid  41 and name  HB*)  3.35  1.66  1.65
assign (resid  43 and name   HN) (resid  44 and name   HN)  2.87  1.17  1.17
assign (resid  44 and name   HN) (resid  45 and name HG2*)  3.85  2.15  2.15
assign (resid  44 and name   HN) (resid  45 and name   HN)  2.69  0.99  0.98
assign (resid  44 and name   HN) (resid  43 and name  HA*)  3.14  1.44  1.44
assign (resid  45 and name   HN) (resid  46 and name   HN)  2.64  0.94  0.94
assign (resid  45 and name   HN) (resid  44 and name   HB)  2.54  0.84  0.83
assign (resid  45 and name   HN) (resid  44 and name HG2*)  3.43  1.73  1.73
assign (resid  46 and name   HN) (resid  45 and name HG2*)  3.81  2.12  2.11
assign (resid  46 and name   HN) (resid  45 and name HG1*)  3.30  1.60  1.60
assign (resid  46 and name   HN) (resid  47 and name   HN)  2.70  1.00  1.00
assign (resid  46 and name   HN) (resid  45 and name   HA)  3.06  1.36  1.36
assign (resid  47 and name   HN) (resid  48 and name   HN)  2.70  1.00  1.00
assign (resid  47 and name   HN) (resid  46 and name  HG*)  3.36  1.66  1.66
assign (resid  48 and name   HN) (resid  49 and name   HN)  2.68  0.98  0.98
assign (resid  48 and name   HN) (resid  47 and name   HA)  3.06  1.36  1.36
assign (resid  49 and name   HN) (resid  48 and name   HA)  3.06  1.36  1.36
assign (resid  49 and name   HN) (resid  50 and name   HN)  2.87  1.17  1.17
assign (resid  50 and name   HN) (resid  49 and name HD2*)  3.85  2.15  2.15
assign (resid  50 and name   HN) (resid  51 and name   HN)  2.74  1.04  1.04
assign (resid  50 and name   HN) (resid  49 and name  HB*)  3.42  1.72  1.72
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assign (resid  69 and name   HN) (resid  68 and name  HB*)  3.85  2.15  2.15
assign (resid  70 and name   HN) (resid  71 and name   HN)  2.94  1.24  1.23
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assign (resid  73 and name   HN) (resid  72 and name HG2*)  3.15  1.45  1.44
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assign (resid  83 and name   HN) (resid  84 and name   HN)  2.71  1.01  1.02
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assign (resid  83 and name   HN) (resid  82 and name   HA)  3.06  1.36  1.36
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assign (resid  84 and name   HN) (resid  83 and name HG1*)  3.62  1.93  1.92
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assign (resid  84 and name   HN) (resid  85 and name   HN)  2.77  1.07  1.08
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assign (resid  89 and name   HN) (resid  88 and name   HA)  3.03  1.33  1.33
assign (resid  89 and name   HN) (resid  90 and name   HN)  3.00  1.30  1.30
assign (resid  90 and name   HN) (resid  89 and name  HB*)  3.06  1.36  1.35
assign (resid  90 and name   HN) (resid  89 and name   HA)  2.53  0.83  0.83
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assign (resid   9 and name   HN) (resid   8 and name   HA)  4.10  2.40  2.40
assign (resid  10 and name   HN) (resid   9 and name   HA)  4.10  2.40  2.40
assign (resid  11 and name   HN) (resid  12 and name   HA)  4.10  2.40  2.40
assign (resid  12 and name   HN) (resid  13 and name   HA)  4.10  2.40  2.40
assign (resid  12 and name   HN) (resid  11 and name  HB*)  4.10  2.40  2.40
assign (resid  12 and name   HN) (resid  11 and name  HG*)  4.10  2.40  2.40
assign (resid  14 and name   HN) (resid  15 and name   HN)  4.10  2.40  2.40
assign (resid  18 and name   HN) (resid  19 and name   HA)  4.10  2.40  2.40
assign (resid  18 and name   HN) (resid  19 and name HG2*)  4.35  2.65  2.65
assign (resid  20 and name   HN) (resid  21 and name  HB*)  4.10  2.40  2.40
assign (resid  20 and name   HN) (resid  21 and name  HG*)  4.10  2.40  2.40
assign (resid  21 and name   HN) (resid  22 and name  HD*)  4.10  2.40  2.40
assign (resid  21 and name   HN) (resid  22 and name  HB*)  4.10  2.40  2.40
assign (resid  22 and name   HN) (resid  23 and name   HA)  4.10  2.40  2.40
assign (resid  22 and name   HN) (resid  21 and name  HB*)  4.10  2.40  2.40
assign (resid  22 and name   HN) (resid  21 and name  HG*)  4.10  2.40  2.40
assign (resid  24 and name   HN) (resid  23 and name  HD*)  4.10  2.40  2.40
assign (resid  27 and name   HN) (resid  28 and name   HA)  4.10  2.40  2.40
assign (resid  27 and name   HN) (resid  28 and name  HB*)  4.10  2.40  2.40
assign (resid  28 and name   HN) (resid  27 and name  HB*)  4.10  2.40  2.40
assign (resid  28 and name   HN) (resid  29 and name   HA)  4.10  2.40  2.40
assign (resid  28 and name   HN) (resid  29 and name  HD*)  4.10  2.40  2.40
assign (resid  29 and name   HN) (resid  30 and name   HA)  4.10  2.40  2.40
assign (resid  29 and name   HN) (resid  28 and name   HA)  4.10  2.40  2.40
assign (resid  30 and name   HN) (resid  31 and name  HB*)  4.35  2.65  2.65
assign (resid  31 and name   HN) (resid  30 and name  HB*)  4.10  2.40  2.40
assign (resid  32 and name   HN) (resid  33 and name  HA*)  4.10  2.40  2.40
assign (resid  36 and name   HN) (resid  37 and name HG2*)  4.35  2.65  2.65
assign (resid  38 and name   HN) (resid  37 and name   HA)  4.10  2.40  2.40
assign (resid  38 and name   HN) (resid  37 and name HG2*)  4.35  2.65  2.65
assign (resid  39 and name   HN) (resid  38 and name   HN)  4.10  2.40  2.40
assign (resid  41 and name   HN) (resid  40 and name  HB*)  4.10  2.40  2.40
assign (resid  43 and name   HN) (resid  42 and name HD1*)  4.35  2.65  2.65
assign (resid  43 and name   HN) (resid  42 and name   HA)  4.10  2.40  2.40
assign (resid  44 and name   HN) (resid  45 and name HG1*)  4.35  2.65  2.65
assign (resid  45 and name   HN) (resid  46 and name  HG*)  4.10  2.40  2.40
assign (resid  46 and name   HN) (resid  47 and name   HA)  4.10  2.40  2.40
assign (resid  47 and name   HN) (resid  48 and name   HA)  4.10  2.40  2.40
assign (resid  48 and name   HN) (resid  49 and name HD1*)  4.35  2.65  2.65
assign (resid  48 and name   HN) (resid  49 and name HD2*)  4.35  2.65  2.65
assign (resid  49 and name   HN) (resid  50 and name  HA*)  4.10  2.40  2.40
assign (resid  49 and name   HN) (resid  48 and name  HB*)  4.10  2.40  2.40
assign (resid  50 and name   HN) (resid  51 and name  HB*)  4.10  2.40  2.40
assign (resid  50 and name   HN) (resid  49 and name HD1*)  4.35  2.65  2.65
assign (resid  54 and name   HN) (resid  55 and name   HN)  4.10  2.40  2.40
assign (resid  55 and name   HN) (resid  56 and name   HN)  4.10  2.40  2.40
assign (resid  58 and name   HN) (resid  59 and name  HB*)  4.10  2.40  2.40
assign (resid  58 and name   HN) (resid  59 and name   HA)  4.10  2.40  2.40
assign (resid  59 and name   HN) (resid  60 and name   HA)  4.10  2.40  2.40
assign (resid  60 and name   HN) (resid  61 and name   HA)  4.10  2.40  2.40
assign (resid  60 and name   HN) (resid  61 and name HG2*)  4.35  2.65  2.65
assign (resid  61 and name   HN) (resid  62 and name   HA)  4.10  2.40  2.40
assign (resid  62 and name   HN) (resid  61 and name   HB)  4.10  2.40  2.40
assign (resid  63 and name   HN) (resid  62 and name HG1*)  4.10  2.40  2.40
assign (resid  65 and name   HN) (resid  66 and name  HB*)  4.10  2.40  2.40
assign (resid  65 and name   HN) (resid  64 and name   HA)  4.10  2.40  2.40
assign (resid  67 and name   HN) (resid  66 and name  HB*)  4.10  2.40  2.40
assign (resid  69 and name   HN) (resid  68 and name   HA)  4.10  2.40  2.40
assign (resid  70 and name   HN) (resid  69 and name  HA*)  4.10  2.40  2.40
assign (resid  71 and name   HN) (resid  70 and name  HB*)  4.10  2.40  2.40
assign (resid  72 and name   HN) (resid  73 and name   HN)  4.10  2.40  2.40
assign (resid  73 and name   HN) (resid  74 and name   HN)  4.10  2.40  2.40
assign (resid  74 and name   HN) (resid  73 and name HG2*)  4.35  2.65  2.65
assign (resid  76 and name   HN) (resid  77 and name   HA)  4.10  2.40  2.40
assign (resid  77 and name   HN) (resid  78 and name  HB*)  4.10  2.40  2.40
assign (resid  80 and name   HN) (resid  81 and name   HA)  4.10  2.40  2.40
assign (resid  81 and name   HN) (resid  82 and name  HB*)  4.10  2.40  2.40
assign (resid  82 and name   HN) (resid  83 and name   HA)  4.10  2.40  2.40
assign (resid  82 and name   HN) (resid  83 and name   HB)  4.10  2.40  2.40
assign (resid  83 and name   HN) (resid  84 and name  HB*)  4.10  2.40  2.40
assign (resid  86 and name   HN) (resid  85 and name  HB*)  4.10  2.40  2.40
assign (resid  86 and name   HN) (resid  87 and name   HA)  4.10  2.40  2.40
assign (resid  87 and name   HN) (resid  86 and name  HB*)  4.10  2.40  2.40
assign (resid  88 and name   HN) (resid  87 and name  HG*)  4.10  2.40  2.40
assign (resid  88 and name   HN) (resid  87 and name   HN)  4.10  2.40  2.40
assign (resid   1 and name  HB*) (resid   2 and name  HB*)  3.85  2.15  2.15
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assign (resid  24 and name  HB*) (resid  23 and name   HA)  3.85  2.15  2.15
assign (resid  31 and name  HB*) (resid  32 and name   HA)  3.70  2.00  2.00
assign (resid  64 and name  HB*) (resid  65 and name HG2*)  3.85  2.15  2.15
assign (resid  37 and name   HA) (resid  38 and name   HA)  3.06  1.36  1.36
assign (resid  61 and name HG2*) (resid  62 and name   HA)  3.37  1.67  1.67
assign (resid   3 and name   HA) (resid   2 and name   HA)  3.27  1.57  1.56
assign (resid   3 and name   HA) (resid   4 and name   HA)  3.49  1.79  1.79
assign (resid   3 and name   HA) (resid   4 and name HG2*)  3.85  2.15  2.15
assign (resid  46 and name   HA) (resid  45 and name HG1*)  3.85  2.15  2.15
assign (resid  52 and name   HA) (resid  53 and name  HD*)  2.38  0.68  0.68
assign (resid   2 and name   HA) (resid   1 and name   HA)  3.67  1.97  1.97
assign (resid   2 and name   HA) (resid   3 and name  HB*)  3.85  2.15  2.15
assign (resid  38 and name   HA) (resid  39 and name HG2*)  3.85  2.15  2.15
assign (resid  80 and name HG1*) (resid  81 and name   HA)  3.85  2.15  2.15
assign (resid  83 and name HG1*) (resid  84 and name   HA)  3.73  2.04  2.03
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assign (resid  13 and name   HA) (resid  12 and name  HB*)  4.10  2.40  2.40
assign (resid  61 and name   HA) (resid  60 and name  HB*)  4.10  2.40  2.40
assign (resid  48 and name   HA) (resid  49 and name HD2*)  4.10  2.40  2.40
assign (resid  53 and name   HA) (resid  54 and name HG2*)  4.10  2.40  2.40
assign (resid   2 and name   HA) (resid   3 and name  HE*)  4.10  2.40  2.40
assign (resid  45 and name HG2*) (resid  44 and name HG2*)  4.10  2.40  2.40
assign (resid  80 and name HG1*) (resid  81 and name  HE*)  4.10  2.40  2.40
assign (resid  13 and name  HD*) (resid  14 and name HD1*)  3.85  2.15  2.15
assign (resid  13 and name  HD*) (resid  14 and name HD2*)  3.56  1.86  1.86
assign (resid  13 and name  HE*) (resid  14 and name HD2*)  3.85  2.15  2.15
assign (resid  26 and name  HD*) (resid  27 and name   HA)  3.17  1.47  1.47
assign (resid  29 and name  HD*) (resid  28 and name  HB*)  3.05  1.35  1.35
class medium
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assign (resid   6 and name   HN) (resid   4 and name   HB)  2.96  1.26  1.25
assign (resid   7 and name   HN) (resid   5 and name   HA)  3.53  1.83  1.83
assign (resid   7 and name   HN) (resid   4 and name HG2*)  3.85  2.15  2.15
assign (resid   8 and name   HN) (resid   5 and name  HB*)  3.33  1.64  1.63
assign (resid   8 and name   HN) (resid   5 and name   HA)  3.12  1.42  1.42
assign (resid   9 and name   HN) (resid   5 and name   HA)  3.54  1.84  1.84
assign (resid  10 and name   HN) (resid   8 and name   HN)  3.85  2.15  2.15
assign (resid  10 and name   HN) (resid   7 and name   HA)  3.45  1.75  1.75
assign (resid  12 and name   HN) (resid   9 and name   HA)  2.94  1.24  1.24
assign (resid  13 and name   HN) (resid  11 and name   HN)  3.52  1.82  1.82
assign (resid  13 and name   HN) (resid  11 and name  HB*)  3.56  1.86  1.86
assign (resid  13 and name   HN) (resid  10 and name   HA)  3.01  1.31  1.31
assign (resid  13 and name   HN) (resid  11 and name   HA)  3.27  1.57  1.57
assign (resid  14 and name   HN) (resid  11 and name   HA)  2.95  1.25  1.25
assign (resid  15 and name   HN) (resid  18 and name  HB*)  2.96  1.26  1.26
assign (resid  15 and name   HN) (resid  18 and name   HN)  3.09  1.39  1.39
assign (resid  17 and name   HN) (resid  19 and name   HN)  3.29  1.59  1.59
assign (resid  17 and name   HN) (resid  15 and name   HA)  3.37  1.67  1.67
assign (resid  17 and name   HN) (resid  15 and name  HB*)  2.98  1.28  1.28
assign (resid  18 and name   HN) (resid  15 and name  HB*)  3.50  1.80  1.79
assign (resid  20 and name   HN) (resid  22 and name   HN)  3.59  1.89  1.89
assign (resid  20 and name   HN) (resid  16 and name   HA)  3.30  1.60  1.60
assign (resid  20 and name   HN) (resid  17 and name   HA)  3.07  1.37  1.37
assign (resid  21 and name   HN) (resid  18 and name   HA)  3.12  1.43  1.42
assign (resid  22 and name   HN) (resid  18 and name   HA)  3.17  1.47  1.46
assign (resid  24 and name   HN) (resid  22 and name   HA)  3.44  1.74  1.74
assign (resid  25 and name   HN) (resid  27 and name   HN)  3.72  2.02  2.02
assign (resid  25 and name   HN) (resid  22 and name   HA)  3.16  1.46  1.46
assign (resid  25 and name   HN) (resid  23 and name   HN)  3.65  1.95  1.95
assign (resid  26 and name   HN) (resid  22 and name   HA)  3.33  1.64  1.63
assign (resid  26 and name   HN) (resid  23 and name   HA)  2.95  1.25  1.25
assign (resid  27 and name   HN) (resid  23 and name   HA)  3.11  1.41  1.41
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assign (resid  14 and name HD2*) (resid  18 and name  HB*)  3.83  2.13  2.13
assign (resid  49 and name  HB*) (resid  46 and name   HA)  3.62  1.92  1.92
assign (resid  49 and name HD1*) (resid  46 and name   HA)  3.17  1.47  1.46
assign (resid  58 and name   HA) (resid  61 and name HD1*)  3.08  1.38  1.38
assign (resid  79 and name HD1*) (resid  76 and name   HA)  2.92  1.22  1.21
assign (resid  18 and name   HA) (resid  21 and name  HB*)  2.89  1.19  1.19
assign (resid  18 and name  HE*) (resid  14 and name HD2*)  3.85  2.15  2.15
assign (resid  53 and name  HG*) (resid  58 and name HD1*)  3.85  2.15  2.15
assign (resid  11 and name  HB*) (resid   8 and name   HA)  3.85  2.15  2.15
assign (resid  11 and name  HD*) (resid   7 and name  HB*)  3.47  1.77  1.77
assign (resid  84 and name  HB*) (resid  81 and name   HA)  3.85  2.15  2.15
assign (resid  84 and name  HD*) (resid  81 and name   HA)  3.85  2.15  2.15
assign (resid  84 and name  HD*) (resid  80 and name HG1*)  3.85  2.15  2.15
assign (resid  38 and name  HB*) (resid  40 and name  HB*)  3.22  1.52  1.52
assign (resid  39 and name   HA) (resid  42 and name  HB*)  3.25  1.55  1.55
assign (resid  39 and name   HA) (resid  42 and name HD1*)  3.72  2.02  2.02
assign (resid  39 and name   HA) (resid  42 and name HD2*)  3.85  2.15  2.15
assign (resid  39 and name   HA) (resid  42 and name   HG)  3.14  1.44  1.44
assign (resid  39 and name   HB) (resid  42 and name HD1*)  3.85  2.15  2.15
assign (resid  65 and name HG1*) (resid  62 and name   HA)  3.85  2.15  2.15
assign (resid  65 and name HG2*) (resid  62 and name   HA)  2.74  1.04  1.04
assign (resid  80 and name   HA) (resid  83 and name   HB)  2.72  1.02  1.02
assign (resid  80 and name   HA) (resid  83 and name HG2*)  3.69  1.99  1.98
assign (resid  80 and name   HB) (resid  77 and name   HA)  2.60  0.91  0.90
assign (resid  83 and name   HA) (resid  86 and name  HB*)  2.94  1.24  1.23
assign (resid  83 and name   HA) (resid  86 and name  HE*)  3.85  2.15  2.15
assign (resid  10 and name  HB*) (resid  14 and name HD1*)  4.10  2.40  2.40
assign (resid  41 and name  HB*) (resid  44 and name   HB)  4.10  2.40  2.40
assign (resid   8 and name   HA) (resid  11 and name  HD*)  4.10  2.40  2.40
assign (resid  27 and name   HA) (resid  30 and name  HB*)  4.10  2.40  2.40
assign (resid  56 and name   HA) (resid  60 and name  HB*)  4.10  2.40  2.40
assign (resid  19 and name   HA) (resid  22 and name  HB*)  4.10  2.40  2.40
assign (resid  23 and name  HB*) (resid  20 and name   HA)  4.10  2.40  2.40
assign (resid  87 and name  HD*) (resid  83 and name HG1*)  4.10  2.40  2.40
assign (resid  87 and name  HE*) (resid  83 and name HG1*)  4.10  2.40  2.40
assign (resid  87 and name  HG*) (resid  83 and name HG1*)  4.10  2.40  2.40
assign (resid  42 and name   HA) (resid  45 and name HG1*)  4.10  2.40  2.40
assign (resid  42 and name   HA) (resid  45 and name HG2*)  4.10  2.40  2.40
assign (resid  42 and name HD1*) (resid  45 and name HG2*)  4.10  2.40  2.40
assign (resid  42 and name HD2*) (resid  39 and name HG2*)  4.10  2.40  2.40
assign (resid  42 and name HD2*) (resid  45 and name HG2*)  4.10  2.40  2.40
assign (resid  49 and name HD1*) (resid  45 and name HG1*)  4.10  2.40  2.40
assign (resid   3 and name  HG*) (resid   8 and name  HB*)  4.10  2.40  2.40
assign (resid  52 and name   HA) (resid  47 and name  HG*)  4.10  2.40  2.40
assign (resid  51 and name  HG*) (resid  46 and name  HE*)  4.10  2.40  2.40
assign (resid  44 and name HG2*) (resid  48 and name  HE*)  4.10  2.40  2.40
assign (resid  45 and name   HA) (resid  48 and name  HE*)  4.10  2.40  2.40
assign (resid  45 and name   HB) (resid  42 and name   HA)  4.10  2.40  2.40
assign (resid  45 and name HG1*) (resid  48 and name  HE*)  4.10  2.40  2.40
assign (resid  45 and name HG2*) (resid  49 and name HD2*)  4.10  2.40  2.40
assign (resid  45 and name HG2*) (resid  48 and name  HE*)  4.10  2.40  2.40
assign (resid  80 and name   HA) (resid  83 and name HG1*)  4.10  2.40  2.40
assign (resid  80 and name HG1*) (resid  84 and name  HB*)  4.10  2.40  2.40
assign (resid  83 and name HG1*) (resid  86 and name  HE*)  4.10  2.40  2.40
assign (resid  83 and name HG2*) (resid  86 and name  HE*)  4.10  2.40  2.40
assign (resid  26 and name  HD*) (resid  23 and name   HA)  3.85  2.15  2.15
assign (resid  29 and name  HD*) (resid  26 and name   HA)  2.98  1.28  1.28
assign (resid  75 and name  HD*) (resid  78 and name  HB*)  3.31  1.61  1.61
assign (resid  75 and name  HD*) (resid  79 and name HD1*)  3.85  2.15  2.15
assign (resid  75 and name  HD*) (resid  79 and name HD2*)  3.85  2.15  2.15
assign (resid  75 and name  HE*) (resid  79 and name HD1*)  3.39  1.69  1.69
assign (resid  75 and name  HE*) (resid  79 and name HD2*)  3.38  1.68  1.68
assign (resid  75 and name   HZ) (resid  79 and name HD1*)  3.85  2.15  2.15
assign (resid  75 and name   HZ) (resid  79 and name HD2*)  3.58  1.89  1.88
assign (resid  78 and name  HD*) (resid  82 and name  HE*)  3.85  2.15  2.15
class long
assign (resid   7 and name   HN) (resid  80 and name HG2*)  3.60  1.90  1.90
assign (resid  10 and name   HN) (resid  80 and name HG2*)  3.85  2.15  2.15
assign (resid  13 and name   HN) (resid  83 and name HG2*)  3.85  2.15  2.15
assign (resid  22 and name   HN) (resid  79 and name HD2*)  3.85  2.15  2.15
assign (resid  23 and name   HN) (resid  75 and name  HE*)  2.94  1.24  1.23
assign (resid  23 and name   HN) (resid  79 and name HD2*)  3.85  2.15  2.15
assign (resid  23 and name   HN) (resid  75 and name   HZ)  2.75  1.05  1.05
assign (resid  26 and name   HN) (resid  75 and name  HE*)  3.23  1.53  1.53
assign (resid  36 and name   HN) (resid  26 and name   HZ)  3.11  1.41  1.41
assign (resid  36 and name   HN) (resid  26 and name  HE*)  3.39  1.69  1.69
assign (resid  37 and name   HN) (resid  74 and name   HN)  3.85  2.15  2.15
assign (resid  37 and name   HN) (resid  74 and name   HA)  3.77  2.07  2.07
assign (resid  37 and name   HN) (resid  73 and name   HB)  3.53  1.83  1.83
assign (resid  37 and name   HN) (resid  73 and name   HN)  3.08  1.38  1.38
assign (resid  37 and name   HN) (resid  72 and name   HB)  3.85  2.15  2.15
assign (resid  37 and name   HN) (resid  26 and name   HZ)  3.77  2.07  2.06
assign (resid  39 and name   HN) (resid  72 and name   HA)  3.66  1.96  1.96
assign (resid  45 and name   HN) (resid  29 and name  HD*)  3.54  1.84  1.83
assign (resid  67 and name   HN) (resid  77 and name  HG*)  3.35  1.66  1.65
assign (resid  73 and name   HN) (resid  36 and name  HB*)  3.46  1.76  1.76
assign (resid  73 and name   HN) (resid  38 and name   HA)  2.93  1.23  1.23
assign (resid  75 and name   HN) (resid  26 and name   HZ)  2.83  1.13  1.13
assign (resid  75 and name   HN) (resid  36 and name   HA)  3.15  1.45  1.45
assign (resid  75 and name   HN) (resid  26 and name  HE*)  3.04  1.34  1.33
assign (resid  80 and name   HN) (resid   7 and name   HA)  3.54  1.84  1.84
assign (resid  80 and name   HN) (resid  10 and name  HB*)  3.73  2.03  2.03
assign (resid   6 and name HE22) (resid  65 and name   HA)  3.45  1.75  1.75
assign (resid   6 and name HE21) (resid  65 and name   HA)  3.15  1.45  1.45
assign (resid   6 and name HE21) (resid  80 and name HG1*)  3.85  2.15  2.15
assign (resid   6 and name HE22) (resid  80 and name HG1*)  3.85  2.15  2.15
assign (resid   7 and name HE22) (resid  77 and name  HG*)  3.00  1.30  1.29
assign (resid   7 and name HE21) (resid  77 and name  HG*)  3.01  1.31  1.31
assign (resid   6 and name   HN) (resid  80 and name HG1*)  4.35  2.65  2.65
assign (resid   6 and name   HN) (resid  80 and name HG2*)  4.35  2.65  2.65
assign (resid   6 and name HE21) (resid  65 and name HG2*)  4.35  2.65  2.65
assign (resid   6 and name HE21) (resid  80 and name HG2*)  4.35  2.65  2.65
assign (resid   8 and name   HN) (resid  80 and name HG2*)  4.35  2.65  2.65
assign (resid  10 and name   HN) (resid  83 and name HG2*)  4.35  2.65  2.65
assign (resid  10 and name   HN) (resid  80 and name   HA)  4.10  2.40  2.40
assign (resid  22 and name   HN) (resid  75 and name   HZ)  4.10  2.40  2.40
assign (resid  22 and name   HN) (resid  75 and name  HE*)  4.10  2.40  2.40
assign (resid  23 and name   HN) (resid  75 and name  HD*)  4.10  2.40  2.40
assign (resid  24 and name   HN) (resid  75 and name  HE*)  4.10  2.40  2.40
assign (resid  26 and name   HN) (resid  75 and name  HD*)  4.10  2.40  2.40
assign (resid  27 and name   HN) (resid  75 and name  HE*)  4.10  2.40  2.40
assign (resid  27 and name   HN) (resid  75 and name  HD*)  4.10  2.40  2.40
assign (resid  29 and name   HN) (resid  37 and name HD1*)  4.35  2.65  2.65
assign (resid  29 and name   HN) (resid  45 and name HG2*)  4.35  2.65  2.65
assign (resid  29 and name   HN) (resid  37 and name HG2*)  4.35  2.65  2.65
assign (resid  29 and name   HN) (resid  45 and name HG1*)  4.35  2.65  2.65
assign (resid  30 and name   HN) (resid  37 and name HG2*)  4.35  2.65  2.65
assign (resid  36 and name   HN) (resid  74 and name   HA)  4.10  2.40  2.40
assign (resid  37 and name   HN) (resid  26 and name  HE*)  4.10  2.40  2.40
assign (resid  37 and name   HN) (resid  30 and name   HA)  4.10  2.40  2.40
assign (resid  37 and name   HN) (resid  72 and name HG2*)  4.35  2.65  2.65
assign (resid  39 and name   HN) (resid  73 and name   HN)  4.10  2.40  2.40
assign (resid  45 and name   HN) (resid  37 and name HD1*)  4.35  2.65  2.65
assign (resid  51 and name HE22) (resid  82 and name  HE*)  4.35  2.65  2.65
assign (resid  51 and name HE21) (resid  82 and name  HE*)  4.35  2.65  2.65
assign (resid  66 and name   HN) (resid  73 and name HD1*)  4.35  2.65  2.65
assign (resid  71 and name   HN) (resid  39 and name HG2*)  4.35  2.65  2.65
assign (resid  73 and name   HN) (resid  39 and name   HB)  4.10  2.40  2.40
assign (resid  73 and name   HN) (resid  37 and name   HA)  4.10  2.40  2.40
assign (resid  78 and name   HN) (resid  26 and name  HD*)  4.10  2.40  2.40
assign (resid  79 and name   HN) (resid  10 and name  HB*)  4.35  2.65  2.65
assign (resid  83 and name   HN) (resid  10 and name  HB*)  4.35  2.65  2.65
assign (resid  83 and name   HN) (resid  10 and name   HA)  4.10  2.40  2.40
assign (resid  85 and name   HN) (resid  61 and name HD1*)  4.35  2.65  2.65
assign (resid  85 and name HE21) (resid  61 and name HD1*)  4.35  2.65  2.65
assign (resid  85 and name HE22) (resid  61 and name HD1*)  4.35  2.65  2.65
assign (resid  10 and name   HA) (resid  83 and name HG1*)  2.82  1.12  1.12
assign (resid  10 and name   HA) (resid  83 and name HG2*)  2.75  1.05  1.04
assign (resid  10 and name  HB*) (resid  80 and name   HA)  2.67  0.97  0.98
assign (resid  10 and name  HB*) (resid  80 and name HG1*)  3.56  1.86  1.86
assign (resid  10 and name  HB*) (resid  80 and name HG2*)  2.93  1.23  1.23
assign (resid  10 and name  HB*) (resid  83 and name HG2*)  3.02  1.32  1.31
assign (resid  25 and name  HB*) (resid  49 and name HD1*)  3.71  2.00  2.00
assign (resid  25 and name  HB*) (resid  49 and name HD2*)  3.19  1.49  1.49
assign (resid  41 and name  HB*) (resid  29 and name  HB*)  3.85  2.15  2.15
assign (resid  30 and name   HA) (resid  37 and name HG2*)  3.65  1.95  1.94
assign (resid  30 and name  HB*) (resid  37 and name HG2*)  3.85  2.15  2.15
assign (resid  36 and name   HA) (resid  74 and name   HA)  2.62  0.92  0.92
assign (resid  36 and name  HB*) (resid  72 and name   HB)  2.75  1.05  1.05
assign (resid  66 and name   HA) (resid  73 and name HD1*)  3.52  1.82  1.81
assign (resid  74 and name   HA) (resid  36 and name  HB*)  3.05  1.35  1.35
assign (resid  13 and name  HB*) (resid  83 and name HG1*)  3.72  2.02  2.02
assign (resid  13 and name  HB*) (resid  83 and name HG2*)  3.62  1.92  1.92
assign (resid  22 and name   HA) (resid  49 and name HD1*)  3.33  1.63  1.62
assign (resid  22 and name   HA) (resid  49 and name HD2*)  3.57  1.87  1.87
assign (resid  19 and name   HA) (resid  79 and name HD2*)  3.21  1.51  1.51
assign (resid  19 and name HD1*) (resid  79 and name HD1*)  3.46  1.76  1.75
assign (resid  19 and name HD1*) (resid  79 and name HD2*)  3.85  2.15  2.15
assign (resid  19 and name HD1*) (resid  11 and name   HA)  3.16  1.46  1.46
assign (resid  19 and name HD1*) (resid  11 and name  HD*)  3.85  2.15  2.15
assign (resid  19 and name HG2*) (resid  79 and name HD1*)  3.10  1.40  1.40
assign (resid  19 and name HG2*) (resid  79 and name HD2*)  3.58  1.88  1.88
assign (resid  37 and name HD1*) (resid  73 and name   HB)  3.85  2.15  2.15
assign (resid  37 and name HD1*) (resid  73 and name HG2*)  3.85  2.15  2.15
assign (resid  37 and name HD1*) (resid  45 and name HG1*)  3.85  2.15  2.15
assign (resid  37 and name HD1*) (resid  45 and name HG2*)  3.64  1.94  1.94
assign (resid  37 and name HG2*) (resid  29 and name  HB*)  3.85  2.15  2.15
assign (resid  37 and name HG2*) (resid  45 and name HG2*)  3.85  2.15  2.15
assign (resid  61 and name HD1*) (resid  46 and name  HE*)  3.34  1.64  1.64
assign (resid  61 and name HG2*) (resid  42 and name   HG)  3.85  2.15  2.15
assign (resid  61 and name HG2*) (resid  81 and name  HG*)  2.94  1.24  1.24
assign (resid  62 and name   HA) (resid  73 and name HD1*)  3.85  2.15  2.15
assign (resid  62 and name HD1*) (resid  39 and name   HB)  2.85  1.15  1.15
assign (resid  62 and name HD1*) (resid  39 and name HG2*)  3.85  2.15  2.15
assign (resid  62 and name HG2*) (resid  39 and name   HB)  2.96  1.26  1.25
assign (resid  73 and name HD1*) (resid  39 and name   HA)  3.49  1.79  1.79
assign (resid  73 and name HD1*) (resid  39 and name HG2*)  3.06  1.36  1.36
assign (resid  23 and name  HE*) (resid  75 and name  HB*)  3.52  1.82  1.81
assign (resid  14 and name HD1*) (resid  79 and name   HA)  3.85  2.15  2.15
assign (resid  14 and name HD1*) (resid  79 and name HD2*)  2.88  1.18  1.18
assign (resid  14 and name HD1*) (resid  83 and name HG2*)  2.87  1.17  1.17
assign (resid  14 and name HD2*) (resid  79 and name HD2*)  3.85  2.15  2.15
assign (resid  14 and name HD2*) (resid  83 and name HG2*)  3.73  2.03  2.02
assign (resid  14 and name   HG) (resid  83 and name HG2*)  3.00  1.30  1.29
assign (resid  49 and name  HB*) (resid  82 and name  HE*)  3.85  2.15  2.15
assign (resid  49 and name HD1*) (resid  82 and name  HE*)  3.37  1.67  1.67
assign (resid  58 and name HD2*) (resid  43 and name  HA*)  3.73  2.03  2.02
assign (resid  79 and name HD1*) (resid  11 and name  HD*)  3.85  2.15  2.15
assign (resid  79 and name HD2*) (resid  22 and name  HB*)  3.04  1.34  1.34
assign (resid  46 and name  HG*) (resid  58 and name HD1*)  3.63  1.93  1.93
assign (resid  81 and name   HA) (resid  65 and name HG1*)  3.15  1.45  1.45
assign (resid   6 and name  HB*) (resid  80 and name HG1*)  3.71  2.01  2.01
assign (resid   6 and name  HB*) (resid  80 and name HG2*)  3.79  2.09  2.09
assign (resid   7 and name   HA) (resid  80 and name HG2*)  3.00  1.30  1.30
assign (resid   7 and name  HG*) (resid  80 and name HG2*)  3.85  2.15  2.15
assign (resid  11 and name   HA) (resid  79 and name HD1*)  3.85  2.15  2.15
assign (resid  84 and name  HD*) (resid  65 and name HG1*)  3.85  2.15  2.15
assign (resid  38 and name   HA) (resid  72 and name   HA)  2.91  1.21  1.21
assign (resid  38 and name   HA) (resid  72 and name HG2*)  3.27  1.57  1.57
assign (resid  39 and name   HA) (resid  73 and name HG1*)  3.69  1.99  1.98
assign (resid  39 and name HG2*) (resid  71 and name  HA*)  3.85  2.15  2.15
assign (resid  39 and name HG2*) (resid  72 and name   HA)  3.31  1.61  1.61
assign (resid  65 and name HG1*) (resid  77 and name   HA)  3.47  1.77  1.77
assign (resid  65 and name HG1*) (resid  73 and name HD1*)  3.85  2.15  2.15
assign (resid  65 and name HG1*) (resid  73 and name HG2*)  3.85  2.15  2.15
assign (resid  65 and name HG1*) (resid  39 and name HG2*)  3.85  2.15  2.15
assign (resid  65 and name HG2*) (resid  73 and name HD1*)  3.23  1.53  1.53
assign (resid  80 and name HG1*) (resid  65 and name   HA)  3.25  1.55  1.55
assign (resid  83 and name   HB) (resid  10 and name  HB*)  3.38  1.68  1.67
assign (resid  10 and name  HB*) (resid  82 and name  HB*)  4.10  2.40  2.40
assign (resid  25 and name  HB*) (resid  45 and name HG1*)  4.10  2.40  2.40
assign (resid  25 and name  HB*) (resid  45 and name HG2*)  4.10  2.40  2.40
assign (resid  26 and name   HA) (resid  45 and name HG2*)  4.10  2.40  2.40
assign (resid  29 and name  HB*) (resid  37 and name HD1*)  4.10  2.40  2.40
assign (resid  19 and name HD1*) (resid  11 and name  HG*)  4.10  2.40  2.40
assign (resid  37 and name HD1*) (resid  26 and name   HA)  4.10  2.40  2.40
assign (resid  62 and name HD1*) (resid  39 and name   HA)  4.10  2.40  2.40
assign (resid  62 and name HG2*) (resid  73 and name HD1*)  4.10  2.40  2.40
assign (resid  62 and name HG2*) (resid  39 and name HG2*)  4.10  2.40  2.40
assign (resid  73 and name HD1*) (resid  66 and name  HB*)  4.10  2.40  2.40
assign (resid  73 and name HD1*) (resid  42 and name HD1*)  4.10  2.40  2.40
assign (resid  73 and name HD1*) (resid  81 and name  HE*)  4.10  2.40  2.40
assign (resid  73 and name HG2*) (resid  42 and name HD1*)  4.10  2.40  2.40
assign (resid  73 and name HG2*) (resid  81 and name  HE*)  4.10  2.40  2.40
assign (resid  42 and name HD2*) (resid  62 and name   HA)  4.10  2.40  2.40
assign (resid  42 and name HD2*) (resid  73 and name HD1*)  4.10  2.40  2.40
assign (resid  42 and name HD2*) (resid  73 and name HG2*)  4.10  2.40  2.40
assign (resid  79 and name HD1*) (resid  11 and name  HB*)  4.10  2.40  2.40
assign (resid  79 and name HD1*) (resid  11 and name  HG*)  4.10  2.40  2.40
assign (resid  79 and name HD2*) (resid  10 and name  HB*)  4.10  2.40  2.40
assign (resid  82 and name  HE*) (resid  46 and name   HA)  4.10  2.40  2.40
assign (resid  51 and name  HG*) (resid  82 and name  HE*)  4.10  2.40  2.40
assign (resid   6 and name  HG*) (resid  80 and name HG1*)  4.10  2.40  2.40
assign (resid   6 and name  HG*) (resid  80 and name HG2*)  4.10  2.40  2.40
assign (resid   7 and name  HB*) (resid  80 and name HG2*)  4.10  2.40  2.40
assign (resid  85 and name  HG*) (resid  46 and name  HE*)  4.10  2.40  2.40
assign (resid  38 and name  HB*) (resid  72 and name HG2*)  4.10  2.40  2.40
assign (resid  72 and name HG2*) (resid  36 and name  HB*)  4.10  2.40  2.40
assign (resid  45 and name HG2*) (resid  28 and name  HE*)  4.10  2.40  2.40
assign (resid  65 and name HG2*) (resid  73 and name HG2*)  4.10  2.40  2.40
assign (resid  80 and name HG2*) (resid  65 and name HG2*)  4.10  2.40  2.40
assign (resid  83 and name HG1*) (resid  10 and name  HB*)  4.10  2.40  2.40
assign (resid  83 and name HG1*) (resid  14 and name HD1*)  4.10  2.40  2.40
assign (resid  83 and name HG1*) (resid  14 and name HD2*)  4.10  2.40  2.40
assign (resid  13 and name  HD*) (resid  83 and name HG1*)  3.84  2.14  2.14
assign (resid  13 and name  HE*) (resid  86 and name  HE*)  3.83  2.13  2.13
assign (resid  13 and name  HE*) (resid  83 and name HG1*)  3.85  2.15  2.15
assign (resid  26 and name  HD*) (resid  37 and name HD1*)  3.85  2.15  2.15
assign (resid  26 and name  HE*) (resid  36 and name   HA)  2.92  1.22  1.22
assign (resid  26 and name  HE*) (resid  74 and name   HA)  2.97  1.27  1.27
assign (resid  26 and name  HE*) (resid  75 and name  HB*)  3.10  1.40  1.40
assign (resid  26 and name  HE*) (resid  37 and name HG2*)  3.85  2.15  2.15
assign (resid  26 and name   HZ) (resid  36 and name   HA)  2.64  0.94  0.94
assign (resid  26 and name   HZ) (resid  74 and name   HA)  2.71  1.01  1.02
assign (resid  29 and name  HD*) (resid  41 and name  HB*)  3.62  1.93  1.92
assign (resid  29 and name  HD*) (resid  37 and name HD1*)  3.85  2.15  2.15
assign (resid  29 and name  HD*) (resid  37 and name HG1*)  3.18  1.48  1.48
assign (resid  29 and name  HD*) (resid  37 and name HG2*)  3.85  2.15  2.15
assign (resid  29 and name  HD*) (resid  42 and name HD1*)  3.85  2.15  2.15
assign (resid  29 and name  HD*) (resid  44 and name HG2*)  3.41  1.71  1.71
assign (resid  29 and name  HD*) (resid  45 and name HG1*)  3.22  1.52  1.52
assign (resid  29 and name  HD*) (resid  45 and name HG2*)  3.85  2.15  2.15
assign (resid  75 and name  HD*) (resid  26 and name  HB*)  3.10  1.41  1.40
assign (resid  75 and name  HD*) (resid  26 and name  HD*)  2.89  1.19  1.19
assign (resid  75 and name  HD*) (resid  23 and name   HA)  3.15  1.45  1.44
assign (resid  75 and name  HE*) (resid  22 and name  HB*)  3.44  1.74  1.74
assign (resid  75 and name  HE*) (resid  26 and name  HB*)  3.28  1.58  1.58
assign (resid  75 and name  HE*) (resid  19 and name HG2*)  3.06  1.36  1.36
assign (resid  75 and name  HE*) (resid  23 and name   HA)  2.65  0.95  0.96
assign (resid  75 and name  HE*) (resid  23 and name  HB*)  3.19  1.49  1.49
assign (resid  75 and name   HZ) (resid  19 and name   HA)  3.65  1.95  1.94
assign (resid  75 and name   HZ) (resid  19 and name HG2*)  3.20  1.50  1.50
assign (resid  75 and name   HZ) (resid  23 and name   HA)  3.21  1.51  1.50
assign (resid  75 and name   HZ) (resid  23 and name  HB*)  3.15  1.45  1.45
assign (resid  78 and name  HD*) (resid  42 and name HD1*)  3.85  2.15  2.15

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   1           HT1      ALA   1  66.182  13.029  15.202
    2   2H    ALA   1           HT3      ALA   1  65.846  11.450  14.683
    3   3H    ALA   1           HT2      ALA   1  65.846  11.816  16.342
    4    HA   ALA   1           HA       ALA   1  68.164  12.105  16.406
    5   1HB   ALA   1           HB1      ALA   1  66.952   9.695  15.493
    6   2HB   ALA   1           HB3      ALA   1  68.486   9.867  14.641
    7   3HB   ALA   1           HB2      ALA   1  68.452   9.873  16.404
    8    H    SER   2           HN       SER   2  67.492  11.090  13.030
    9    HA   SER   2           HA       SER   2  69.325  13.265  12.133
   10   1HB   SER   2           HB2      SER   2  70.699  11.287  12.095
   11   2HB   SER   2           HB1      SER   2  69.420  10.345  11.335
   12    HG   SER   2           HG       SER   2  71.149  11.227   9.935
   13    H    MET   3           HN       MET   3  69.099  13.576   9.684
   14    HA   MET   3           HA       MET   3  66.625  12.626   8.453
   15   1HB   MET   3           HB2      MET   3  65.635  14.358   9.810
   16   2HB   MET   3           HB1      MET   3  66.900  15.504   9.363
   17   1HG   MET   3           HG2      MET   3  66.071  15.780   7.196
   18   2HG   MET   3           HG1      MET   3  65.223  14.233   7.217
   19   1HE   MET   3           HE3      MET   3  65.812  17.125   9.333
   20   2HE   MET   3           HE2      MET   3  64.307  18.029   9.473
   21   3HE   MET   3           HE1      MET   3  64.608  16.663  10.545
   22    H    THR   4           HN       THR   4  68.067  11.978   6.777
   23    HA   THR   4           HA       THR   4  69.836  13.936   5.515
   24    HB   THR   4           HB       THR   4  69.825  11.927   3.743
   25    HG1  THR   4           HG1      THR   4  69.598  10.068   5.434
   26   1HG2  THR   4          HG23      THR   4  71.733  12.686   5.135
   27   2HG2  THR   4          HG22      THR   4  71.101  11.745   6.487
   28   3HG2  THR   4          HG21      THR   4  71.657  10.927   5.027
   29    H    ASP   5           HN       ASP   5  69.562  14.771   3.370
   30    HA   ASP   5           HA       ASP   5  66.846  15.478   2.703
   31   1HB   ASP   5           HB2      ASP   5  69.387  15.730   1.064
   32   2HB   ASP   5           HB1      ASP   5  67.856  16.528   0.702
   33    H    GLN   6           HN       GLN   6  69.041  12.950   1.640
   34    HA   GLN   6           HA       GLN   6  67.700  12.213  -0.767
   35   1HB   GLN   6           HB2      GLN   6  68.824  10.059  -0.532
   36   2HB   GLN   6           HB1      GLN   6  69.938  11.348  -0.074
   37   1HG   GLN   6           HG2      GLN   6  69.765  10.863   2.212
   38   2HG   GLN   6           HG1      GLN   6  68.230  10.018   2.015
   39   1HE2  GLN   6          HE22      GLN   6  71.369   7.905   0.444
   40   2HE2  GLN   6          HE21      GLN   6  71.103   9.511  -0.040
   41    H    GLN   7           HN       GLN   7  66.941  11.640   2.598
   42    HA   GLN   7           HA       GLN   7  65.000   9.530   2.051
   43   1HB   GLN   7           HB2      GLN   7  65.605  11.224   4.484
   44   2HB   GLN   7           HB1      GLN   7  64.312  10.024   4.460
   45   1HG   GLN   7           HG2      GLN   7  65.833   8.232   4.117
   46   2HG   GLN   7           HG1      GLN   7  67.144   9.326   3.675
   47   1HE2  GLN   7          HE22      GLN   7  68.109   8.685   7.081
   48   2HE2  GLN   7          HE21      GLN   7  68.347   8.151   5.487
   49    H    ALA   8           HN       ALA   8  64.991  13.001   2.060
   50    HA   ALA   8           HA       ALA   8  62.154  13.366   2.481
   51   1HB   ALA   8           HB1      ALA   8  64.187  15.135   1.087
   52   2HB   ALA   8           HB3      ALA   8  62.555  15.631   1.534
   53   3HB   ALA   8           HB2      ALA   8  63.727  15.222   2.787
   54    H    GLU   9           HN       GLU   9  64.190  13.023  -0.420
   55    HA   GLU   9           HA       GLU   9  61.902  13.313  -2.218
   56   1HB   GLU   9           HB2      GLU   9  64.817  12.654  -2.552
   57   2HB   GLU   9           HB1      GLU   9  63.696  12.374  -3.885
   58   1HG   GLU   9           HG2      GLU   9  63.280  14.620  -4.194
   59   2HG   GLU   9           HG1      GLU   9  63.550  15.011  -2.495
   60    H    ALA  10           HN       ALA  10  63.730  10.663  -0.775
   61    HA   ALA  10           HA       ALA  10  62.771   8.533  -2.385
   62   1HB   ALA  10           HB3      ALA  10  63.742   8.745   0.449
   63   2HB   ALA  10           HB2      ALA  10  63.043   7.227  -0.114
   64   3HB   ALA  10           HB1      ALA  10  64.465   7.894  -0.915
   65    H    ARG  11           HN       ARG  11  61.496   9.545   0.815
   66    HA   ARG  11           HA       ARG  11  59.127   7.949   0.614
   67   1HB   ARG  11           HB2      ARG  11  59.941  10.307   2.295
   68   2HB   ARG  11           HB1      ARG  11  58.283   9.710   2.358
   69   1HG   ARG  11           HG2      ARG  11  58.878   7.782   3.427
   70   2HG   ARG  11           HG1      ARG  11  60.388   7.632   2.528
   71   1HD   ARG  11           HD2      ARG  11  60.648   8.129   5.010
   72   2HD   ARG  11           HD1      ARG  11  61.481   9.244   3.927
   73    HE   ARG  11           HE       ARG  11  58.877   9.869   5.262
   74   1HH1  ARG  11          HH21      ARG  11  59.109  11.778   3.210
   75   2HH1  ARG  11          HH22      ARG  11  60.175  12.998   3.821
   76   1HH2  ARG  11          HH11      ARG  11  61.464  10.987   6.334
   77   2HH2  ARG  11          HH12      ARG  11  61.509  12.550   5.590
   78    H    ALA  12           HN       ALA  12  60.001  10.975  -0.805
   79    HA   ALA  12           HA       ALA  12  57.300  11.966  -1.196
   80   1HB   ALA  12           HB3      ALA  12  60.022  12.677  -2.219
   81   2HB   ALA  12           HB2      ALA  12  58.615  13.280  -3.095
   82   3HB   ALA  12           HB1      ALA  12  58.837  13.690  -1.394
   83    H    PHE  13           HN       PHE  13  59.501   9.897  -3.022
   84    HA   PHE  13           HA       PHE  13  57.673   9.841  -5.335
   85   1HB   PHE  13           HB2      PHE  13  60.118   9.783  -5.700
   86   2HB   PHE  13           HB1      PHE  13  60.215   8.276  -4.789
   87    HD1  PHE  13           HD1      PHE  13  58.828   9.859  -7.849
   88    HD2  PHE  13           HD2      PHE  13  59.596   6.183  -5.765
   89    HE1  PHE  13           HE1      PHE  13  58.266   8.581  -9.899
   90    HE2  PHE  13           HE2      PHE  13  59.035   4.904  -7.816
   91    HZ   PHE  13           HZ       PHE  13  58.370   6.102  -9.883
   92    H    LEU  14           HN       LEU  14  58.435   7.919  -2.510
   93    HA   LEU  14           HA       LEU  14  56.939   5.590  -3.521
   94   1HB   LEU  14           HB2      LEU  14  58.019   6.068  -0.730
   95   2HB   LEU  14           HB1      LEU  14  57.553   4.523  -1.443
   96    HG   LEU  14           HG       LEU  14  59.694   6.236  -2.699
   97   1HD1  LEU  14          HD12      LEU  14  60.228   5.744  -0.274
   98   2HD1  LEU  14          HD11      LEU  14  60.161   4.028  -0.678
   99   3HD1  LEU  14          HD13      LEU  14  61.374   5.064  -1.429
  100   1HD2  LEU  14          HD23      LEU  14  58.552   3.529  -3.031
  101   2HD2  LEU  14          HD22      LEU  14  59.356   4.562  -4.212
  102   3HD2  LEU  14          HD21      LEU  14  60.314   3.598  -3.087
  103    H    SER  15           HN       SER  15  54.801   5.230  -3.108
  104    HA   SER  15           HA       SER  15  53.261   7.301  -1.744
  105   1HB   SER  15           HB2      SER  15  51.315   5.934  -2.353
  106   2HB   SER  15           HB1      SER  15  52.386   6.109  -3.739
  107    HG   SER  15           HG       SER  15  51.669   3.931  -3.348
  108    H    GLU  16           HN       GLU  16  51.971   6.949   0.167
  109    HA   GLU  16           HA       GLU  16  53.242   5.698   2.325
  110   1HB   GLU  16           HB2      GLU  16  50.523   6.722   1.783
  111   2HB   GLU  16           HB1      GLU  16  50.619   5.522   3.074
  112   1HG   GLU  16           HG2      GLU  16  52.708   7.633   3.095
  113   2HG   GLU  16           HG1      GLU  16  51.071   8.157   3.488
  114    H    GLU  17           HN       GLU  17  50.966   4.320  -0.001
  115    HA   GLU  17           HA       GLU  17  50.574   1.834   1.407
  116   1HB   GLU  17           HB2      GLU  17  49.973   2.913  -1.289
  117   2HB   GLU  17           HB1      GLU  17  50.140   1.159  -1.189
  118   1HG   GLU  17           HG2      GLU  17  48.464   1.048   0.570
  119   2HG   GLU  17           HG1      GLU  17  48.368   2.808   0.635
  120    H    MET  18           HN       MET  18  52.903   2.928  -1.034
  121    HA   MET  18           HA       MET  18  54.096   0.345  -1.477
  122   1HB   MET  18           HB2      MET  18  54.403   2.916  -2.532
  123   2HB   MET  18           HB1      MET  18  55.954   2.572  -1.763
  124   1HG   MET  18           HG2      MET  18  56.216   0.538  -3.023
  125   2HG   MET  18           HG1      MET  18  54.566   0.640  -3.636
  126   1HE   MET  18           HE2      MET  18  53.635   2.240  -5.038
  127   2HE   MET  18           HE1      MET  18  54.475   2.972  -6.403
  128   3HE   MET  18           HE3      MET  18  54.428   1.212  -6.230
  129    H    ILE  19           HN       ILE  19  55.301   3.141   0.418
  130    HA   ILE  19           HA       ILE  19  57.515   1.970   1.612
  131    HB   ILE  19           HB       ILE  19  55.482   3.902   2.745
  132   1HG1  ILE  19          HG12      ILE  19  58.194   4.847   2.413
  133   2HG1  ILE  19          HG11      ILE  19  57.621   4.118   0.911
  134   1HG2  ILE  19          HG23      ILE  19  57.871   2.630   4.023
  135   2HG2  ILE  19          HG22      ILE  19  57.561   4.336   4.344
  136   3HG2  ILE  19          HG21      ILE  19  56.343   3.127   4.750
  137   1HD1  ILE  19          HD11      ILE  19  55.620   5.813   2.239
  138   2HD1  ILE  19          HD13      ILE  19  57.061   6.689   1.724
  139   3HD1  ILE  19          HD12      ILE  19  56.117   5.775   0.547
  140    H    ALA  20           HN       ALA  20  54.110   1.522   2.489
  141    HA   ALA  20           HA       ALA  20  54.494   0.099   4.916
  142   1HB   ALA  20           HB1      ALA  20  52.336   0.040   2.810
  143   2HB   ALA  20           HB3      ALA  20  52.268  -1.034   4.207
  144   3HB   ALA  20           HB2      ALA  20  52.266   0.715   4.438
  145    H    GLU  21           HN       GLU  21  54.279  -1.118   1.563
  146    HA   GLU  21           HA       GLU  21  54.600  -3.878   2.221
  147   1HB   GLU  21           HB2      GLU  21  55.075  -2.236  -0.255
  148   2HB   GLU  21           HB1      GLU  21  55.581  -3.925  -0.212
  149   1HG   GLU  21           HG2      GLU  21  53.116  -4.251   0.764
  150   2HG   GLU  21           HG1      GLU  21  52.828  -2.767  -0.145
  151    H    PHE  22           HN       PHE  22  57.017  -1.432   1.237
  152    HA   PHE  22           HA       PHE  22  59.307  -3.063   1.301
  153   1HB   PHE  22           HB2      PHE  22  59.092  -0.179   2.221
  154   2HB   PHE  22           HB1      PHE  22  60.576  -1.002   1.741
  155    HD1  PHE  22           HD1      PHE  22  59.366  -2.646  -0.534
  156    HD2  PHE  22           HD2      PHE  22  59.040   1.509   0.506
  157    HE1  PHE  22           HE1      PHE  22  58.910  -2.087  -2.907
  158    HE2  PHE  22           HE2      PHE  22  58.583   2.067  -1.866
  159    HZ   PHE  22           HZ       PHE  22  58.519   0.270  -3.573
  160    H    LYS  23           HN       LYS  23  57.426  -1.759   3.959
  161    HA   LYS  23           HA       LYS  23  59.376  -2.151   6.028
  162   1HB   LYS  23           HB2      LYS  23  57.332  -0.789   6.339
  163   2HB   LYS  23           HB1      LYS  23  56.349  -2.248   6.212
  164   1HG   LYS  23           HG2      LYS  23  56.659  -1.785   8.562
  165   2HG   LYS  23           HG1      LYS  23  57.646  -3.191   8.162
  166   1HD   LYS  23           HD2      LYS  23  59.640  -1.804   7.998
  167   2HD   LYS  23           HD1      LYS  23  58.682  -0.343   8.252
  168   1HE   LYS  23           HE2      LYS  23  58.205  -2.304  10.349
  169   2HE   LYS  23           HE1      LYS  23  59.915  -1.882  10.237
  170   1HZ   LYS  23           HZ1      LYS  23  58.633   0.502   9.969
  171   2HZ   LYS  23           HZ3      LYS  23  57.704  -0.301  11.140
  172   3HZ   LYS  23           HZ2      LYS  23  59.370  -0.075  11.387
  173    H    ALA  24           HN       ALA  24  56.888  -4.267   4.635
  174    HA   ALA  24           HA       ALA  24  57.045  -6.418   6.446
  175   1HB   ALA  24           HB3      ALA  24  56.584  -6.345   3.460
  176   2HB   ALA  24           HB2      ALA  24  56.491  -7.841   4.388
  177   3HB   ALA  24           HB1      ALA  24  55.382  -6.515   4.740
  178    H    ALA  25           HN       ALA  25  59.130  -5.683   3.652
  179    HA   ALA  25           HA       ALA  25  60.744  -8.070   3.975
  180   1HB   ALA  25           HB1      ALA  25  60.447  -6.294   1.955
  181   2HB   ALA  25           HB3      ALA  25  61.935  -5.681   2.673
  182   3HB   ALA  25           HB2      ALA  25  61.853  -7.349   2.107
  183    H    PHE  26           HN       PHE  26  60.960  -4.735   5.140
  184    HA   PHE  26           HA       PHE  26  63.613  -4.726   6.085
  185   1HB   PHE  26           HB2      PHE  26  61.904  -2.814   6.132
  186   2HB   PHE  26           HB1      PHE  26  61.308  -3.527   7.632
  187    HD1  PHE  26           HD1      PHE  26  64.728  -3.013   6.166
  188    HD2  PHE  26           HD2      PHE  26  62.089  -2.366   9.493
  189    HE1  PHE  26           HE1      PHE  26  66.574  -1.929   7.420
  190    HE2  PHE  26           HE2      PHE  26  63.934  -1.282  10.746
  191    HZ   PHE  26           HZ       PHE  26  66.177  -1.065   9.710
  192    H    ASP  27           HN       ASP  27  60.702  -5.557   8.012
  193    HA   ASP  27           HA       ASP  27  62.061  -6.495  10.295
  194   1HB   ASP  27           HB2      ASP  27  59.389  -7.084   9.070
  195   2HB   ASP  27           HB1      ASP  27  59.943  -8.082  10.416
  196    H    MET  28           HN       MET  28  61.546  -8.049   7.193
  197    HA   MET  28           HA       MET  28  62.060 -10.743   7.918
  198   1HB   MET  28           HB2      MET  28  61.630  -9.375   5.547
  199   2HB   MET  28           HB1      MET  28  63.291  -9.945   5.379
  200   1HG   MET  28           HG2      MET  28  60.935 -11.692   6.152
  201   2HG   MET  28           HG1      MET  28  61.637 -11.606   4.537
  202   1HE   MET  28           HE2      MET  28  64.194 -11.652   4.231
  203   2HE   MET  28           HE1      MET  28  64.821 -11.086   5.777
  204   3HE   MET  28           HE3      MET  28  65.306 -12.666   5.147
  205    H    PHE  29           HN       PHE  29  64.394  -8.307   6.703
  206    HA   PHE  29           HA       PHE  29  66.654 -10.010   7.438
  207   1HB   PHE  29           HB2      PHE  29  66.523  -7.127   6.507
  208   2HB   PHE  29           HB1      PHE  29  68.013  -8.046   6.719
  209    HD1  PHE  29           HD2      PHE  29  64.834  -7.865   4.806
  210    HD2  PHE  29           HD1      PHE  29  68.720  -9.670   5.107
  211    HE1  PHE  29           HE2      PHE  29  64.559  -8.837   2.541
  212    HE2  PHE  29           HE1      PHE  29  68.446 -10.639   2.845
  213    HZ   PHE  29           HZ       PHE  29  66.365 -10.225   1.561
  214    H    ASP  30           HN       ASP  30  64.648  -7.837   9.106
  215    HA   ASP  30           HA       ASP  30  66.739  -7.006  11.018
  216   1HB   ASP  30           HB2      ASP  30  64.700  -5.589  10.204
  217   2HB   ASP  30           HB1      ASP  30  63.791  -6.528  11.388
  218    H    ALA  31           HN       ALA  31  66.826  -9.621  11.213
  219    HA   ALA  31           HA       ALA  31  64.832 -10.829  12.922
  220   1HB   ALA  31           HB2      ALA  31  67.157 -11.675  11.515
  221   2HB   ALA  31           HB1      ALA  31  67.381 -12.120  13.206
  222   3HB   ALA  31           HB3      ALA  31  65.960 -12.683  12.328
  223    H    ASP  32           HN       ASP  32  67.463  -8.695  13.507
  224    HA   ASP  32           HA       ASP  32  67.942  -9.531  16.263
  225   1HB   ASP  32           HB2      ASP  32  69.048  -7.599  14.393
  226   2HB   ASP  32           HB1      ASP  32  68.803  -6.877  15.983
  227    H    GLY  33           HN       GLY  33  65.824  -7.273  14.614
  228   1HA   GLY  33           HA2      GLY  33  63.858  -6.282  15.500
  229   2HA   GLY  33           HA1      GLY  33  64.296  -6.907  17.091
  230    H    GLY  34           HN       GLY  34  66.838  -5.281  15.483
  231   1HA   GLY  34           HA2      GLY  34  66.573  -3.030  17.397
  232   2HA   GLY  34           HA1      GLY  34  68.028  -3.438  16.486
  233    H    GLY  35           HN       GLY  35  66.199  -3.751  14.032
  234   1HA   GLY  35           HA2      GLY  35  65.077  -2.288  12.490
  235   2HA   GLY  35           HA1      GLY  35  65.456  -0.926  13.545
  236    H    ASP  36           HN       ASP  36  67.753  -3.371  12.411
  237    HA   ASP  36           HA       ASP  36  68.891  -1.539  10.419
  238   1HB   ASP  36           HB2      ASP  36  71.051  -1.299  11.478
  239   2HB   ASP  36           HB1      ASP  36  69.828  -0.774  12.637
  240    H    ILE  37           HN       ILE  37  69.902  -2.719   8.834
  241    HA   ILE  37           HA       ILE  37  70.489  -5.586   9.453
  242    HB   ILE  37           HB       ILE  37  68.730  -5.822   7.976
  243   1HG1  ILE  37          HG12      ILE  37  71.108  -5.381   6.145
  244   2HG1  ILE  37          HG11      ILE  37  70.589  -6.910   6.857
  245   1HG2  ILE  37          HG21      ILE  37  69.654  -3.225   6.731
  246   2HG2  ILE  37          HG23      ILE  37  68.347  -4.203   6.066
  247   3HG2  ILE  37          HG22      ILE  37  68.191  -3.502   7.676
  248   1HD1  ILE  37          HD11      ILE  37  68.324  -6.411   5.658
  249   2HD1  ILE  37          HD13      ILE  37  69.280  -5.301   4.679
  250   3HD1  ILE  37          HD12      ILE  37  69.674  -7.020   4.701
  251    H    SER  38           HN       SER  38  72.130  -6.493   7.826
  252    HA   SER  38           HA       SER  38  74.423  -4.642   7.766
  253   1HB   SER  38           HB2      SER  38  74.017  -7.572   7.588
  254   2HB   SER  38           HB1      SER  38  75.358  -6.934   6.639
  255    HG   SER  38           HG       SER  38  74.975  -7.027   9.390
  256    H    THR  39           HN       THR  39  75.345  -3.822   5.892
  257    HA   THR  39           HA       THR  39  73.741  -3.555   3.551
  258    HB   THR  39           HB       THR  39  76.062  -2.909   2.514
  259    HG1  THR  39           HG1      THR  39  77.523  -2.378   4.258
  260   1HG2  THR  39          HG22      THR  39  74.836  -1.467   4.880
  261   2HG2  THR  39          HG21      THR  39  75.990  -0.742   3.761
  262   3HG2  THR  39          HG23      THR  39  74.406  -1.259   3.182
  263    H    LYS  40           HN       LYS  40  76.012  -6.011   4.544
  264    HA   LYS  40           HA       LYS  40  76.452  -7.137   1.912
  265   1HB   LYS  40           HB2      LYS  40  76.733  -8.315   4.693
  266   2HB   LYS  40           HB1      LYS  40  77.230  -9.145   3.218
  267   1HG   LYS  40           HG2      LYS  40  78.733  -7.234   2.683
  268   2HG   LYS  40           HG1      LYS  40  78.281  -6.479   4.212
  269   1HD   LYS  40           HD2      LYS  40  80.167  -7.594   4.922
  270   2HD   LYS  40           HD1      LYS  40  78.989  -8.886   5.156
  271   1HE   LYS  40           HE2      LYS  40  80.281 -10.134   3.786
  272   2HE   LYS  40           HE1      LYS  40  79.690  -9.116   2.472
  273   1HZ   LYS  40           HZ2      LYS  40  81.751  -7.789   3.874
  274   2HZ   LYS  40           HZ1      LYS  40  82.291  -9.328   3.398
  275   3HZ   LYS  40           HZ3      LYS  40  81.696  -8.245   2.238
  276    H    ALA  41           HN       ALA  41  74.003  -7.511   4.399
  277    HA   ALA  41           HA       ALA  41  72.829  -9.906   3.229
  278   1HB   ALA  41           HB3      ALA  41  72.572  -9.294   5.639
  279   2HB   ALA  41           HB2      ALA  41  71.596  -7.909   5.151
  280   3HB   ALA  41           HB1      ALA  41  71.024  -9.547   4.834
  281    H    LEU  42           HN       LEU  42  72.804  -6.606   2.420
  282    HA   LEU  42           HA       LEU  42  70.142  -6.285   1.438
  283   1HB   LEU  42           HB2      LEU  42  72.728  -4.915   1.125
  284   2HB   LEU  42           HB1      LEU  42  71.665  -4.768  -0.275
  285    HG   LEU  42           HG       LEU  42  69.897  -3.847   1.052
  286   1HD1  LEU  42          HD11      LEU  42  71.637  -4.528   3.443
  287   2HD1  LEU  42          HD13      LEU  42  70.132  -3.614   3.523
  288   3HD1  LEU  42          HD12      LEU  42  70.113  -5.301   3.010
  289   1HD2  LEU  42          HD23      LEU  42  71.952  -2.405   0.502
  290   2HD2  LEU  42          HD22      LEU  42  70.878  -1.807   1.767
  291   3HD2  LEU  42          HD21      LEU  42  72.395  -2.597   2.198
  292    H    GLY  43           HN       GLY  43  73.066  -7.636  -0.069
  293   1HA   GLY  43           HA2      GLY  43  72.169  -7.904  -2.714
  294   2HA   GLY  43           HA1      GLY  43  73.219  -9.084  -1.923
  295    H    THR  44           HN       THR  44  71.307  -9.738   0.162
  296    HA   THR  44           HA       THR  44  69.769 -11.747  -1.273
  297    HB   THR  44           HB       THR  44  69.849 -10.929   1.645
  298    HG1  THR  44           HG1      THR  44  70.998 -12.879   1.802
  299   1HG2  THR  44          HG21      THR  44  67.797 -12.312   0.341
  300   2HG2  THR  44          HG23      THR  44  68.787 -13.574   1.072
  301   3HG2  THR  44          HG22      THR  44  68.109 -12.294   2.077
  302    H    VAL  45           HN       VAL  45  69.069  -8.649   0.313
  303    HA   VAL  45           HA       VAL  45  66.218  -8.860   0.240
  304    HB   VAL  45           HB       VAL  45  67.872  -6.333  -0.039
  305   1HG1  VAL  45          HG13      VAL  45  65.104  -6.763  -0.111
  306   2HG1  VAL  45          HG12      VAL  45  65.427  -6.224   1.537
  307   3HG1  VAL  45          HG11      VAL  45  65.917  -5.223   0.170
  308   1HG2  VAL  45          HG23      VAL  45  68.128  -8.141   1.986
  309   2HG2  VAL  45          HG22      VAL  45  68.341  -6.404   2.197
  310   3HG2  VAL  45          HG21      VAL  45  66.798  -7.157   2.596
  311    H    MET  46           HN       MET  46  68.590  -7.943  -2.200
  312    HA   MET  46           HA       MET  46  66.835  -6.740  -4.082
  313   1HB   MET  46           HB2      MET  46  69.388  -8.325  -4.419
  314   2HB   MET  46           HB1      MET  46  68.550  -7.584  -5.783
  315   1HG   MET  46           HG2      MET  46  68.978  -5.813  -3.449
  316   2HG   MET  46           HG1      MET  46  70.440  -6.300  -4.306
  317   1HE   MET  46           HE1      MET  46  68.638  -3.494  -3.863
  318   2HE   MET  46           HE3      MET  46  70.315  -3.449  -4.425
  319   3HE   MET  46           HE2      MET  46  69.054  -2.622  -5.335
  320    H    ARG  47           HN       ARG  47  68.171 -10.026  -4.519
  321    HA   ARG  47           HA       ARG  47  66.349 -10.960  -6.385
  322   1HB   ARG  47           HB2      ARG  47  68.052 -12.216  -4.330
  323   2HB   ARG  47           HB1      ARG  47  66.683 -13.203  -4.844
  324   1HG   ARG  47           HG2      ARG  47  68.181 -11.842  -7.014
  325   2HG   ARG  47           HG1      ARG  47  69.042 -13.135  -6.178
  326   1HD   ARG  47           HD2      ARG  47  67.219 -14.694  -6.628
  327   2HD   ARG  47           HD1      ARG  47  66.264 -13.406  -7.366
  328    HE   ARG  47           HE       ARG  47  68.526 -13.358  -8.891
  329   1HH1  ARG  47          HH11      ARG  47  66.143 -15.668  -8.010
  330   2HH1  ARG  47          HH12      ARG  47  66.569 -16.790  -9.258
  331   1HH2  ARG  47          HH21      ARG  47  69.238 -14.900 -10.411
  332   2HH2  ARG  47          HH22      ARG  47  68.322 -16.357 -10.617
  333    H    MET  48           HN       MET  48  65.759 -10.348  -3.003
  334    HA   MET  48           HA       MET  48  63.378 -11.966  -2.772
  335   1HB   MET  48           HB2      MET  48  64.345  -9.558  -1.208
  336   2HB   MET  48           HB1      MET  48  62.920 -10.501  -0.773
  337   1HG   MET  48           HG2      MET  48  65.448 -12.004  -1.264
  338   2HG   MET  48           HG1      MET  48  65.346 -11.062   0.223
  339   1HE   MET  48           HE2      MET  48  64.328 -11.563   2.135
  340   2HE   MET  48           HE1      MET  48  62.688 -11.210   1.598
  341   3HE   MET  48           HE3      MET  48  63.031 -12.705   2.479
  342    H    LEU  49           HN       LEU  49  63.775  -8.418  -3.130
  343    HA   LEU  49           HA       LEU  49  60.963  -8.010  -3.661
  344   1HB   LEU  49           HB2      LEU  49  63.100  -6.101  -4.580
  345   2HB   LEU  49           HB1      LEU  49  61.499  -5.744  -3.936
  346    HG   LEU  49           HG       LEU  49  63.933  -6.702  -2.421
  347   1HD1  LEU  49          HD12      LEU  49  62.609  -4.171  -2.854
  348   2HD1  LEU  49          HD11      LEU  49  62.589  -4.583  -1.140
  349   3HD1  LEU  49          HD13      LEU  49  64.121  -4.500  -2.009
  350   1HD2  LEU  49          HD21      LEU  49  61.878  -7.964  -1.726
  351   2HD2  LEU  49          HD23      LEU  49  62.516  -6.925  -0.453
  352   3HD2  LEU  49          HD22      LEU  49  61.100  -6.421  -1.376
  353    H    GLY  50           HN       GLY  50  63.697  -7.350  -5.876
  354   1HA   GLY  50           HA2      GLY  50  63.180  -9.020  -7.985
  355   2HA   GLY  50           HA1      GLY  50  61.949  -7.773  -8.186
  356    H    GLN  51           HN       GLN  51  65.449  -8.308  -8.002
  357    HA   GLN  51           HA       GLN  51  65.895  -6.208  -9.979
  358   1HB   GLN  51           HB2      GLN  51  66.252  -5.683  -7.101
  359   2HB   GLN  51           HB1      GLN  51  67.664  -5.293  -8.083
  360   1HG   GLN  51           HG2      GLN  51  65.728  -4.242  -9.649
  361   2HG   GLN  51           HG1      GLN  51  64.967  -4.048  -8.070
  362   1HE2  GLN  51          HE22      GLN  51  67.186  -1.500  -7.012
  363   2HE2  GLN  51          HE21      GLN  51  65.910  -2.531  -6.578
  364    H    ASN  52           HN       ASN  52  67.826  -6.586 -11.054
  365    HA   ASN  52           HA       ASN  52  69.862  -8.319  -9.783
  366   1HB   ASN  52           HB2      ASN  52  68.906  -9.045 -12.542
  367   2HB   ASN  52           HB1      ASN  52  69.777 -10.037 -11.372
  368   1HD2  ASN  52          HD22      ASN  52  65.734 -10.005 -11.336
  369   2HD2  ASN  52          HD21      ASN  52  66.626  -9.166 -12.512
  370    HA   PRO  53           HA       PRO  53  71.417  -4.966 -12.623
  371   1HB   PRO  53           HB2      PRO  53  72.607  -3.446 -10.666
  372   2HB   PRO  53           HB1      PRO  53  70.937  -3.208 -11.211
  373   1HG   PRO  53           HG2      PRO  53  71.929  -4.444  -8.683
  374   2HG   PRO  53           HG1      PRO  53  70.389  -3.628  -9.004
  375   1HD   PRO  53           HD2      PRO  53  70.781  -6.427  -8.863
  376   2HD   PRO  53           HD1      PRO  53  69.343  -5.606  -9.506
  377    H    THR  54           HN       THR  54  73.902  -4.107 -12.434
  378    HA   THR  54           HA       THR  54  75.527  -6.519 -12.413
  379    HB   THR  54           HB       THR  54  75.868  -4.557 -13.973
  380    HG1  THR  54           HG1      THR  54  77.892  -5.618 -12.340
  381   1HG2  THR  54          HG21      THR  54  75.767  -3.070 -11.666
  382   2HG2  THR  54          HG23      THR  54  77.502  -3.142 -11.976
  383   3HG2  THR  54          HG22      THR  54  76.413  -2.495 -13.203
  384    H    LYS  55           HN       LYS  55  77.149  -7.072 -10.922
  385    HA   LYS  55           HA       LYS  55  76.733  -6.547  -8.199
  386   1HB   LYS  55           HB2      LYS  55  78.164  -8.382  -9.096
  387   2HB   LYS  55           HB1      LYS  55  79.395  -7.187  -9.506
  388   1HG   LYS  55           HG2      LYS  55  78.442  -6.971  -6.736
  389   2HG   LYS  55           HG1      LYS  55  79.221  -8.514  -7.091
  390   1HD   LYS  55           HD2      LYS  55  80.997  -6.925  -8.290
  391   2HD   LYS  55           HD1      LYS  55  80.371  -5.755  -7.127
  392   1HE   LYS  55           HE2      LYS  55  80.932  -8.423  -5.995
  393   2HE   LYS  55           HE1      LYS  55  82.356  -7.562  -6.578
  394   1HZ   LYS  55           HZ2      LYS  55  81.240  -5.589  -5.309
  395   2HZ   LYS  55           HZ1      LYS  55  80.493  -6.839  -4.434
  396   3HZ   LYS  55           HZ3      LYS  55  82.184  -6.729  -4.475
  397    H    GLU  56           HN       GLU  56  78.442  -4.627 -10.572
  398    HA   GLU  56           HA       GLU  56  79.997  -3.029  -8.782
  399   1HB   GLU  56           HB2      GLU  56  80.005  -3.161 -11.403
  400   2HB   GLU  56           HB1      GLU  56  78.787  -1.890 -11.287
  401   1HG   GLU  56           HG2      GLU  56  81.197  -1.523  -9.596
  402   2HG   GLU  56           HG1      GLU  56  81.452  -1.388 -11.337
  403    H    GLU  57           HN       GLU  57  76.953  -2.085 -10.427
  404    HA   GLU  57           HA       GLU  57  76.403   0.225  -8.971
  405   1HB   GLU  57           HB2      GLU  57  74.592  -1.869 -10.163
  406   2HB   GLU  57           HB1      GLU  57  73.923  -0.476  -9.313
  407   1HG   GLU  57           HG2      GLU  57  74.961   1.062 -10.831
  408   2HG   GLU  57           HG1      GLU  57  75.942  -0.214 -11.552
  409    H    LEU  58           HN       LEU  58  76.267  -3.073  -7.872
  410    HA   LEU  58           HA       LEU  58  74.518  -2.674  -5.622
  411   1HB   LEU  58           HB2      LEU  58  75.488  -4.881  -6.722
  412   2HB   LEU  58           HB1      LEU  58  76.763  -4.659  -5.524
  413    HG   LEU  58           HG       LEU  58  73.969  -4.361  -4.551
  414   1HD1  LEU  58          HD13      LEU  58  74.573  -6.561  -6.149
  415   2HD1  LEU  58          HD12      LEU  58  74.838  -7.150  -4.509
  416   3HD1  LEU  58          HD11      LEU  58  73.274  -6.473  -4.959
  417   1HD2  LEU  58          HD21      LEU  58  76.206  -4.235  -3.238
  418   2HD2  LEU  58          HD23      LEU  58  74.903  -5.203  -2.547
  419   3HD2  LEU  58          HD22      LEU  58  76.232  -5.992  -3.396
  420    H    ASP  59           HN       ASP  59  78.091  -3.026  -5.659
  421    HA   ASP  59           HA       ASP  59  78.540  -2.232  -2.998
  422   1HB   ASP  59           HB2      ASP  59  80.213  -3.087  -4.804
  423   2HB   ASP  59           HB1      ASP  59  80.399  -1.381  -5.212
  424    H    ALA  60           HN       ALA  60  78.524  -0.157  -5.917
  425    HA   ALA  60           HA       ALA  60  78.972   2.311  -4.610
  426   1HB   ALA  60           HB1      ALA  60  77.644   1.486  -7.161
  427   2HB   ALA  60           HB3      ALA  60  77.404   3.141  -6.601
  428   3HB   ALA  60           HB2      ALA  60  79.033   2.543  -6.914
  429    H    ILE  61           HN       ILE  61  75.999   0.451  -5.047
  430    HA   ILE  61           HA       ILE  61  74.151   2.420  -4.146
  431    HB   ILE  61           HB       ILE  61  74.167  -0.587  -4.223
  432   1HG1  ILE  61          HG12      ILE  61  72.063   1.223  -5.353
  433   2HG1  ILE  61          HG11      ILE  61  73.640   1.160  -6.142
  434   1HG2  ILE  61          HG22      ILE  61  72.513   1.088  -2.473
  435   2HG2  ILE  61          HG21      ILE  61  71.566   0.073  -3.560
  436   3HG2  ILE  61          HG23      ILE  61  72.740  -0.660  -2.468
  437   1HD1  ILE  61          HD12      ILE  61  72.766  -1.514  -5.507
  438   2HD1  ILE  61          HD11      ILE  61  71.511  -0.681  -6.423
  439   3HD1  ILE  61          HD13      ILE  61  73.140  -0.820  -7.085
  440    H    ILE  62           HN       ILE  62  76.058   0.006  -2.352
  441    HA   ILE  62           HA       ILE  62  74.947   0.565   0.221
  442    HB   ILE  62           HB       ILE  62  77.653  -0.496  -0.627
  443   1HG1  ILE  62          HG12      ILE  62  75.453  -1.979   0.798
  444   2HG1  ILE  62          HG11      ILE  62  75.386  -1.759  -0.951
  445   1HG2  ILE  62          HG23      ILE  62  76.499   0.057   2.095
  446   2HG2  ILE  62          HG22      ILE  62  77.600  -1.301   1.865
  447   3HG2  ILE  62          HG21      ILE  62  78.138   0.341   1.506
  448   1HD1  ILE  62          HD11      ILE  62  77.800  -2.665  -0.976
  449   2HD1  ILE  62          HD13      ILE  62  77.482  -3.205   0.672
  450   3HD1  ILE  62          HD12      ILE  62  76.511  -3.826  -0.663
  451    H    GLU  63           HN       GLU  63  77.953   1.789  -1.297
  452    HA   GLU  63           HA       GLU  63  78.525   3.644   0.826
  453   1HB   GLU  63           HB2      GLU  63  80.086   4.672  -0.819
  454   2HB   GLU  63           HB1      GLU  63  80.268   2.919  -0.732
  455   1HG   GLU  63           HG2      GLU  63  79.022   2.600  -2.755
  456   2HG   GLU  63           HG1      GLU  63  78.502   4.285  -2.774
  457    H    GLU  64           HN       GLU  64  76.158   3.678  -1.621
  458    HA   GLU  64           HA       GLU  64  75.979   6.649  -1.591
  459   1HB   GLU  64           HB2      GLU  64  75.186   4.526  -3.458
  460   2HB   GLU  64           HB1      GLU  64  73.927   5.736  -3.202
  461   1HG   GLU  64           HG2      GLU  64  75.678   7.513  -3.613
  462   2HG   GLU  64           HG1      GLU  64  76.778   6.223  -4.100
  463    H    VAL  65           HN       VAL  65  74.609   3.879  -0.122
  464    HA   VAL  65           HA       VAL  65  72.080   5.288   0.527
  465    HB   VAL  65           HB       VAL  65  73.029   2.490   1.222
  466   1HG1  VAL  65          HG13      VAL  65  71.007   4.052   2.394
  467   2HG1  VAL  65          HG12      VAL  65  70.167   2.969   1.282
  468   3HG1  VAL  65          HG11      VAL  65  71.209   2.305   2.540
  469   1HG2  VAL  65          HG22      VAL  65  72.380   3.351  -1.246
  470   2HG2  VAL  65          HG21      VAL  65  71.954   1.740  -0.670
  471   3HG2  VAL  65          HG23      VAL  65  70.758   3.036  -0.629
  472    H    ASP  66           HN       ASP  66  75.132   4.342   1.960
  473    HA   ASP  66           HA       ASP  66  74.220   4.999   4.684
  474   1HB   ASP  66           HB2      ASP  66  76.482   3.624   3.482
  475   2HB   ASP  66           HB1      ASP  66  77.020   4.802   4.679
  476    H    GLU  67           HN       GLU  67  73.639   7.253   3.740
  477    HA   GLU  67           HA       GLU  67  75.721   9.099   3.052
  478   1HB   GLU  67           HB2      GLU  67  72.867   9.305   3.910
  479   2HB   GLU  67           HB1      GLU  67  73.861  10.757   4.031
  480   1HG   GLU  67           HG2      GLU  67  73.532   9.067   1.534
  481   2HG   GLU  67           HG1      GLU  67  72.739  10.615   1.829
  482    H    ASP  68           HN       ASP  68  74.965   7.607   6.002
  483    HA   ASP  68           HA       ASP  68  76.185   9.822   7.580
  484   1HB   ASP  68           HB2      ASP  68  75.489   8.237   9.526
  485   2HB   ASP  68           HB1      ASP  68  74.222   9.119   8.674
  486    H    GLY  69           HN       GLY  69  76.677   6.502   6.540
  487   1HA   GLY  69           HA2      GLY  69  78.709   5.300   6.469
  488   2HA   GLY  69           HA1      GLY  69  79.511   6.690   7.203
  489    H    SER  70           HN       SER  70  76.662   5.186   8.611
  490    HA   SER  70           HA       SER  70  78.035   4.820  11.140
  491   1HB   SER  70           HB2      SER  70  75.926   3.942  11.936
  492   2HB   SER  70           HB1      SER  70  75.575   5.316  10.892
  493    HG   SER  70           HG       SER  70  75.545   3.491   9.206
  494    H    GLY  71           HN       GLY  71  77.270   2.763   8.394
  495   1HA   GLY  71           HA2      GLY  71  78.640   0.785   7.956
  496   2HA   GLY  71           HA1      GLY  71  78.852   0.597   9.698
  497    H    THR  72           HN       THR  72  75.676   1.437   8.724
  498    HA   THR  72           HA       THR  72  74.758  -1.335   8.405
  499    HB   THR  72           HB       THR  72  73.073  -0.577  10.435
  500    HG1  THR  72           HG1      THR  72  74.792  -0.003  12.064
  501   1HG2  THR  72          HG21      THR  72  75.564  -2.249  10.311
  502   2HG2  THR  72          HG23      THR  72  74.720  -2.055  11.848
  503   3HG2  THR  72          HG22      THR  72  73.884  -2.763  10.466
  504    H    ILE  73           HN       ILE  73  72.557  -1.410   7.652
  505    HA   ILE  73           HA       ILE  73  71.637   1.198   6.563
  506    HB   ILE  73           HB       ILE  73  70.827  -1.651   5.915
  507   1HG1  ILE  73          HG12      ILE  73  73.120  -0.797   5.187
  508   2HG1  ILE  73          HG11      ILE  73  72.064  -1.341   3.883
  509   1HG2  ILE  73          HG21      ILE  73  69.749   1.018   5.104
  510   2HG2  ILE  73          HG23      ILE  73  69.829  -0.250   3.880
  511   3HG2  ILE  73          HG22      ILE  73  68.898  -0.507   5.356
  512   1HD1  ILE  73          HD12      ILE  73  71.554   1.442   4.441
  513   2HD1  ILE  73          HD11      ILE  73  73.279   1.200   4.158
  514   3HD1  ILE  73          HD13      ILE  73  72.107   0.701   2.938
  515    H    ASP  74           HN       ASP  74  69.585   2.017   7.033
  516    HA   ASP  74           HA       ASP  74  68.056   0.547   9.146
  517   1HB   ASP  74           HB2      ASP  74  68.529   3.525   8.822
  518   2HB   ASP  74           HB1      ASP  74  67.346   2.839   9.937
  519    H    PHE  75           HN       PHE  75  65.713   0.882   9.058
  520    HA   PHE  75           HA       PHE  75  64.499   0.523   6.605
  521   1HB   PHE  75           HB2      PHE  75  63.447   0.498   8.966
  522   2HB   PHE  75           HB1      PHE  75  63.164   2.220   8.713
  523    HD1  PHE  75           HD2      PHE  75  62.985  -0.762   6.445
  524    HD2  PHE  75           HD1      PHE  75  60.925   2.588   8.170
  525    HE1  PHE  75           HE2      PHE  75  60.982  -1.292   5.081
  526    HE2  PHE  75           HE1      PHE  75  58.922   2.060   6.806
  527    HZ   PHE  75           HZ       PHE  75  58.950   0.119   5.261
  528    H    GLU  76           HN       GLU  76  65.157   3.660   8.168
  529    HA   GLU  76           HA       GLU  76  63.929   5.323   6.228
  530   1HB   GLU  76           HB2      GLU  76  66.475   5.892   7.779
  531   2HB   GLU  76           HB1      GLU  76  65.408   7.092   7.049
  532   1HG   GLU  76           HG2      GLU  76  63.659   6.635   8.580
  533   2HG   GLU  76           HG1      GLU  76  64.391   5.112   9.088
  534    H    GLU  77           HN       GLU  77  67.283   4.092   6.366
  535    HA   GLU  77           HA       GLU  77  68.055   5.312   3.864
  536   1HB   GLU  77           HB2      GLU  77  69.259   2.930   5.306
  537   2HB   GLU  77           HB1      GLU  77  70.033   3.855   4.018
  538   1HG   GLU  77           HG2      GLU  77  70.020   5.866   5.394
  539   2HG   GLU  77           HG1      GLU  77  69.126   5.028   6.663
  540    H    PHE  78           HN       PHE  78  66.209   2.519   4.650
  541    HA   PHE  78           HA       PHE  78  66.810   0.902   2.356
  542   1HB   PHE  78           HB2      PHE  78  65.192   0.658   4.607
  543   2HB   PHE  78           HB1      PHE  78  64.039   0.722   3.272
  544    HD1  PHE  78           HD2      PHE  78  64.170  -0.915   1.417
  545    HD2  PHE  78           HD1      PHE  78  66.708  -1.195   4.867
  546    HE1  PHE  78           HE2      PHE  78  64.726  -3.257   0.815
  547    HE2  PHE  78           HE1      PHE  78  67.268  -3.537   4.268
  548    HZ   PHE  78           HZ       PHE  78  66.277  -4.567   2.241
  549    H    LEU  79           HN       LEU  79  63.956   2.979   2.972
  550    HA   LEU  79           HA       LEU  79  62.731   2.900   0.500
  551   1HB   LEU  79           HB2      LEU  79  63.213   5.438   2.095
  552   2HB   LEU  79           HB1      LEU  79  61.924   5.174   0.919
  553    HG   LEU  79           HG       LEU  79  62.309   3.668   3.522
  554   1HD1  LEU  79          HD13      LEU  79  61.368   6.041   3.576
  555   2HD1  LEU  79          HD12      LEU  79  60.001   5.418   2.651
  556   3HD1  LEU  79          HD11      LEU  79  60.333   4.789   4.266
  557   1HD2  LEU  79          HD22      LEU  79  60.230   3.385   1.330
  558   2HD2  LEU  79          HD21      LEU  79  61.449   2.189   1.769
  559   3HD2  LEU  79          HD23      LEU  79  60.153   2.582   2.899
  560    H    VAL  80           HN       VAL  80  65.758   4.488   1.309
  561    HA   VAL  80           HA       VAL  80  65.978   6.019  -1.131
  562    HB   VAL  80           HB       VAL  80  68.227   4.989   0.621
  563   1HG1  VAL  80          HG11      VAL  80  67.929   7.150  -1.453
  564   2HG1  VAL  80          HG13      VAL  80  69.151   7.291  -0.189
  565   3HG1  VAL  80          HG12      VAL  80  69.189   5.925  -1.305
  566   1HG2  VAL  80          HG23      VAL  80  66.227   6.310   1.710
  567   2HG2  VAL  80          HG22      VAL  80  67.886   6.778   2.088
  568   3HG2  VAL  80          HG21      VAL  80  66.957   7.700   0.904
  569    H    MET  81           HN       MET  81  67.353   2.883  -0.097
  570    HA   MET  81           HA       MET  81  68.808   2.265  -2.417
  571   1HB   MET  81           HB2      MET  81  68.463   0.934  -0.169
  572   2HB   MET  81           HB1      MET  81  67.183   0.126  -1.074
  573   1HG   MET  81           HG2      MET  81  68.662  -0.822  -2.594
  574   2HG   MET  81           HG1      MET  81  69.875   0.436  -2.354
  575   1HE   MET  81           HE2      MET  81  70.328   1.048  -0.006
  576   2HE   MET  81           HE1      MET  81  70.286  -0.017   1.397
  577   3HE   MET  81           HE3      MET  81  71.731   0.054   0.379
  578    H    MET  82           HN       MET  82  65.328   1.997  -1.827
  579    HA   MET  82           HA       MET  82  64.724   0.548  -4.242
  580   1HB   MET  82           HB2      MET  82  62.871   2.477  -2.827
  581   2HB   MET  82           HB1      MET  82  62.434   1.059  -3.780
  582   1HG   MET  82           HG2      MET  82  63.807   1.108  -1.081
  583   2HG   MET  82           HG1      MET  82  62.222   0.440  -1.464
  584   1HE   MET  82           HE3      MET  82  62.137  -0.793  -3.740
  585   2HE   MET  82           HE2      MET  82  63.089  -2.240  -4.065
  586   3HE   MET  82           HE1      MET  82  61.981  -2.211  -2.694
  587    H    VAL  83           HN       VAL  83  64.319   4.026  -3.458
  588    HA   VAL  83           HA       VAL  83  63.775   4.729  -6.213
  589    HB   VAL  83           HB       VAL  83  64.818   6.705  -4.203
  590   1HG1  VAL  83          HG12      VAL  83  63.374   6.717  -6.714
  591   2HG1  VAL  83          HG11      VAL  83  62.439   7.535  -5.462
  592   3HG1  VAL  83          HG13      VAL  83  64.076   8.073  -5.832
  593   1HG2  VAL  83          HG23      VAL  83  62.309   5.073  -4.047
  594   2HG2  VAL  83          HG22      VAL  83  63.338   5.669  -2.743
  595   3HG2  VAL  83          HG21      VAL  83  62.237   6.769  -3.571
  596    H    ARG  84           HN       ARG  84  66.601   3.759  -4.733
  597    HA   ARG  84           HA       ARG  84  68.503   5.592  -5.869
  598   1HB   ARG  84           HB2      ARG  84  68.630   2.816  -4.738
  599   2HB   ARG  84           HB1      ARG  84  70.021   3.443  -5.624
  600   1HG   ARG  84           HG2      ARG  84  69.161   5.521  -3.898
  601   2HG   ARG  84           HG1      ARG  84  69.191   4.044  -2.935
  602   1HD   ARG  84           HD2      ARG  84  71.465   3.776  -3.159
  603   2HD   ARG  84           HD1      ARG  84  71.500   4.518  -4.759
  604    HE   ARG  84           HE       ARG  84  72.025   5.894  -2.320
  605   1HH1  ARG  84          HH11      ARG  84  71.130   6.241  -5.569
  606   2HH1  ARG  84          HH12      ARG  84  70.751   7.927  -5.453
  607   1HH2  ARG  84          HH21      ARG  84  71.138   8.047  -2.009
  608   2HH2  ARG  84          HH22      ARG  84  70.755   8.950  -3.436
  609    H    GLN  85           HN       GLN  85  67.463   2.330  -6.931
  610    HA   GLN  85           HA       GLN  85  68.713   2.828  -9.567
  611   1HB   GLN  85           HB2      GLN  85  67.172   0.371  -8.706
  612   2HB   GLN  85           HB1      GLN  85  68.362   0.505 -10.002
  613   1HG   GLN  85           HG2      GLN  85  69.465   1.372  -7.452
  614   2HG   GLN  85           HG1      GLN  85  68.870  -0.286  -7.368
  615   1HE2  GLN  85          HE22      GLN  85  72.163   0.568  -9.611
  616   2HE2  GLN  85          HE21      GLN  85  71.284   1.808  -8.856
  617    H    MET  86           HN       MET  86  65.574   2.763  -8.047
  618    HA   MET  86           HA       MET  86  64.003   2.457 -10.440
  619   1HB   MET  86           HB2      MET  86  63.528   3.223  -7.623
  620   2HB   MET  86           HB1      MET  86  62.393   3.914  -8.783
  621   1HG   MET  86           HG2      MET  86  62.686   1.257  -9.602
  622   2HG   MET  86           HG1      MET  86  62.615   1.169  -7.842
  623   1HE   MET  86           HE2      MET  86  61.145   1.857  -6.440
  624   2HE   MET  86           HE1      MET  86  59.485   2.402  -6.663
  625   3HE   MET  86           HE3      MET  86  59.902   0.700  -6.906
  626    H    LYS  87           HN       LYS  87  65.633   5.173  -8.952
  627    HA   LYS  87           HA       LYS  87  64.764   6.848 -11.257
  628   1HB   LYS  87           HB2      LYS  87  64.389   7.396  -8.348
  629   2HB   LYS  87           HB1      LYS  87  64.860   8.752  -9.374
  630   1HG   LYS  87           HG2      LYS  87  62.554   6.909 -10.041
  631   2HG   LYS  87           HG1      LYS  87  62.354   8.405  -9.130
  632   1HD   LYS  87           HD2      LYS  87  62.251   9.521 -11.081
  633   2HD   LYS  87           HD1      LYS  87  63.931   9.070 -11.379
  634   1HE   LYS  87           HE2      LYS  87  63.253   7.777 -13.089
  635   2HE   LYS  87           HE1      LYS  87  62.349   6.781 -11.948
  636   1HZ   LYS  87           HZ1      LYS  87  61.236   9.332 -12.913
  637   2HZ   LYS  87           HZ3      LYS  87  61.095   7.929 -13.855
  638   3HZ   LYS  87           HZ2      LYS  87  60.422   7.975 -12.296
  639    H    GLU  88           HN       GLU  88  67.197   5.569 -11.198
  640    HA   GLU  88           HA       GLU  88  69.312   7.014  -9.926
  641   1HB   GLU  88           HB2      GLU  88  69.317   4.701 -11.175
  642   2HB   GLU  88           HB1      GLU  88  69.687   5.682 -12.594
  643   1HG   GLU  88           HG2      GLU  88  71.765   6.272 -11.816
  644   2HG   GLU  88           HG1      GLU  88  71.252   6.255 -10.129
  645    H    ASP  89           HN       ASP  89  68.446   7.068 -13.407
  646    HA   ASP  89           HA       ASP  89  68.830  10.006 -13.406
  647   1HB   ASP  89           HB2      ASP  89  70.822   8.169 -14.336
  648   2HB   ASP  89           HB1      ASP  89  70.152   9.014 -15.731
  649    H    ALA  90           HN       ALA  90  66.396   8.849 -13.661
  650    HA   ALA  90           HA       ALA  90  65.652   9.567 -16.398
  651   1HB   ALA  90           HB3      ALA  90  65.805   6.740 -15.502
  652   2HB   ALA  90           HB2      ALA  90  64.335   7.198 -16.361
  653   3HB   ALA  90           HB1      ALA  90  65.908   7.412 -17.129
   
  No H/Q in entry =         653
  Start of MODEL    2
    1   1H    ALA   1           HT3      ALA   1  62.496  14.079  12.744
    2   2H    ALA   1           HT2      ALA   1  62.861  12.470  12.338
    3   3H    ALA   1           HT1      ALA   1  63.222  13.060  13.890
    4    HA   ALA   1           HA       ALA   1  65.066  14.174  13.222
    5   1HB   ALA   1           HB2      ALA   1  64.637  11.917  11.255
    6   2HB   ALA   1           HB1      ALA   1  66.142  12.837  11.315
    7   3HB   ALA   1           HB3      ALA   1  65.617  11.910  12.721
    8    H    SER   2           HN       SER   2  66.323  15.047  11.169
    9    HA   SER   2           HA       SER   2  64.428  16.841   9.787
   10   1HB   SER   2           HB2      SER   2  66.474  17.992   9.008
   11   2HB   SER   2           HB1      SER   2  66.489  17.785  10.756
   12    HG   SER   2           HG       SER   2  68.236  16.898   8.944
   13    H    MET   3           HN       MET   3  63.444  15.287   8.351
   14    HA   MET   3           HA       MET   3  64.625  13.427   6.682
   15   1HB   MET   3           HB2      MET   3  62.846  14.127   4.966
   16   2HB   MET   3           HB1      MET   3  62.259  13.660   6.562
   17   1HG   MET   3           HG2      MET   3  62.109  16.009   7.231
   18   2HG   MET   3           HG1      MET   3  62.783  16.515   5.682
   19   1HE   MET   3           HE3      MET   3  60.037  14.971   7.667
   20   2HE   MET   3           HE2      MET   3  58.681  14.705   6.574
   21   3HE   MET   3           HE1      MET   3  60.082  13.640   6.503
   22    H    THR   4           HN       THR   4  66.467  13.681   5.506
   23    HA   THR   4           HA       THR   4  67.346  16.257   4.516
   24    HB   THR   4           HB       THR   4  69.177  15.013   3.494
   25    HG1  THR   4           HG1      THR   4  68.716  13.124   2.751
   26   1HG2  THR   4          HG23      THR   4  69.091  15.328   6.003
   27   2HG2  THR   4          HG22      THR   4  68.476  13.679   6.118
   28   3HG2  THR   4          HG21      THR   4  70.087  13.975   5.464
   29    H    ASP   5           HN       ASP   5  68.106  16.097   1.982
   30    HA   ASP   5           HA       ASP   5  65.642  16.253   0.490
   31   1HB   ASP   5           HB2      ASP   5  68.487  16.122  -0.558
   32   2HB   ASP   5           HB1      ASP   5  67.073  16.708  -1.437
   33    H    GLN   6           HN       GLN   6  68.244  13.838   0.685
   34    HA   GLN   6           HA       GLN   6  67.422  12.147  -1.426
   35   1HB   GLN   6           HB2      GLN   6  69.054  11.888   1.007
   36   2HB   GLN   6           HB1      GLN   6  68.283  10.381   0.511
   37   1HG   GLN   6           HG2      GLN   6  69.403  10.316  -1.522
   38   2HG   GLN   6           HG1      GLN   6  69.626  12.063  -1.574
   39   1HE2  GLN   6          HE22      GLN   6  72.166   9.913   0.859
   40   2HE2  GLN   6          HE21      GLN   6  70.571   9.371   0.652
   41    H    GLN   7           HN       GLN   7  66.422  12.104   2.005
   42    HA   GLN   7           HA       GLN   7  64.462   9.998   1.544
   43   1HB   GLN   7           HB2      GLN   7  65.316  11.701   3.839
   44   2HB   GLN   7           HB1      GLN   7  63.689  11.021   3.905
   45   1HG   GLN   7           HG2      GLN   7  64.469   8.933   4.282
   46   2HG   GLN   7           HG1      GLN   7  65.685   9.075   3.013
   47   1HE2  GLN   7          HE22      GLN   7  68.120   9.148   5.573
   48   2HE2  GLN   7          HE21      GLN   7  67.528   8.352   4.195
   49    H    ALA   8           HN       ALA   8  64.532  13.391   1.076
   50    HA   ALA   8           HA       ALA   8  61.724  13.933   1.510
   51   1HB   ALA   8           HB1      ALA   8  63.780  15.573   1.254
   52   2HB   ALA   8           HB3      ALA   8  63.364  15.493  -0.459
   53   3HB   ALA   8           HB2      ALA   8  62.178  16.072   0.711
   54    H    GLU   9           HN       GLU   9  63.605  13.615  -1.529
   55    HA   GLU   9           HA       GLU   9  61.212  13.391  -3.143
   56   1HB   GLU   9           HB2      GLU   9  64.132  13.294  -3.572
   57   2HB   GLU   9           HB1      GLU   9  63.195  12.297  -4.688
   58   1HG   GLU   9           HG2      GLU   9  63.444  14.550  -5.611
   59   2HG   GLU   9           HG1      GLU   9  61.755  14.264  -5.191
   60    H    ALA  10           HN       ALA  10  63.390  11.087  -1.592
   61    HA   ALA  10           HA       ALA  10  62.532   8.727  -2.922
   62   1HB   ALA  10           HB3      ALA  10  63.686   9.297  -0.206
   63   2HB   ALA  10           HB2      ALA  10  63.110   7.673  -0.584
   64   3HB   ALA  10           HB1      ALA  10  64.396   8.399  -1.549
   65    H    ARG  11           HN       ARG  11  61.498   9.741   0.358
   66    HA   ARG  11           HA       ARG  11  59.253   8.013   0.478
   67   1HB   ARG  11           HB2      ARG  11  60.421   9.888   2.166
   68   2HB   ARG  11           HB1      ARG  11  58.826  10.567   1.842
   69   1HG   ARG  11           HG2      ARG  11  58.028   9.139   3.396
   70   2HG   ARG  11           HG1      ARG  11  58.338   7.847   2.236
   71   1HD   ARG  11           HD2      ARG  11  60.335   7.231   3.246
   72   2HD   ARG  11           HD1      ARG  11  60.610   8.837   3.920
   73    HE   ARG  11           HE       ARG  11  58.527   8.176   5.409
   74   1HH1  ARG  11          HH11      ARG  11  58.008   5.512   5.176
   75   2HH1  ARG  11          HH12      ARG  11  59.224   4.661   6.068
   76   1HH2  ARG  11          HH21      ARG  11  61.414   7.347   6.161
   77   2HH2  ARG  11          HH22      ARG  11  61.153   5.700   6.626
   78    H    ALA  12           HN       ALA  12  59.638  11.195  -0.975
   79    HA   ALA  12           HA       ALA  12  56.905  11.879  -1.311
   80   1HB   ALA  12           HB3      ALA  12  59.452  12.770  -2.335
   81   2HB   ALA  12           HB2      ALA  12  58.273  12.710  -3.645
   82   3HB   ALA  12           HB1      ALA  12  57.941  13.670  -2.201
   83    H    PHE  13           HN       PHE  13  59.041   9.851  -3.305
   84    HA   PHE  13           HA       PHE  13  56.933   9.349  -5.273
   85   1HB   PHE  13           HB2      PHE  13  59.150   9.283  -6.141
   86   2HB   PHE  13           HB1      PHE  13  59.710   8.238  -4.837
   87    HD1  PHE  13           HD1      PHE  13  57.354   8.345  -7.741
   88    HD2  PHE  13           HD2      PHE  13  59.661   5.895  -5.071
   89    HE1  PHE  13           HE1      PHE  13  56.805   6.345  -9.100
   90    HE2  PHE  13           HE2      PHE  13  59.112   3.895  -6.431
   91    HZ   PHE  13           HZ       PHE  13  57.683   4.120  -8.444
   92    H    LEU  14           HN       LEU  14  58.084   7.882  -2.322
   93    HA   LEU  14           HA       LEU  14  56.581   5.389  -2.856
   94   1HB   LEU  14           HB2      LEU  14  58.061   6.166  -0.332
   95   2HB   LEU  14           HB1      LEU  14  57.587   4.545  -0.843
   96    HG   LEU  14           HG       LEU  14  59.408   6.247  -2.542
   97   1HD1  LEU  14          HD11      LEU  14  59.998   5.273   0.064
   98   2HD1  LEU  14          HD13      LEU  14  60.849   4.237  -1.082
   99   3HD1  LEU  14          HD12      LEU  14  61.115   5.981  -1.102
  100   1HD2  LEU  14          HD23      LEU  14  58.607   3.355  -2.346
  101   2HD2  LEU  14          HD22      LEU  14  58.681   4.392  -3.770
  102   3HD2  LEU  14          HD21      LEU  14  60.169   3.780  -3.047
  103    H    SER  15           HN       SER  15  54.533   5.083  -2.121
  104    HA   SER  15           HA       SER  15  53.366   7.184  -0.370
  105   1HB   SER  15           HB2      SER  15  52.391   5.596  -2.572
  106   2HB   SER  15           HB1      SER  15  51.382   5.321  -1.154
  107    HG   SER  15           HG       SER  15  51.019   7.509  -1.015
  108    H    GLU  16           HN       GLU  16  51.691   6.277   1.256
  109    HA   GLU  16           HA       GLU  16  53.001   4.650   3.162
  110   1HB   GLU  16           HB2      GLU  16  50.099   5.363   2.734
  111   2HB   GLU  16           HB1      GLU  16  50.599   4.315   4.063
  112   1HG   GLU  16           HG2      GLU  16  51.521   6.031   5.230
  113   2HG   GLU  16           HG1      GLU  16  52.225   6.755   3.783
  114    H    GLU  17           HN       GLU  17  50.985   3.780   0.424
  115    HA   GLU  17           HA       GLU  17  50.493   1.052   1.228
  116   1HB   GLU  17           HB2      GLU  17  49.538   2.636  -0.766
  117   2HB   GLU  17           HB1      GLU  17  50.684   1.644  -1.669
  118   1HG   GLU  17           HG2      GLU  17  48.584   0.510   0.198
  119   2HG   GLU  17           HG1      GLU  17  48.368   0.662  -1.546
  120    H    MET  18           HN       MET  18  53.020   2.605  -0.737
  121    HA   MET  18           HA       MET  18  54.319   0.122  -1.450
  122   1HB   MET  18           HB2      MET  18  55.025   3.029  -1.587
  123   2HB   MET  18           HB1      MET  18  56.314   1.842  -1.773
  124   1HG   MET  18           HG2      MET  18  55.106   0.764  -3.604
  125   2HG   MET  18           HG1      MET  18  53.747   1.867  -3.388
  126   1HE   MET  18           HE1      MET  18  54.007   1.901  -5.806
  127   2HE   MET  18           HE3      MET  18  54.938   3.122  -6.685
  128   3HE   MET  18           HE2      MET  18  55.653   1.551  -6.328
  129    H    ILE  19           HN       ILE  19  55.268   2.686   0.875
  130    HA   ILE  19           HA       ILE  19  57.452   1.367   2.040
  131    HB   ILE  19           HB       ILE  19  55.400   3.229   3.257
  132   1HG1  ILE  19          HG12      ILE  19  58.119   4.184   3.088
  133   2HG1  ILE  19          HG11      ILE  19  57.602   3.580   1.514
  134   1HG2  ILE  19          HG21      ILE  19  56.395   1.835   5.036
  135   2HG2  ILE  19          HG23      ILE  19  58.009   2.243   4.453
  136   3HG2  ILE  19          HG22      ILE  19  56.975   3.496   5.139
  137   1HD1  ILE  19          HD12      ILE  19  55.979   5.507   3.197
  138   2HD1  ILE  19          HD11      ILE  19  57.055   6.006   1.890
  139   3HD1  ILE  19          HD13      ILE  19  55.644   5.007   1.540
  140    H    ALA  20           HN       ALA  20  54.086   0.590   2.272
  141    HA   ALA  20           HA       ALA  20  54.156  -0.839   4.768
  142   1HB   ALA  20           HB2      ALA  20  52.085  -0.083   3.478
  143   2HB   ALA  20           HB1      ALA  20  52.352  -1.470   2.422
  144   3HB   ALA  20           HB3      ALA  20  52.024  -1.717   4.137
  145    H    GLU  21           HN       GLU  21  54.602  -1.875   1.384
  146    HA   GLU  21           HA       GLU  21  55.081  -4.648   2.153
  147   1HB   GLU  21           HB2      GLU  21  55.456  -3.125  -0.436
  148   2HB   GLU  21           HB1      GLU  21  55.827  -4.839  -0.269
  149   1HG   GLU  21           HG2      GLU  21  53.628  -4.974  -0.989
  150   2HG   GLU  21           HG1      GLU  21  53.379  -4.924   0.757
  151    H    PHE  22           HN       PHE  22  57.100  -1.867   1.237
  152    HA   PHE  22           HA       PHE  22  59.599  -3.141   1.057
  153   1HB   PHE  22           HB2      PHE  22  58.714  -0.401   1.884
  154   2HB   PHE  22           HB1      PHE  22  60.398  -0.856   2.148
  155    HD1  PHE  22           HD1      PHE  22  61.414  -2.250   0.027
  156    HD2  PHE  22           HD2      PHE  22  58.260   0.664  -0.130
  157    HE1  PHE  22           HE1      PHE  22  61.895  -1.856  -2.373
  158    HE2  PHE  22           HE2      PHE  22  58.743   1.058  -2.531
  159    HZ   PHE  22           HZ       PHE  22  60.560  -0.204  -3.652
  160    H    LYS  23           HN       LYS  23  57.944  -1.920   3.975
  161    HA   LYS  23           HA       LYS  23  59.986  -2.553   5.842
  162   1HB   LYS  23           HB2      LYS  23  57.977  -1.211   6.398
  163   2HB   LYS  23           HB1      LYS  23  56.982  -2.659   6.252
  164   1HG   LYS  23           HG2      LYS  23  57.433  -2.445   8.580
  165   2HG   LYS  23           HG1      LYS  23  58.521  -3.711   8.010
  166   1HD   LYS  23           HD2      LYS  23  60.051  -2.424   9.154
  167   2HD   LYS  23           HD1      LYS  23  60.123  -1.608   7.591
  168   1HE   LYS  23           HE2      LYS  23  59.138   0.271   8.394
  169   2HE   LYS  23           HE1      LYS  23  57.959  -0.642   9.337
  170   1HZ   LYS  23           HZ1      LYS  23  60.324  -1.144  10.582
  171   2HZ   LYS  23           HZ3      LYS  23  60.461   0.489  10.152
  172   3HZ   LYS  23           HZ2      LYS  23  59.148  -0.031  11.097
  173    H    ALA  24           HN       ALA  24  57.528  -4.577   4.328
  174    HA   ALA  24           HA       ALA  24  57.596  -6.839   5.983
  175   1HB   ALA  24           HB2      ALA  24  56.348  -6.326   3.686
  176   2HB   ALA  24           HB1      ALA  24  57.691  -7.257   3.023
  177   3HB   ALA  24           HB3      ALA  24  56.621  -7.985   4.224
  178    H    ALA  25           HN       ALA  25  59.848  -5.968   3.355
  179    HA   ALA  25           HA       ALA  25  61.496  -8.329   3.783
  180   1HB   ALA  25           HB2      ALA  25  62.073  -5.751   2.291
  181   2HB   ALA  25           HB1      ALA  25  63.063  -7.208   2.220
  182   3HB   ALA  25           HB3      ALA  25  61.417  -7.230   1.586
  183    H    PHE  26           HN       PHE  26  62.028  -4.836   4.385
  184    HA   PHE  26           HA       PHE  26  64.475  -4.896   5.654
  185   1HB   PHE  26           HB2      PHE  26  63.002  -2.873   5.276
  186   2HB   PHE  26           HB1      PHE  26  62.110  -3.337   6.727
  187    HD1  PHE  26           HD2      PHE  26  63.153  -3.242   8.938
  188    HD2  PHE  26           HD1      PHE  26  65.288  -2.066   5.407
  189    HE1  PHE  26           HE2      PHE  26  64.880  -2.154  10.348
  190    HE2  PHE  26           HE1      PHE  26  67.018  -0.976   6.814
  191    HZ   PHE  26           HZ       PHE  26  66.812  -1.021   9.286
  192    H    ASP  27           HN       ASP  27  61.461  -4.957   7.593
  193    HA   ASP  27           HA       ASP  27  62.641  -5.817   9.992
  194   1HB   ASP  27           HB2      ASP  27  60.190  -5.099   9.493
  195   2HB   ASP  27           HB1      ASP  27  59.922  -6.810   9.155
  196    H    MET  28           HN       MET  28  61.809  -7.679   7.138
  197    HA   MET  28           HA       MET  28  61.825 -10.290   8.243
  198   1HB   MET  28           HB2      MET  28  61.738  -9.165   5.669
  199   2HB   MET  28           HB1      MET  28  63.160 -10.208   5.667
  200   1HG   MET  28           HG2      MET  28  61.116 -11.620   7.036
  201   2HG   MET  28           HG1      MET  28  60.386 -10.963   5.571
  202   1HE   MET  28           HE3      MET  28  62.685 -10.591   3.731
  203   2HE   MET  28           HE2      MET  28  62.897 -12.088   2.825
  204   3HE   MET  28           HE1      MET  28  61.276 -11.452   3.096
  205    H    PHE  29           HN       PHE  29  64.522  -8.269   7.089
  206    HA   PHE  29           HA       PHE  29  66.418 -10.301   8.168
  207   1HB   PHE  29           HB2      PHE  29  67.223  -7.873   6.582
  208   2HB   PHE  29           HB1      PHE  29  68.043  -9.430   6.714
  209    HD1  PHE  29           HD1      PHE  29  65.803 -11.315   6.305
  210    HD2  PHE  29           HD2      PHE  29  66.752  -7.652   4.276
  211    HE1  PHE  29           HE1      PHE  29  64.606 -12.124   4.287
  212    HE2  PHE  29           HE2      PHE  29  65.553  -8.459   2.258
  213    HZ   PHE  29           HZ       PHE  29  64.482 -10.695   2.266
  214    H    ASP  30           HN       ASP  30  65.016  -8.776  10.058
  215    HA   ASP  30           HA       ASP  30  67.104  -6.850  10.999
  216   1HB   ASP  30           HB2      ASP  30  65.379  -5.665  12.187
  217   2HB   ASP  30           HB1      ASP  30  64.786  -5.925  10.546
  218    H    ALA  31           HN       ALA  31  67.728  -9.415  11.525
  219    HA   ALA  31           HA       ALA  31  66.566 -10.356  14.029
  220   1HB   ALA  31           HB1      ALA  31  67.773 -11.703  12.111
  221   2HB   ALA  31           HB3      ALA  31  69.233 -11.283  13.007
  222   3HB   ALA  31           HB2      ALA  31  67.955 -12.214  13.789
  223    H    ASP  32           HN       ASP  32  68.518  -7.784  13.408
  224    HA   ASP  32           HA       ASP  32  70.544  -8.099  15.451
  225   1HB   ASP  32           HB2      ASP  32  69.841  -6.155  13.473
  226   2HB   ASP  32           HB1      ASP  32  69.956  -5.337  15.031
  227    H    GLY  33           HN       GLY  33  67.216  -7.028  15.427
  228   1HA   GLY  33           HA2      GLY  33  65.864  -6.980  17.425
  229   2HA   GLY  33           HA1      GLY  33  67.334  -6.806  18.383
  230    H    GLY  34           HN       GLY  34  68.417  -4.683  16.643
  231   1HA   GLY  34           HA2      GLY  34  66.982  -2.441  17.883
  232   2HA   GLY  34           HA1      GLY  34  68.480  -2.328  16.957
  233    H    GLY  35           HN       GLY  35  66.455  -4.197  15.141
  234   1HA   GLY  35           HA2      GLY  35  64.983  -3.751  13.350
  235   2HA   GLY  35           HA1      GLY  35  64.777  -2.116  13.982
  236    H    ASP  36           HN       ASP  36  67.436  -4.065  12.565
  237    HA   ASP  36           HA       ASP  36  67.818  -2.054  10.467
  238   1HB   ASP  36           HB2      ASP  36  70.048  -1.397  11.076
  239   2HB   ASP  36           HB1      ASP  36  69.042  -1.158  12.506
  240    H    ILE  37           HN       ILE  37  68.939  -2.931   8.709
  241    HA   ILE  37           HA       ILE  37  69.694  -5.802   9.012
  242    HB   ILE  37           HB       ILE  37  68.068  -5.820   7.371
  243   1HG1  ILE  37          HG12      ILE  37  70.613  -5.175   5.855
  244   2HG1  ILE  37          HG11      ILE  37  70.007  -6.775   6.285
  245   1HG2  ILE  37          HG22      ILE  37  69.111  -3.142   6.410
  246   2HG2  ILE  37          HG21      ILE  37  67.716  -3.994   5.747
  247   3HG2  ILE  37          HG23      ILE  37  67.676  -3.395   7.406
  248   1HD1  ILE  37          HD11      ILE  37  68.515  -4.824   4.515
  249   2HD1  ILE  37          HD13      ILE  37  69.545  -6.117   3.901
  250   3HD1  ILE  37          HD12      ILE  37  68.097  -6.507   4.828
  251    H    SER  38           HN       SER  38  71.489  -6.461   7.449
  252    HA   SER  38           HA       SER  38  73.688  -4.476   7.717
  253   1HB   SER  38           HB2      SER  38  73.931  -7.366   6.860
  254   2HB   SER  38           HB1      SER  38  75.197  -6.316   7.489
  255    HG   SER  38           HG       SER  38  74.363  -6.483   9.480
  256    H    THR  39           HN       THR  39  74.872  -3.767   5.907
  257    HA   THR  39           HA       THR  39  73.510  -3.523   3.428
  258    HB   THR  39           HB       THR  39  75.828  -2.921   2.534
  259    HG1  THR  39           HG1      THR  39  77.278  -2.605   4.461
  260   1HG2  THR  39          HG23      THR  39  74.771  -1.616   5.054
  261   2HG2  THR  39          HG22      THR  39  75.996  -0.893   4.010
  262   3HG2  THR  39          HG21      THR  39  74.372  -1.189   3.389
  263    H    LYS  40           HN       LYS  40  75.601  -6.040   4.673
  264    HA   LYS  40           HA       LYS  40  76.134  -7.294   2.127
  265   1HB   LYS  40           HB2      LYS  40  77.646  -8.160   3.601
  266   2HB   LYS  40           HB1      LYS  40  76.604  -7.858   4.987
  267   1HG   LYS  40           HG2      LYS  40  75.302  -9.860   4.490
  268   2HG   LYS  40           HG1      LYS  40  76.247 -10.146   3.028
  269   1HD   LYS  40           HD2      LYS  40  78.053  -9.819   5.230
  270   2HD   LYS  40           HD1      LYS  40  76.831 -11.008   5.679
  271   1HE   LYS  40           HE2      LYS  40  77.678 -11.426   2.945
  272   2HE   LYS  40           HE1      LYS  40  79.071 -11.431   4.026
  273   1HZ   LYS  40           HZ2      LYS  40  76.773 -12.868   5.017
  274   2HZ   LYS  40           HZ1      LYS  40  77.456 -13.534   3.612
  275   3HZ   LYS  40           HZ3      LYS  40  78.410 -13.318   4.998
  276    H    ALA  41           HN       ALA  41  73.588  -7.530   4.555
  277    HA   ALA  41           HA       ALA  41  72.304  -9.829   3.295
  278   1HB   ALA  41           HB2      ALA  41  72.135  -8.855   5.780
  279   2HB   ALA  41           HB1      ALA  41  70.788  -7.961   5.074
  280   3HB   ALA  41           HB3      ALA  41  70.789  -9.725   5.043
  281    H    LEU  42           HN       LEU  42  72.483  -6.506   2.617
  282    HA   LEU  42           HA       LEU  42  69.874  -5.953   1.635
  283   1HB   LEU  42           HB2      LEU  42  72.458  -4.709   1.566
  284   2HB   LEU  42           HB1      LEU  42  71.764  -4.667  -0.056
  285    HG   LEU  42           HG       LEU  42  69.757  -3.609   0.753
  286   1HD1  LEU  42          HD12      LEU  42  70.854  -4.461   3.393
  287   2HD1  LEU  42          HD11      LEU  42  69.916  -2.968   3.344
  288   3HD1  LEU  42          HD13      LEU  42  69.190  -4.483   2.810
  289   1HD2  LEU  42          HD23      LEU  42  72.323  -2.436   1.823
  290   2HD2  LEU  42          HD22      LEU  42  71.447  -1.989   0.361
  291   3HD2  LEU  42          HD21      LEU  42  70.789  -1.574   1.944
  292    H    GLY  43           HN       GLY  43  72.720  -7.340  -0.026
  293   1HA   GLY  43           HA2      GLY  43  71.760  -7.540  -2.625
  294   2HA   GLY  43           HA1      GLY  43  72.743  -8.804  -1.880
  295    H    THR  44           HN       THR  44  70.740  -9.334   0.213
  296    HA   THR  44           HA       THR  44  69.141 -11.273  -1.249
  297    HB   THR  44           HB       THR  44  69.231 -10.422   1.653
  298    HG1  THR  44           HG1      THR  44  70.931 -11.670   1.239
  299   1HG2  THR  44          HG23      THR  44  67.248 -12.036   0.188
  300   2HG2  THR  44          HG22      THR  44  67.913 -12.823   1.619
  301   3HG2  THR  44          HG21      THR  44  67.120 -11.255   1.764
  302    H    VAL  45           HN       VAL  45  68.453  -8.222   0.478
  303    HA   VAL  45           HA       VAL  45  65.619  -8.311   0.159
  304    HB   VAL  45           HB       VAL  45  67.247  -5.767   0.121
  305   1HG1  VAL  45          HG11      VAL  45  64.497  -6.595   1.061
  306   2HG1  VAL  45          HG13      VAL  45  65.256  -5.103   1.615
  307   3HG1  VAL  45          HG12      VAL  45  64.922  -5.336  -0.100
  308   1HG2  VAL  45          HG21      VAL  45  67.406  -7.859   2.048
  309   2HG2  VAL  45          HG23      VAL  45  68.093  -6.238   2.156
  310   3HG2  VAL  45          HG22      VAL  45  66.472  -6.552   2.773
  311    H    MET  46           HN       MET  46  68.052  -6.574  -1.815
  312    HA   MET  46           HA       MET  46  66.394  -5.540  -3.792
  313   1HB   MET  46           HB2      MET  46  69.112  -6.828  -4.184
  314   2HB   MET  46           HB1      MET  46  68.326  -5.750  -5.336
  315   1HG   MET  46           HG2      MET  46  68.158  -4.245  -3.084
  316   2HG   MET  46           HG1      MET  46  69.655  -5.120  -2.762
  317   1HE   MET  46           HE1      MET  46  68.473  -2.311  -3.308
  318   2HE   MET  46           HE3      MET  46  70.108  -1.651  -3.469
  319   3HE   MET  46           HE2      MET  46  68.953  -1.485  -4.789
  320    H    ARG  47           HN       ARG  47  68.122  -8.653  -4.218
  321    HA   ARG  47           HA       ARG  47  66.654  -9.543  -6.443
  322   1HB   ARG  47           HB2      ARG  47  68.318 -10.807  -4.357
  323   2HB   ARG  47           HB1      ARG  47  67.148 -11.889  -5.114
  324   1HG   ARG  47           HG2      ARG  47  68.053 -10.706  -7.332
  325   2HG   ARG  47           HG1      ARG  47  69.483 -10.477  -6.325
  326   1HD   ARG  47           HD2      ARG  47  68.108 -13.151  -6.673
  327   2HD   ARG  47           HD1      ARG  47  69.471 -12.628  -7.660
  328    HE   ARG  47           HE       ARG  47  69.621 -13.027  -4.700
  329   1HH1  ARG  47          HH21      ARG  47  71.937 -11.739  -4.854
  330   2HH1  ARG  47          HH22      ARG  47  73.090 -12.740  -5.672
  331   1HH2  ARG  47          HH11      ARG  47  70.692 -14.824  -7.062
  332   2HH2  ARG  47          HH12      ARG  47  72.385 -14.487  -6.922
  333    H    MET  48           HN       MET  48  65.755  -9.500  -3.058
  334    HA   MET  48           HA       MET  48  63.585 -11.366  -3.197
  335   1HB   MET  48           HB2      MET  48  64.740  -9.699  -1.237
  336   2HB   MET  48           HB1      MET  48  63.051  -9.202  -1.352
  337   1HG   MET  48           HG2      MET  48  63.406 -12.114  -1.412
  338   2HG   MET  48           HG1      MET  48  63.976 -11.374   0.083
  339   1HE   MET  48           HE3      MET  48  62.872  -9.346   0.898
  340   2HE   MET  48           HE2      MET  48  61.521  -8.674  -0.011
  341   3HE   MET  48           HE1      MET  48  61.224  -9.467   1.533
  342    H    LEU  49           HN       LEU  49  63.762  -7.856  -3.743
  343    HA   LEU  49           HA       LEU  49  60.909  -7.575  -4.186
  344   1HB   LEU  49           HB2      LEU  49  62.880  -5.654  -5.368
  345   2HB   LEU  49           HB1      LEU  49  61.351  -5.329  -4.550
  346    HG   LEU  49           HG       LEU  49  64.012  -6.058  -3.319
  347   1HD1  LEU  49          HD13      LEU  49  63.141  -3.643  -3.829
  348   2HD1  LEU  49          HD12      LEU  49  62.095  -3.915  -2.436
  349   3HD1  LEU  49          HD11      LEU  49  63.846  -3.982  -2.250
  350   1HD2  LEU  49          HD23      LEU  49  61.293  -6.706  -2.391
  351   2HD2  LEU  49          HD22      LEU  49  62.846  -7.334  -1.839
  352   3HD2  LEU  49          HD21      LEU  49  62.243  -5.799  -1.213
  353    H    GLY  50           HN       GLY  50  63.558  -8.650  -6.119
  354   1HA   GLY  50           HA2      GLY  50  62.884  -9.894  -8.185
  355   2HA   GLY  50           HA1      GLY  50  61.779  -8.560  -8.524
  356    H    GLN  51           HN       GLN  51  64.855  -7.724  -7.199
  357    HA   GLN  51           HA       GLN  51  65.599  -6.528  -9.816
  358   1HB   GLN  51           HB2      GLN  51  66.379  -6.002  -6.957
  359   2HB   GLN  51           HB1      GLN  51  67.412  -5.442  -8.273
  360   1HG   GLN  51           HG2      GLN  51  64.511  -4.879  -8.563
  361   2HG   GLN  51           HG1      GLN  51  65.356  -3.979  -7.302
  362   1HE2  GLN  51          HE22      GLN  51  66.925  -1.832  -9.600
  363   2HE2  GLN  51          HE21      GLN  51  66.490  -2.152  -7.990
  364    H    ASN  52           HN       ASN  52  67.634  -6.972 -10.779
  365    HA   ASN  52           HA       ASN  52  69.356  -9.000  -9.472
  366   1HB   ASN  52           HB2      ASN  52  69.389 -10.118 -11.875
  367   2HB   ASN  52           HB1      ASN  52  68.140 -10.546 -10.705
  368   1HD2  ASN  52          HD22      ASN  52  66.847  -7.709 -13.364
  369   2HD2  ASN  52          HD21      ASN  52  68.273  -7.450 -12.479
  370    HA   PRO  53           HA       PRO  53  71.538  -5.715 -11.971
  371   1HB   PRO  53           HB2      PRO  53  72.653  -4.382  -9.843
  372   2HB   PRO  53           HB1      PRO  53  71.086  -3.954 -10.550
  373   1HG   PRO  53           HG2      PRO  53  71.664  -5.353  -7.981
  374   2HG   PRO  53           HG1      PRO  53  70.260  -4.372  -8.433
  375   1HD   PRO  53           HD2      PRO  53  70.352  -7.201  -8.357
  376   2HD   PRO  53           HD1      PRO  53  69.082  -6.216  -9.111
  377    H    THR  54           HN       THR  54  74.078  -5.076 -11.287
  378    HA   THR  54           HA       THR  54  75.376  -7.725 -11.056
  379    HB   THR  54           HB       THR  54  77.455  -6.383 -11.640
  380    HG1  THR  54           HG1      THR  54  77.150  -4.333 -11.302
  381   1HG2  THR  54          HG21      THR  54  75.016  -6.611 -13.368
  382   2HG2  THR  54          HG23      THR  54  76.441  -5.784 -14.002
  383   3HG2  THR  54          HG22      THR  54  76.554  -7.467 -13.487
  384    H    LYS  55           HN       LYS  55  76.765  -8.270  -9.360
  385    HA   LYS  55           HA       LYS  55  76.342  -7.357  -6.786
  386   1HB   LYS  55           HB2      LYS  55  77.771  -9.330  -7.479
  387   2HB   LYS  55           HB1      LYS  55  79.076  -8.186  -7.796
  388   1HG   LYS  55           HG2      LYS  55  79.585  -8.088  -5.607
  389   2HG   LYS  55           HG1      LYS  55  77.923  -7.653  -5.205
  390   1HD   LYS  55           HD2      LYS  55  77.464 -10.215  -5.615
  391   2HD   LYS  55           HD1      LYS  55  79.195 -10.369  -5.313
  392   1HE   LYS  55           HE2      LYS  55  78.986  -9.862  -3.100
  393   2HE   LYS  55           HE1      LYS  55  77.741  -8.648  -3.397
  394   1HZ   LYS  55           HZ3      LYS  55  76.925 -11.354  -3.968
  395   2HZ   LYS  55           HZ2      LYS  55  77.294 -11.076  -2.333
  396   3HZ   LYS  55           HZ1      LYS  55  76.114 -10.134  -3.113
  397    H    GLU  56           HN       GLU  56  78.478  -5.933  -9.217
  398    HA   GLU  56           HA       GLU  56  79.814  -4.088  -7.484
  399   1HB   GLU  56           HB2      GLU  56  79.473  -4.464 -10.383
  400   2HB   GLU  56           HB1      GLU  56  79.678  -2.779  -9.904
  401   1HG   GLU  56           HG2      GLU  56  81.503  -5.027  -9.010
  402   2HG   GLU  56           HG1      GLU  56  81.848  -3.958 -10.369
  403    H    GLU  57           HN       GLU  57  76.904  -3.693  -9.530
  404    HA   GLU  57           HA       GLU  57  76.318  -1.015  -8.960
  405   1HB   GLU  57           HB2      GLU  57  74.994  -3.110 -10.213
  406   2HB   GLU  57           HB1      GLU  57  73.930  -2.705  -8.865
  407   1HG   GLU  57           HG2      GLU  57  73.515  -0.572  -9.650
  408   2HG   GLU  57           HG1      GLU  57  75.075  -0.456 -10.465
  409    H    LEU  58           HN       LEU  58  75.835  -3.866  -6.936
  410    HA   LEU  58           HA       LEU  58  74.219  -2.536  -4.945
  411   1HB   LEU  58           HB2      LEU  58  75.673  -5.121  -5.179
  412   2HB   LEU  58           HB1      LEU  58  75.364  -4.542  -3.541
  413    HG   LEU  58           HG       LEU  58  72.992  -4.128  -5.080
  414   1HD1  LEU  58          HD12      LEU  58  74.369  -6.168  -6.260
  415   2HD1  LEU  58          HD11      LEU  58  73.460  -7.050  -5.032
  416   3HD1  LEU  58          HD13      LEU  58  72.609  -6.065  -6.222
  417   1HD2  LEU  58          HD22      LEU  58  73.246  -4.514  -2.607
  418   2HD2  LEU  58          HD21      LEU  58  72.014  -5.530  -3.354
  419   3HD2  LEU  58          HD23      LEU  58  73.591  -6.208  -2.953
  420    H    ASP  59           HN       ASP  59  77.694  -3.440  -4.964
  421    HA   ASP  59           HA       ASP  59  78.461  -2.281  -2.543
  422   1HB   ASP  59           HB2      ASP  59  79.842  -3.465  -4.504
  423   2HB   ASP  59           HB1      ASP  59  80.228  -1.791  -4.905
  424    H    ALA  60           HN       ALA  60  77.932  -0.659  -5.663
  425    HA   ALA  60           HA       ALA  60  78.789   1.941  -4.729
  426   1HB   ALA  60           HB2      ALA  60  77.504   0.823  -7.143
  427   2HB   ALA  60           HB1      ALA  60  77.065   2.492  -6.782
  428   3HB   ALA  60           HB3      ALA  60  78.759   2.054  -7.005
  429    H    ILE  61           HN       ILE  61  75.636   0.319  -4.975
  430    HA   ILE  61           HA       ILE  61  73.995   2.510  -4.231
  431    HB   ILE  61           HB       ILE  61  73.736  -0.479  -3.890
  432   1HG1  ILE  61          HG12      ILE  61  71.939   1.371  -5.442
  433   2HG1  ILE  61          HG11      ILE  61  73.496   0.886  -6.115
  434   1HG2  ILE  61          HG23      ILE  61  72.266   1.598  -2.478
  435   2HG2  ILE  61          HG22      ILE  61  71.199   0.639  -3.505
  436   3HG2  ILE  61          HG21      ILE  61  72.191  -0.152  -2.281
  437   1HD1  ILE  61          HD12      ILE  61  71.333  -1.014  -5.155
  438   2HD1  ILE  61          HD11      ILE  61  71.688  -0.640  -6.842
  439   3HD1  ILE  61          HD13      ILE  61  72.883  -1.484  -5.855
  440    H    ILE  62           HN       ILE  62  75.124  -0.124  -2.076
  441    HA   ILE  62           HA       ILE  62  74.351   1.016   0.364
  442    HB   ILE  62           HB       ILE  62  76.714  -0.733  -0.346
  443   1HG1  ILE  62          HG12      ILE  62  74.523  -1.687   1.387
  444   2HG1  ILE  62          HG11      ILE  62  74.029  -1.276  -0.255
  445   1HG2  ILE  62          HG21      ILE  62  77.236   0.544   1.704
  446   2HG2  ILE  62          HG23      ILE  62  75.701   0.036   2.409
  447   3HG2  ILE  62          HG22      ILE  62  76.954  -1.159   2.069
  448   1HD1  ILE  62          HD12      ILE  62  76.485  -2.951   0.218
  449   2HD1  ILE  62          HD11      ILE  62  74.885  -3.693   0.214
  450   3HD1  ILE  62          HD13      ILE  62  75.471  -2.856  -1.223
  451    H    GLU  63           HN       GLU  63  77.245   1.677  -1.574
  452    HA   GLU  63           HA       GLU  63  78.575   3.284   0.404
  453   1HB   GLU  63           HB2      GLU  63  78.825   2.863  -2.541
  454   2HB   GLU  63           HB1      GLU  63  79.584   4.299  -1.852
  455   1HG   GLU  63           HG2      GLU  63  80.843   2.936  -0.275
  456   2HG   GLU  63           HG1      GLU  63  80.013   1.479  -0.826
  457    H    GLU  64           HN       GLU  64  76.159   4.024  -2.070
  458    HA   GLU  64           HA       GLU  64  76.309   6.905  -1.381
  459   1HB   GLU  64           HB2      GLU  64  74.657   5.432  -3.458
  460   2HB   GLU  64           HB1      GLU  64  74.693   7.184  -3.247
  461   1HG   GLU  64           HG2      GLU  64  77.262   5.672  -3.641
  462   2HG   GLU  64           HG1      GLU  64  76.263   6.086  -5.034
  463    H    VAL  65           HN       VAL  65  74.777   4.219  -0.178
  464    HA   VAL  65           HA       VAL  65  72.223   5.620   0.393
  465    HB   VAL  65           HB       VAL  65  73.172   2.786   0.880
  466   1HG1  VAL  65          HG12      VAL  65  71.186   4.303   2.301
  467   2HG1  VAL  65          HG11      VAL  65  70.381   3.060   1.341
  468   3HG1  VAL  65          HG13      VAL  65  71.627   2.608   2.506
  469   1HG2  VAL  65          HG21      VAL  65  72.396   3.653  -1.433
  470   2HG2  VAL  65          HG23      VAL  65  71.620   2.196  -0.812
  471   3HG2  VAL  65          HG22      VAL  65  70.790   3.749  -0.709
  472    H    ASP  66           HN       ASP  66  74.843   3.968   2.196
  473    HA   ASP  66           HA       ASP  66  73.904   4.968   4.753
  474   1HB   ASP  66           HB2      ASP  66  75.707   3.018   3.929
  475   2HB   ASP  66           HB1      ASP  66  76.738   4.256   4.648
  476    H    GLU  67           HN       GLU  67  73.749   7.275   4.266
  477    HA   GLU  67           HA       GLU  67  76.028   8.827   3.445
  478   1HB   GLU  67           HB2      GLU  67  74.715  10.756   4.053
  479   2HB   GLU  67           HB1      GLU  67  73.612   9.572   3.353
  480   1HG   GLU  67           HG2      GLU  67  73.525   8.824   5.962
  481   2HG   GLU  67           HG1      GLU  67  73.802  10.556   6.140
  482    H    ASP  68           HN       ASP  68  75.299   7.251   6.370
  483    HA   ASP  68           HA       ASP  68  77.006   9.111   7.950
  484   1HB   ASP  68           HB2      ASP  68  76.269   7.492   9.846
  485   2HB   ASP  68           HB1      ASP  68  75.064   8.598   9.183
  486    H    GLY  69           HN       GLY  69  77.060   6.051   6.354
  487   1HA   GLY  69           HA2      GLY  69  78.718   4.395   6.219
  488   2HA   GLY  69           HA1      GLY  69  79.848   5.684   6.639
  489    H    SER  70           HN       SER  70  77.192   4.658   8.718
  490    HA   SER  70           HA       SER  70  78.999   4.286  10.953
  491   1HB   SER  70           HB2      SER  70  76.817   3.266  11.974
  492   2HB   SER  70           HB1      SER  70  76.861   4.988  11.605
  493    HG   SER  70           HG       SER  70  75.310   3.031  10.564
  494    H    GLY  71           HN       GLY  71  77.756   2.225   8.459
  495   1HA   GLY  71           HA2      GLY  71  78.915   0.095   8.038
  496   2HA   GLY  71           HA1      GLY  71  79.111  -0.085   9.783
  497    H    THR  72           HN       THR  72  76.056   1.142   9.019
  498    HA   THR  72           HA       THR  72  74.790  -1.490   8.632
  499    HB   THR  72           HB       THR  72  73.257  -0.804  10.690
  500    HG1  THR  72           HG1      THR  72  74.915   1.074  10.830
  501   1HG2  THR  72          HG21      THR  72  74.786  -2.847  10.326
  502   2HG2  THR  72          HG23      THR  72  75.977  -1.964  11.281
  503   3HG2  THR  72          HG22      THR  72  74.424  -2.397  11.992
  504    H    ILE  73           HN       ILE  73  72.780  -1.278   7.645
  505    HA   ILE  73           HA       ILE  73  71.970   1.511   6.985
  506    HB   ILE  73           HB       ILE  73  71.490  -1.160   5.668
  507   1HG1  ILE  73          HG12      ILE  73  72.827   1.456   4.984
  508   2HG1  ILE  73          HG11      ILE  73  73.501  -0.170   4.928
  509   1HG2  ILE  73          HG22      ILE  73  70.085   1.476   5.124
  510   2HG2  ILE  73          HG21      ILE  73  70.029   0.076   4.055
  511   3HG2  ILE  73          HG23      ILE  73  69.328  -0.019   5.670
  512   1HD1  ILE  73          HD13      ILE  73  71.313   0.864   3.107
  513   2HD1  ILE  73          HD12      ILE  73  73.012   0.714   2.659
  514   3HD1  ILE  73          HD11      ILE  73  72.065  -0.728   3.025
  515    H    ASP  74           HN       ASP  74  69.667   2.044   7.075
  516    HA   ASP  74           HA       ASP  74  68.087   0.267   8.877
  517   1HB   ASP  74           HB2      ASP  74  69.190   2.441   9.908
  518   2HB   ASP  74           HB1      ASP  74  67.834   3.242   9.116
  519    H    PHE  75           HN       PHE  75  65.689   1.042   8.844
  520    HA   PHE  75           HA       PHE  75  64.647   0.799   6.247
  521   1HB   PHE  75           HB2      PHE  75  63.458   0.636   8.552
  522   2HB   PHE  75           HB1      PHE  75  63.214   2.375   8.381
  523    HD1  PHE  75           HD2      PHE  75  63.214  -0.350   5.818
  524    HD2  PHE  75           HD1      PHE  75  60.952   2.691   7.837
  525    HE1  PHE  75           HE2      PHE  75  61.297  -0.768   4.299
  526    HE2  PHE  75           HE1      PHE  75  59.036   2.275   6.320
  527    HZ   PHE  75           HZ       PHE  75  59.209   0.546   4.550
  528    H    GLU  76           HN       GLU  76  65.242   3.781   8.118
  529    HA   GLU  76           HA       GLU  76  64.187   5.651   6.304
  530   1HB   GLU  76           HB2      GLU  76  66.451   5.738   8.277
  531   2HB   GLU  76           HB1      GLU  76  66.185   7.112   7.203
  532   1HG   GLU  76           HG2      GLU  76  63.734   7.029   7.956
  533   2HG   GLU  76           HG1      GLU  76  64.278   5.946   9.237
  534    H    GLU  77           HN       GLU  77  67.602   4.545   6.441
  535    HA   GLU  77           HA       GLU  77  68.250   5.818   3.921
  536   1HB   GLU  77           HB2      GLU  77  69.755   3.559   5.265
  537   2HB   GLU  77           HB1      GLU  77  70.399   4.756   4.141
  538   1HG   GLU  77           HG2      GLU  77  70.173   6.519   5.727
  539   2HG   GLU  77           HG1      GLU  77  69.152   5.540   6.781
  540    H    PHE  78           HN       PHE  78  66.567   2.976   4.691
  541    HA   PHE  78           HA       PHE  78  67.413   1.284   2.525
  542   1HB   PHE  78           HB2      PHE  78  65.666   1.050   4.679
  543   2HB   PHE  78           HB1      PHE  78  64.605   0.980   3.272
  544    HD1  PHE  78           HD1      PHE  78  67.631  -0.527   4.828
  545    HD2  PHE  78           HD2      PHE  78  64.586  -0.914   1.824
  546    HE1  PHE  78           HE1      PHE  78  68.357  -2.858   4.392
  547    HE2  PHE  78           HE2      PHE  78  65.312  -3.245   1.388
  548    HZ   PHE  78           HZ       PHE  78  67.197  -4.217   2.671
  549    H    LEU  79           HN       LEU  79  64.351   3.119   2.841
  550    HA   LEU  79           HA       LEU  79  63.433   2.857   0.227
  551   1HB   LEU  79           HB2      LEU  79  63.296   5.376   1.914
  552   2HB   LEU  79           HB1      LEU  79  62.246   4.986   0.552
  553    HG   LEU  79           HG       LEU  79  62.500   3.198   2.980
  554   1HD1  LEU  79          HD12      LEU  79  60.679   5.543   2.440
  555   2HD1  LEU  79          HD11      LEU  79  60.186   4.227   3.507
  556   3HD1  LEU  79          HD13      LEU  79  61.612   5.189   3.895
  557   1HD2  LEU  79          HD23      LEU  79  61.206   3.015   0.419
  558   2HD2  LEU  79          HD22      LEU  79  61.220   1.833   1.728
  559   3HD2  LEU  79          HD21      LEU  79  59.974   3.080   1.679
  560    H    VAL  80           HN       VAL  80  66.068   4.859   1.393
  561    HA   VAL  80           HA       VAL  80  66.319   6.589  -0.863
  562    HB   VAL  80           HB       VAL  80  68.449   5.509   1.010
  563   1HG1  VAL  80          HG13      VAL  80  68.527   7.353  -1.305
  564   2HG1  VAL  80          HG12      VAL  80  69.330   7.943   0.151
  565   3HG1  VAL  80          HG11      VAL  80  69.825   6.412  -0.569
  566   1HG2  VAL  80          HG21      VAL  80  66.615   7.906   1.034
  567   2HG2  VAL  80          HG23      VAL  80  66.913   6.737   2.320
  568   3HG2  VAL  80          HG22      VAL  80  68.147   7.928   1.908
  569    H    MET  81           HN       MET  81  68.267   3.666  -0.130
  570    HA   MET  81           HA       MET  81  69.584   3.477  -2.592
  571   1HB   MET  81           HB2      MET  81  70.160   1.293  -1.984
  572   2HB   MET  81           HB1      MET  81  69.787   2.021  -0.425
  573   1HG   MET  81           HG2      MET  81  67.405   1.141  -0.750
  574   2HG   MET  81           HG1      MET  81  68.056   0.179  -2.078
  575   1HE   MET  81           HE3      MET  81  68.832   1.532   1.196
  576   2HE   MET  81           HE2      MET  81  69.002   0.182   2.315
  577   3HE   MET  81           HE1      MET  81  70.396   0.725   1.384
  578    H    MET  82           HN       MET  82  66.339   2.315  -1.743
  579    HA   MET  82           HA       MET  82  65.760   0.841  -4.076
  580   1HB   MET  82           HB2      MET  82  64.192   2.273  -2.012
  581   2HB   MET  82           HB1      MET  82  63.357   2.001  -3.543
  582   1HG   MET  82           HG2      MET  82  63.084   0.138  -1.861
  583   2HG   MET  82           HG1      MET  82  63.744  -0.373  -3.415
  584   1HE   MET  82           HE2      MET  82  64.667  -2.399  -2.854
  585   2HE   MET  82           HE1      MET  82  66.024  -1.631  -3.672
  586   3HE   MET  82           HE3      MET  82  66.296  -2.600  -2.218
  587    H    VAL  83           HN       VAL  83  64.416   4.100  -3.563
  588    HA   VAL  83           HA       VAL  83  63.943   4.606  -6.311
  589    HB   VAL  83           HB       VAL  83  64.494   6.640  -4.133
  590   1HG1  VAL  83          HG11      VAL  83  63.186   6.770  -6.856
  591   2HG1  VAL  83          HG13      VAL  83  62.874   7.979  -5.611
  592   3HG1  VAL  83          HG12      VAL  83  64.509   7.757  -6.235
  593   1HG2  VAL  83          HG22      VAL  83  62.002   5.135  -4.965
  594   2HG2  VAL  83          HG21      VAL  83  62.728   5.223  -3.361
  595   3HG2  VAL  83          HG23      VAL  83  61.934   6.639  -4.047
  596    H    ARG  84           HN       ARG  84  66.911   4.525  -4.631
  597    HA   ARG  84           HA       ARG  84  68.369   6.539  -6.050
  598   1HB   ARG  84           HB2      ARG  84  68.917   4.683  -4.035
  599   2HB   ARG  84           HB1      ARG  84  69.971   4.207  -5.364
  600   1HG   ARG  84           HG2      ARG  84  70.819   6.511  -5.534
  601   2HG   ARG  84           HG1      ARG  84  69.753   7.006  -4.219
  602   1HD   ARG  84           HD2      ARG  84  71.896   6.611  -3.224
  603   2HD   ARG  84           HD1      ARG  84  70.887   5.232  -2.791
  604    HE   ARG  84           HE       ARG  84  72.686   4.044  -3.773
  605   1HH1  ARG  84          HH11      ARG  84  73.521   6.863  -5.029
  606   2HH1  ARG  84          HH12      ARG  84  73.684   6.369  -6.682
  607   1HH2  ARG  84          HH21      ARG  84  72.099   3.322  -6.202
  608   2HH2  ARG  84          HH22      ARG  84  72.878   4.364  -7.345
  609    H    GLN  85           HN       GLN  85  67.521   3.210  -6.871
  610    HA   GLN  85           HA       GLN  85  69.069   3.545  -9.410
  611   1HB   GLN  85           HB2      GLN  85  68.837   1.345  -7.530
  612   2HB   GLN  85           HB1      GLN  85  68.377   0.843  -9.157
  613   1HG   GLN  85           HG2      GLN  85  70.727   2.542  -9.229
  614   2HG   GLN  85           HG1      GLN  85  70.990   1.150  -8.177
  615   1HE2  GLN  85          HE22      GLN  85  71.365   0.508 -12.032
  616   2HE2  GLN  85          HE21      GLN  85  71.649   1.972 -11.220
  617    H    MET  86           HN       MET  86  65.967   2.462  -8.050
  618    HA   MET  86           HA       MET  86  64.670   1.451 -10.265
  619   1HB   MET  86           HB2      MET  86  62.645   1.979  -9.229
  620   2HB   MET  86           HB1      MET  86  63.765   2.034  -7.871
  621   1HG   MET  86           HG2      MET  86  63.965   4.488  -8.146
  622   2HG   MET  86           HG1      MET  86  62.818   4.424  -9.483
  623   1HE   MET  86           HE1      MET  86  60.858   2.961  -9.333
  624   2HE   MET  86           HE3      MET  86  59.686   2.967  -8.007
  625   3HE   MET  86           HE2      MET  86  59.967   4.432  -8.946
  626    H    LYS  87           HN       LYS  87  65.093   4.931  -9.560
  627    HA   LYS  87           HA       LYS  87  63.694   5.987 -11.750
  628   1HB   LYS  87           HB2      LYS  87  66.268   6.964 -10.481
  629   2HB   LYS  87           HB1      LYS  87  65.297   7.912 -11.609
  630   1HG   LYS  87           HG2      LYS  87  63.899   6.706  -9.264
  631   2HG   LYS  87           HG1      LYS  87  64.944   8.095  -8.965
  632   1HD   LYS  87           HD2      LYS  87  63.521   9.532  -9.990
  633   2HD   LYS  87           HD1      LYS  87  63.211   8.412 -11.317
  634   1HE   LYS  87           HE2      LYS  87  61.355   7.551 -10.322
  635   2HE   LYS  87           HE1      LYS  87  62.095   7.566  -8.720
  636   1HZ   LYS  87           HZ1      LYS  87  61.837  10.180  -9.208
  637   2HZ   LYS  87           HZ3      LYS  87  60.483   9.580 -10.035
  638   3HZ   LYS  87           HZ2      LYS  87  60.678   9.252  -8.380
  639    H    GLU  88           HN       GLU  88  67.151   6.439 -12.049
  640    HA   GLU  88           HA       GLU  88  67.682   4.533 -14.097
  641   1HB   GLU  88           HB2      GLU  88  67.652   6.165 -16.052
  642   2HB   GLU  88           HB1      GLU  88  66.066   5.657 -15.470
  643   1HG   GLU  88           HG2      GLU  88  66.232   7.764 -13.932
  644   2HG   GLU  88           HG1      GLU  88  67.461   8.293 -15.082
  645    H    ASP  89           HN       ASP  89  69.880   4.534 -14.442
  646    HA   ASP  89           HA       ASP  89  71.384   7.039 -13.851
  647   1HB   ASP  89           HB2      ASP  89  71.272   4.932 -12.068
  648   2HB   ASP  89           HB1      ASP  89  72.743   4.584 -12.977
  649    H    ALA  90           HN       ALA  90  70.767   6.046 -16.415
  650    HA   ALA  90           HA       ALA  90  72.668   4.300 -17.569
  651   1HB   ALA  90           HB3      ALA  90  70.882   6.454 -18.554
  652   2HB   ALA  90           HB2      ALA  90  72.251   6.060 -19.595
  653   3HB   ALA  90           HB1      ALA  90  71.094   4.807 -19.148
   
  No H/Q in entry =         653
  Start of MODEL    3
    1   1H    ALA   1           HT2      ALA   1  68.202  11.118  11.865
    2   2H    ALA   1           HT1      ALA   1  68.488  10.638  10.259
    3   3H    ALA   1           HT3      ALA   1  68.892   9.600  11.537
    4    HA   ALA   1           HA       ALA   1  70.709  10.857  12.188
    5   1HB   ALA   1           HB3      ALA   1  70.334  10.626   9.232
    6   2HB   ALA   1           HB2      ALA   1  71.717  11.552   9.815
    7   3HB   ALA   1           HB1      ALA   1  71.532   9.858  10.273
    8    H    SER   2           HN       SER   2  70.227  12.863   9.355
    9    HA   SER   2           HA       SER   2  69.658  15.197  11.127
   10   1HB   SER   2           HB2      SER   2  71.268  16.249   9.141
   11   2HB   SER   2           HB1      SER   2  71.795  15.867  10.778
   12    HG   SER   2           HG       SER   2  73.139  14.768   9.422
   13    H    MET   3           HN       MET   3  67.705  13.886   9.663
   14    HA   MET   3           HA       MET   3  66.156  14.160   7.907
   15   1HB   MET   3           HB2      MET   3  66.398  16.483   9.440
   16   2HB   MET   3           HB1      MET   3  66.442  17.056   7.773
   17   1HG   MET   3           HG2      MET   3  64.387  15.725   7.299
   18   2HG   MET   3           HG1      MET   3  64.320  15.273   9.002
   19   1HE   MET   3           HE3      MET   3  64.089  16.392  10.737
   20   2HE   MET   3           HE2      MET   3  64.169  18.135  10.982
   21   3HE   MET   3           HE1      MET   3  62.606  17.355  10.759
   22    H    THR   4           HN       THR   4  68.710  13.586   6.885
   23    HA   THR   4           HA       THR   4  69.730  15.437   4.996
   24    HB   THR   4           HB       THR   4  70.784  13.541   3.926
   25    HG1  THR   4           HG1      THR   4  68.882  12.005   5.362
   26   1HG2  THR   4          HG23      THR   4  70.685  13.839   6.817
   27   2HG2  THR   4          HG22      THR   4  71.076  12.183   6.352
   28   3HG2  THR   4          HG21      THR   4  72.071  13.520   5.774
   29    H    ASP   5           HN       ASP   5  69.272  15.745   2.766
   30    HA   ASP   5           HA       ASP   5  66.497  15.537   2.028
   31   1HB   ASP   5           HB2      ASP   5  68.973  16.589   0.851
   32   2HB   ASP   5           HB1      ASP   5  67.864  15.923  -0.348
   33    H    GLN   6           HN       GLN   6  69.118  13.327   1.854
   34    HA   GLN   6           HA       GLN   6  68.500  11.821  -0.454
   35   1HB   GLN   6           HB2      GLN   6  69.524  10.878   2.241
   36   2HB   GLN   6           HB1      GLN   6  69.525   9.897   0.776
   37   1HG   GLN   6           HG2      GLN   6  70.761  12.621   0.662
   38   2HG   GLN   6           HG1      GLN   6  71.660  11.324   1.450
   39   1HE2  GLN   6          HE22      GLN   6  72.257   9.533  -1.577
   40   2HE2  GLN   6          HE21      GLN   6  72.237   9.421   0.117
   41    H    GLN   7           HN       GLN   7  67.216  11.466   2.866
   42    HA   GLN   7           HA       GLN   7  65.365   9.363   2.065
   43   1HB   GLN   7           HB2      GLN   7  65.110  11.059   4.550
   44   2HB   GLN   7           HB1      GLN   7  64.625   9.380   4.315
   45   1HG   GLN   7           HG2      GLN   7  67.100   8.866   3.930
   46   2HG   GLN   7           HG1      GLN   7  67.429  10.484   4.550
   47   1HE2  GLN   7          HE22      GLN   7  67.550   8.203   7.479
   48   2HE2  GLN   7          HE21      GLN   7  68.460   8.428   6.063
   49    H    ALA   8           HN       ALA   8  65.337  12.823   2.040
   50    HA   ALA   8           HA       ALA   8  62.468  13.177   2.137
   51   1HB   ALA   8           HB1      ALA   8  64.640  14.949   0.977
   52   2HB   ALA   8           HB3      ALA   8  62.964  15.438   1.231
   53   3HB   ALA   8           HB2      ALA   8  63.985  15.041   2.613
   54    H    GLU   9           HN       GLU   9  64.795  12.553  -0.441
   55    HA   GLU   9           HA       GLU   9  62.823  13.006  -2.557
   56   1HB   GLU   9           HB2      GLU   9  65.631  12.783  -2.424
   57   2HB   GLU   9           HB1      GLU   9  65.088  11.409  -3.388
   58   1HG   GLU   9           HG2      GLU   9  63.608  13.115  -4.641
   59   2HG   GLU   9           HG1      GLU   9  64.626  14.346  -3.891
   60    H    ALA  10           HN       ALA  10  64.223  10.217  -0.870
   61    HA   ALA  10           HA       ALA  10  63.028   8.206  -2.534
   62   1HB   ALA  10           HB2      ALA  10  64.884   7.831  -0.862
   63   2HB   ALA  10           HB1      ALA  10  63.678   7.972   0.417
   64   3HB   ALA  10           HB3      ALA  10  63.568   6.661  -0.756
   65    H    ARG  11           HN       ARG  11  61.982   9.597   0.593
   66    HA   ARG  11           HA       ARG  11  59.489   8.155   0.648
   67   1HB   ARG  11           HB2      ARG  11  60.892   9.931   2.355
   68   2HB   ARG  11           HB1      ARG  11  59.313  10.662   2.060
   69   1HG   ARG  11           HG2      ARG  11  58.155   8.805   2.927
   70   2HG   ARG  11           HG1      ARG  11  59.548   7.737   2.750
   71   1HD   ARG  11           HD2      ARG  11  60.399   8.337   4.760
   72   2HD   ARG  11           HD1      ARG  11  60.081  10.048   4.477
   73    HE   ARG  11           HE       ARG  11  58.127   9.799   5.758
   74   1HH1  ARG  11          HH11      ARG  11  59.371   6.753   4.752
   75   2HH1  ARG  11          HH12      ARG  11  58.041   5.846   5.391
   76   1HH2  ARG  11          HH21      ARG  11  56.294   8.646   6.454
   77   2HH2  ARG  11          HH22      ARG  11  56.301   6.917   6.355
   78    H    ALA  12           HN       ALA  12  60.543  11.047  -0.966
   79    HA   ALA  12           HA       ALA  12  57.890  12.167  -1.358
   80   1HB   ALA  12           HB2      ALA  12  60.035  13.486  -1.480
   81   2HB   ALA  12           HB1      ALA  12  60.389  12.664  -3.000
   82   3HB   ALA  12           HB3      ALA  12  58.976  13.711  -2.873
   83    H    PHE  13           HN       PHE  13  59.980   9.952  -3.144
   84    HA   PHE  13           HA       PHE  13  58.126   9.900  -5.437
   85   1HB   PHE  13           HB2      PHE  13  60.536   9.730  -5.865
   86   2HB   PHE  13           HB1      PHE  13  60.633   8.297  -4.843
   87    HD1  PHE  13           HD1      PHE  13  59.098   9.656  -7.954
   88    HD2  PHE  13           HD2      PHE  13  60.071   6.145  -5.677
   89    HE1  PHE  13           HE1      PHE  13  58.480   8.230  -9.887
   90    HE2  PHE  13           HE2      PHE  13  59.454   4.720  -7.613
   91    HZ   PHE  13           HZ       PHE  13  58.658   5.763  -9.717
   92    H    LEU  14           HN       LEU  14  58.750   8.114  -2.519
   93    HA   LEU  14           HA       LEU  14  57.145   5.809  -3.461
   94   1HB   LEU  14           HB2      LEU  14  58.398   6.239  -0.736
   95   2HB   LEU  14           HB1      LEU  14  57.828   4.717  -1.423
   96    HG   LEU  14           HG       LEU  14  59.981   6.342  -2.774
   97   1HD1  LEU  14          HD11      LEU  14  60.198   5.154  -0.223
   98   2HD1  LEU  14          HD13      LEU  14  60.992   4.044  -1.342
   99   3HD1  LEU  14          HD12      LEU  14  61.515   5.725  -1.248
  100   1HD2  LEU  14          HD23      LEU  14  59.040   3.465  -2.860
  101   2HD2  LEU  14          HD22      LEU  14  59.020   4.645  -4.172
  102   3HD2  LEU  14          HD21      LEU  14  60.553   3.994  -3.592
  103    H    SER  15           HN       SER  15  55.088   5.363  -2.681
  104    HA   SER  15           HA       SER  15  53.774   7.569  -1.192
  105   1HB   SER  15           HB2      SER  15  52.963   6.051  -3.367
  106   2HB   SER  15           HB1      SER  15  52.086   5.322  -2.025
  107    HG   SER  15           HG       SER  15  51.458   7.506  -1.461
  108    H    GLU  16           HN       GLU  16  52.273   6.959   0.592
  109    HA   GLU  16           HA       GLU  16  53.519   5.394   2.586
  110   1HB   GLU  16           HB2      GLU  16  51.047   6.844   2.286
  111   2HB   GLU  16           HB1      GLU  16  50.729   5.300   3.079
  112   1HG   GLU  16           HG2      GLU  16  53.005   6.073   4.367
  113   2HG   GLU  16           HG1      GLU  16  52.254   7.638   4.053
  114    H    GLU  17           HN       GLU  17  51.287   4.464   0.031
  115    HA   GLU  17           HA       GLU  17  50.651   1.858   1.093
  116   1HB   GLU  17           HB2      GLU  17  50.676   2.770  -1.802
  117   2HB   GLU  17           HB1      GLU  17  49.827   1.365  -1.156
  118   1HG   GLU  17           HG2      GLU  17  48.819   3.248   0.480
  119   2HG   GLU  17           HG1      GLU  17  49.152   4.256  -0.928
  120    H    MET  18           HN       MET  18  53.247   3.115  -0.945
  121    HA   MET  18           HA       MET  18  54.308   0.500  -1.624
  122   1HB   MET  18           HB2      MET  18  55.265   3.334  -1.874
  123   2HB   MET  18           HB1      MET  18  56.417   2.016  -2.091
  124   1HG   MET  18           HG2      MET  18  53.836   1.698  -3.509
  125   2HG   MET  18           HG1      MET  18  54.875   2.993  -4.102
  126   1HE   MET  18           HE3      MET  18  55.942   2.573  -6.050
  127   2HE   MET  18           HE2      MET  18  57.361   2.633  -5.007
  128   3HE   MET  18           HE1      MET  18  57.259   1.415  -6.275
  129    H    ILE  19           HN       ILE  19  55.537   3.076   0.550
  130    HA   ILE  19           HA       ILE  19  57.617   1.593   1.727
  131    HB   ILE  19           HB       ILE  19  55.828   3.743   2.887
  132   1HG1  ILE  19          HG12      ILE  19  58.606   4.417   2.565
  133   2HG1  ILE  19          HG11      ILE  19  58.004   3.732   1.054
  134   1HG2  ILE  19          HG23      ILE  19  58.366   2.544   4.039
  135   2HG2  ILE  19          HG22      ILE  19  57.520   3.954   4.677
  136   3HG2  ILE  19          HG21      ILE  19  56.746   2.369   4.716
  137   1HD1  ILE  19          HD12      ILE  19  56.077   5.303   1.141
  138   2HD1  ILE  19          HD11      ILE  19  56.754   6.021   2.602
  139   3HD1  ILE  19          HD13      ILE  19  57.622   6.151   1.073
  140    H    ALA  20           HN       ALA  20  54.177   1.309   2.173
  141    HA   ALA  20           HA       ALA  20  54.223  -0.031   4.720
  142   1HB   ALA  20           HB3      ALA  20  52.234   0.008   2.443
  143   2HB   ALA  20           HB2      ALA  20  51.957  -0.918   3.918
  144   3HB   ALA  20           HB1      ALA  20  52.123   0.836   3.996
  145    H    GLU  21           HN       GLU  21  54.299  -1.211   1.359
  146    HA   GLU  21           HA       GLU  21  54.357  -4.006   2.157
  147   1HB   GLU  21           HB2      GLU  21  54.803  -2.519  -0.424
  148   2HB   GLU  21           HB1      GLU  21  55.188  -4.238  -0.306
  149   1HG   GLU  21           HG2      GLU  21  52.613  -3.751   0.891
  150   2HG   GLU  21           HG1      GLU  21  52.642  -3.074  -0.739
  151    H    PHE  22           HN       PHE  22  56.829  -1.731   0.919
  152    HA   PHE  22           HA       PHE  22  59.038  -3.468   0.968
  153   1HB   PHE  22           HB2      PHE  22  58.819  -0.503   1.519
  154   2HB   PHE  22           HB1      PHE  22  60.371  -1.337   1.476
  155    HD1  PHE  22           HD1      PHE  22  60.553  -3.048  -0.645
  156    HD2  PHE  22           HD2      PHE  22  58.155   0.512  -0.460
  157    HE1  PHE  22           HE1      PHE  22  60.545  -2.922  -3.123
  158    HE2  PHE  22           HE2      PHE  22  58.149   0.636  -2.937
  159    HZ   PHE  22           HZ       PHE  22  59.343  -1.081  -4.268
  160    H    LYS  23           HN       LYS  23  57.568  -1.643   3.638
  161    HA   LYS  23           HA       LYS  23  59.473  -2.033   5.647
  162   1HB   LYS  23           HB2      LYS  23  57.511  -0.744   6.143
  163   2HB   LYS  23           HB1      LYS  23  56.451  -2.110   5.794
  164   1HG   LYS  23           HG2      LYS  23  56.751  -1.764   8.239
  165   2HG   LYS  23           HG1      LYS  23  57.354  -3.336   7.714
  166   1HD   LYS  23           HD2      LYS  23  59.483  -2.827   8.283
  167   2HD   LYS  23           HD1      LYS  23  59.382  -1.229   7.542
  168   1HE   LYS  23           HE2      LYS  23  59.710  -1.276  10.083
  169   2HE   LYS  23           HE1      LYS  23  58.384  -0.279   9.488
  170   1HZ   LYS  23           HZ3      LYS  23  57.577  -2.979   9.921
  171   2HZ   LYS  23           HZ2      LYS  23  58.203  -2.283  11.338
  172   3HZ   LYS  23           HZ1      LYS  23  56.905  -1.545  10.526
  173    H    ALA  24           HN       ALA  24  57.003  -4.324   4.507
  174    HA   ALA  24           HA       ALA  24  57.437  -6.370   6.412
  175   1HB   ALA  24           HB3      ALA  24  55.853  -6.086   4.196
  176   2HB   ALA  24           HB2      ALA  24  57.007  -7.299   3.644
  177   3HB   ALA  24           HB1      ALA  24  56.044  -7.592   5.093
  178    H    ALA  25           HN       ALA  25  59.115  -5.748   3.324
  179    HA   ALA  25           HA       ALA  25  60.836  -8.043   3.488
  180   1HB   ALA  25           HB2      ALA  25  60.416  -6.661   1.417
  181   2HB   ALA  25           HB1      ALA  25  61.442  -5.409   2.118
  182   3HB   ALA  25           HB3      ALA  25  62.120  -6.992   1.733
  183    H    PHE  26           HN       PHE  26  61.133  -4.713   4.671
  184    HA   PHE  26           HA       PHE  26  63.859  -4.770   5.432
  185   1HB   PHE  26           HB2      PHE  26  62.213  -2.795   5.510
  186   2HB   PHE  26           HB1      PHE  26  61.702  -3.433   7.073
  187    HD1  PHE  26           HD1      PHE  26  65.011  -3.044   5.335
  188    HD2  PHE  26           HD2      PHE  26  62.662  -2.280   8.851
  189    HE1  PHE  26           HE1      PHE  26  66.973  -1.981   6.416
  190    HE2  PHE  26           HE2      PHE  26  64.626  -1.216   9.931
  191    HZ   PHE  26           HZ       PHE  26  66.780  -1.066   8.714
  192    H    ASP  27           HN       ASP  27  61.031  -5.416   7.543
  193    HA   ASP  27           HA       ASP  27  62.503  -6.374   9.759
  194   1HB   ASP  27           HB2      ASP  27  60.421  -7.497  10.441
  195   2HB   ASP  27           HB1      ASP  27  60.080  -5.875   9.837
  196    H    MET  28           HN       MET  28  61.994  -7.807   6.674
  197    HA   MET  28           HA       MET  28  62.260 -10.575   7.455
  198   1HB   MET  28           HB2      MET  28  61.832  -9.142   5.052
  199   2HB   MET  28           HB1      MET  28  63.309 -10.078   4.813
  200   1HG   MET  28           HG2      MET  28  62.230 -12.109   5.070
  201   2HG   MET  28           HG1      MET  28  60.975 -11.431   6.106
  202   1HE   MET  28           HE2      MET  28  62.173  -9.552   3.064
  203   2HE   MET  28           HE1      MET  28  62.480 -11.180   2.467
  204   3HE   MET  28           HE3      MET  28  61.240 -10.174   1.705
  205    H    PHE  29           HN       PHE  29  64.568  -8.059   6.466
  206    HA   PHE  29           HA       PHE  29  66.838  -9.902   6.594
  207   1HB   PHE  29           HB2      PHE  29  67.210  -6.935   6.717
  208   2HB   PHE  29           HB1      PHE  29  68.117  -8.141   5.805
  209    HD1  PHE  29           HD1      PHE  29  66.312  -9.576   4.199
  210    HD2  PHE  29           HD2      PHE  29  66.098  -5.438   5.330
  211    HE1  PHE  29           HE1      PHE  29  64.930  -9.100   2.195
  212    HE2  PHE  29           HE2      PHE  29  64.715  -4.962   3.326
  213    HZ   PHE  29           HZ       PHE  29  64.131  -6.792   1.759
  214    H    ASP  30           HN       ASP  30  64.979  -8.237   8.875
  215    HA   ASP  30           HA       ASP  30  67.234  -8.099  10.818
  216   1HB   ASP  30           HB2      ASP  30  64.646  -6.692  10.502
  217   2HB   ASP  30           HB1      ASP  30  65.097  -7.083  12.162
  218    H    ALA  31           HN       ALA  31  67.250 -10.484  10.999
  219    HA   ALA  31           HA       ALA  31  64.915 -11.898  11.971
  220   1HB   ALA  31           HB2      ALA  31  67.589 -12.553  11.159
  221   2HB   ALA  31           HB1      ALA  31  67.284 -13.275  12.739
  222   3HB   ALA  31           HB3      ALA  31  66.215 -13.636  11.382
  223    H    ASP  32           HN       ASP  32  67.674 -10.298  13.492
  224    HA   ASP  32           HA       ASP  32  66.895 -11.241  16.166
  225   1HB   ASP  32           HB2      ASP  32  69.289 -10.858  15.524
  226   2HB   ASP  32           HB1      ASP  32  68.936  -9.134  15.400
  227    H    GLY  33           HN       GLY  33  65.982  -8.732  14.065
  228   1HA   GLY  33           HA2      GLY  33  64.398  -7.019  14.416
  229   2HA   GLY  33           HA1      GLY  33  64.250  -7.560  16.088
  230    H    GLY  34           HN       GLY  34  67.075  -6.378  14.243
  231   1HA   GLY  34           HA2      GLY  34  67.767  -4.633  16.519
  232   2HA   GLY  34           HA1      GLY  34  68.766  -4.918  15.093
  233    H    GLY  35           HN       GLY  35  65.691  -4.330  13.996
  234   1HA   GLY  35           HA2      GLY  35  64.618  -2.433  13.113
  235   2HA   GLY  35           HA1      GLY  35  65.582  -1.448  14.216
  236    H    ASP  36           HN       ASP  36  67.610  -3.469  12.463
  237    HA   ASP  36           HA       ASP  36  67.811  -1.899  10.028
  238   1HB   ASP  36           HB2      ASP  36  70.096  -0.994  10.539
  239   2HB   ASP  36           HB1      ASP  36  68.822  -0.268  11.522
  240    H    ILE  37           HN       ILE  37  69.175  -2.928   8.521
  241    HA   ILE  37           HA       ILE  37  70.480  -5.425   9.515
  242    HB   ILE  37           HB       ILE  37  68.924  -6.437   8.218
  243   1HG1  ILE  37          HG12      ILE  37  71.186  -6.466   6.889
  244   2HG1  ILE  37          HG11      ILE  37  69.720  -7.054   6.116
  245   1HG2  ILE  37          HG23      ILE  37  68.626  -3.742   6.922
  246   2HG2  ILE  37          HG22      ILE  37  67.882  -5.163   6.189
  247   3HG2  ILE  37          HG21      ILE  37  67.436  -4.679   7.826
  248   1HD1  ILE  37          HD13      ILE  37  69.403  -4.806   5.078
  249   2HD1  ILE  37          HD12      ILE  37  70.937  -4.294   5.778
  250   3HD1  ILE  37          HD11      ILE  37  70.904  -5.581   4.574
  251    H    SER  38           HN       SER  38  72.411  -6.057   8.358
  252    HA   SER  38           HA       SER  38  74.068  -3.755   7.676
  253   1HB   SER  38           HB2      SER  38  75.762  -5.643   7.156
  254   2HB   SER  38           HB1      SER  38  75.226  -5.462   8.824
  255    HG   SER  38           HG       SER  38  74.703  -7.455   6.965
  256    H    THR  39           HN       THR  39  75.089  -3.401   5.613
  257    HA   THR  39           HA       THR  39  73.368  -3.873   3.359
  258    HB   THR  39           HB       THR  39  74.886  -2.606   2.116
  259    HG1  THR  39           HG1      THR  39  76.933  -3.030   2.167
  260   1HG2  THR  39          HG22      THR  39  74.392  -1.835   4.792
  261   2HG2  THR  39          HG21      THR  39  76.070  -1.410   4.454
  262   3HG2  THR  39          HG23      THR  39  74.779  -0.787   3.428
  263    H    LYS  40           HN       LYS  40  75.695  -5.824   4.890
  264    HA   LYS  40           HA       LYS  40  76.724  -7.270   2.638
  265   1HB   LYS  40           HB2      LYS  40  76.238  -8.304   5.448
  266   2HB   LYS  40           HB1      LYS  40  77.354  -8.978   4.260
  267   1HG   LYS  40           HG2      LYS  40  77.811  -6.130   4.662
  268   2HG   LYS  40           HG1      LYS  40  77.955  -7.031   6.173
  269   1HD   LYS  40           HD2      LYS  40  79.248  -8.623   4.256
  270   2HD   LYS  40           HD1      LYS  40  79.762  -6.974   3.901
  271   1HE   LYS  40           HE2      LYS  40  81.062  -6.904   5.740
  272   2HE   LYS  40           HE1      LYS  40  79.737  -7.457   6.764
  273   1HZ   LYS  40           HZ1      LYS  40  80.932  -9.454   5.024
  274   2HZ   LYS  40           HZ3      LYS  40  81.914  -8.896   6.290
  275   3HZ   LYS  40           HZ2      LYS  40  80.400  -9.588   6.634
  276    H    ALA  41           HN       ALA  41  73.732  -7.469   4.463
  277    HA   ALA  41           HA       ALA  41  72.941  -9.974   3.111
  278   1HB   ALA  41           HB3      ALA  41  71.936  -8.338   5.372
  279   2HB   ALA  41           HB2      ALA  41  70.700  -9.150   4.412
  280   3HB   ALA  41           HB1      ALA  41  71.979 -10.090   5.182
  281    H    LEU  42           HN       LEU  42  72.655  -6.571   2.652
  282    HA   LEU  42           HA       LEU  42  70.226  -6.166   1.397
  283   1HB   LEU  42           HB2      LEU  42  72.899  -5.012   1.163
  284   2HB   LEU  42           HB1      LEU  42  72.013  -4.939  -0.360
  285    HG   LEU  42           HG       LEU  42  71.497  -2.932   0.882
  286   1HD1  LEU  42          HD11      LEU  42  69.607  -4.588  -0.123
  287   2HD1  LEU  42          HD13      LEU  42  69.057  -4.484   1.549
  288   3HD1  LEU  42          HD12      LEU  42  69.232  -3.017   0.586
  289   1HD2  LEU  42          HD21      LEU  42  71.691  -4.722   3.120
  290   2HD2  LEU  42          HD23      LEU  42  71.597  -2.961   3.129
  291   3HD2  LEU  42          HD22      LEU  42  70.119  -3.923   3.164
  292    H    GLY  43           HN       GLY  43  72.955  -8.033   0.195
  293   1HA   GLY  43           HA2      GLY  43  72.159  -8.305  -2.519
  294   2HA   GLY  43           HA1      GLY  43  73.107  -9.500  -1.632
  295    H    THR  44           HN       THR  44  71.486 -10.497   0.238
  296    HA   THR  44           HA       THR  44  69.667 -12.165  -1.218
  297    HB   THR  44           HB       THR  44  70.030 -11.607   1.736
  298    HG1  THR  44           HG1      THR  44  70.435 -14.007   0.319
  299   1HG2  THR  44          HG22      THR  44  67.975 -13.253   0.301
  300   2HG2  THR  44          HG21      THR  44  68.621 -13.837   1.836
  301   3HG2  THR  44          HG23      THR  44  67.805 -12.275   1.760
  302    H    VAL  45           HN       VAL  45  69.322  -9.087   0.391
  303    HA   VAL  45           HA       VAL  45  66.480  -9.054   0.689
  304    HB   VAL  45           HB       VAL  45  68.496  -6.833   0.268
  305   1HG1  VAL  45          HG13      VAL  45  65.529  -6.799   0.418
  306   2HG1  VAL  45          HG12      VAL  45  66.372  -5.602   1.402
  307   3HG1  VAL  45          HG11      VAL  45  66.632  -5.651  -0.342
  308   1HG2  VAL  45          HG22      VAL  45  67.766  -8.466   2.484
  309   2HG2  VAL  45          HG21      VAL  45  68.855  -7.080   2.479
  310   3HG2  VAL  45          HG23      VAL  45  67.136  -6.849   2.798
  311    H    MET  46           HN       MET  46  68.597  -8.154  -2.021
  312    HA   MET  46           HA       MET  46  66.565  -7.071  -3.707
  313   1HB   MET  46           HB2      MET  46  69.163  -8.479  -4.387
  314   2HB   MET  46           HB1      MET  46  68.159  -7.641  -5.570
  315   1HG   MET  46           HG2      MET  46  69.111  -6.261  -3.060
  316   2HG   MET  46           HG1      MET  46  70.104  -6.307  -4.518
  317   1HE   MET  46           HE1      MET  46  70.160  -4.033  -3.988
  318   2HE   MET  46           HE3      MET  46  69.304  -2.907  -5.051
  319   3HE   MET  46           HE2      MET  46  68.744  -3.164  -3.401
  320    H    ARG  47           HN       ARG  47  68.070 -10.321  -3.925
  321    HA   ARG  47           HA       ARG  47  66.266 -11.436  -5.761
  322   1HB   ARG  47           HB2      ARG  47  67.421 -12.938  -3.397
  323   2HB   ARG  47           HB1      ARG  47  66.978 -13.595  -4.971
  324   1HG   ARG  47           HG2      ARG  47  68.772 -11.484  -5.503
  325   2HG   ARG  47           HG1      ARG  47  69.470 -12.383  -4.156
  326   1HD   ARG  47           HD2      ARG  47  69.630 -14.362  -5.379
  327   2HD   ARG  47           HD1      ARG  47  68.362 -13.884  -6.508
  328    HE   ARG  47           HE       ARG  47  70.735 -12.186  -6.653
  329   1HH1  ARG  47          HH21      ARG  47  69.219 -12.553  -9.078
  330   2HH1  ARG  47          HH22      ARG  47  70.088 -13.775  -9.945
  331   1HH2  ARG  47          HH11      ARG  47  71.857 -14.861  -7.169
  332   2HH2  ARG  47          HH12      ARG  47  71.581 -15.082  -8.864
  333    H    MET  48           HN       MET  48  65.777 -10.644  -2.411
  334    HA   MET  48           HA       MET  48  63.486 -12.361  -1.983
  335   1HB   MET  48           HB2      MET  48  64.405  -9.835  -0.582
  336   2HB   MET  48           HB1      MET  48  63.065 -10.838  -0.029
  337   1HG   MET  48           HG2      MET  48  65.526 -12.350  -0.598
  338   2HG   MET  48           HG1      MET  48  65.688 -11.187   0.717
  339   1HE   MET  48           HE1      MET  48  64.799 -11.219   2.802
  340   2HE   MET  48           HE3      MET  48  64.205 -12.670   3.621
  341   3HE   MET  48           HE2      MET  48  65.808 -12.661   2.888
  342    H    LEU  49           HN       LEU  49  63.809  -8.872  -2.716
  343    HA   LEU  49           HA       LEU  49  60.942  -8.539  -3.053
  344   1HB   LEU  49           HB2      LEU  49  62.989  -6.674  -4.233
  345   2HB   LEU  49           HB1      LEU  49  61.418  -6.292  -3.530
  346    HG   LEU  49           HG       LEU  49  63.940  -7.119  -2.081
  347   1HD1  LEU  49          HD11      LEU  49  62.170  -4.675  -2.145
  348   2HD1  LEU  49          HD13      LEU  49  63.264  -4.984  -0.795
  349   3HD1  LEU  49          HD12      LEU  49  63.908  -4.777  -2.423
  350   1HD2  LEU  49          HD21      LEU  49  61.894  -8.324  -1.217
  351   2HD2  LEU  49          HD23      LEU  49  62.640  -7.243  -0.041
  352   3HD2  LEU  49          HD22      LEU  49  61.176  -6.746  -0.889
  353    H    GLY  50           HN       GLY  50  63.530  -8.023  -5.477
  354   1HA   GLY  50           HA2      GLY  50  62.765  -9.882  -7.400
  355   2HA   GLY  50           HA1      GLY  50  61.691  -8.509  -7.665
  356    H    GLN  51           HN       GLN  51  63.602  -6.477  -6.893
  357    HA   GLN  51           HA       GLN  51  64.769  -5.775  -9.305
  358   1HB   GLN  51           HB2      GLN  51  65.130  -5.020  -6.517
  359   2HB   GLN  51           HB1      GLN  51  66.644  -4.915  -7.415
  360   1HG   GLN  51           HG2      GLN  51  65.685  -2.810  -7.799
  361   2HG   GLN  51           HG1      GLN  51  65.197  -3.717  -9.230
  362   1HE2  GLN  51          HE22      GLN  51  62.331  -2.116  -7.017
  363   2HE2  GLN  51          HE21      GLN  51  63.947  -1.597  -7.043
  364    H    ASN  52           HN       ASN  52  66.600  -6.365 -10.439
  365    HA   ASN  52           HA       ASN  52  68.509  -8.232  -9.115
  366   1HB   ASN  52           HB2      ASN  52  67.406  -8.633 -11.910
  367   2HB   ASN  52           HB1      ASN  52  68.497  -9.709 -11.036
  368   1HD2  ASN  52          HD22      ASN  52  65.741 -10.473  -8.624
  369   2HD2  ASN  52          HD21      ASN  52  67.288  -9.786  -8.494
  370    HA   PRO  53           HA       PRO  53  70.524  -4.837 -11.572
  371   1HB   PRO  53           HB2      PRO  53  71.789  -3.657  -9.435
  372   2HB   PRO  53           HB1      PRO  53  70.173  -3.191  -9.996
  373   1HG   PRO  53           HG2      PRO  53  70.940  -4.774  -7.587
  374   2HG   PRO  53           HG1      PRO  53  69.506  -3.771  -7.860
  375   1HD   PRO  53           HD2      PRO  53  69.603  -6.597  -8.004
  376   2HD   PRO  53           HD1      PRO  53  68.281  -5.567  -8.593
  377    H    THR  54           HN       THR  54  73.068  -4.284 -11.272
  378    HA   THR  54           HA       THR  54  74.407  -6.915 -11.169
  379    HB   THR  54           HB       THR  54  75.007  -5.584 -13.066
  380    HG1  THR  54           HG1      THR  54  77.119  -5.035 -11.297
  381   1HG2  THR  54          HG23      THR  54  75.215  -3.394 -11.020
  382   2HG2  THR  54          HG22      THR  54  76.114  -3.273 -12.532
  383   3HG2  THR  54          HG21      THR  54  74.356  -3.397 -12.560
  384    H    LYS  55           HN       LYS  55  76.146  -7.374  -9.748
  385    HA   LYS  55           HA       LYS  55  75.976  -6.407  -7.108
  386   1HB   LYS  55           HB2      LYS  55  78.239  -7.408  -6.793
  387   2HB   LYS  55           HB1      LYS  55  77.140  -8.490  -7.650
  388   1HG   LYS  55           HG2      LYS  55  78.121  -7.411  -9.806
  389   2HG   LYS  55           HG1      LYS  55  79.432  -6.878  -8.753
  390   1HD   LYS  55           HD2      LYS  55  78.519  -9.757  -8.857
  391   2HD   LYS  55           HD1      LYS  55  79.775  -9.128  -9.923
  392   1HE   LYS  55           HE2      LYS  55  80.866  -8.240  -7.732
  393   2HE   LYS  55           HE1      LYS  55  79.814  -9.401  -6.924
  394   1HZ   LYS  55           HZ2      LYS  55  80.727 -11.119  -8.436
  395   2HZ   LYS  55           HZ1      LYS  55  81.848  -9.975  -9.006
  396   3HZ   LYS  55           HZ3      LYS  55  81.882 -10.457  -7.381
  397    H    GLU  56           HN       GLU  56  78.216  -5.404  -9.704
  398    HA   GLU  56           HA       GLU  56  79.728  -3.528  -8.241
  399   1HB   GLU  56           HB2      GLU  56  80.290  -4.147 -10.545
  400   2HB   GLU  56           HB1      GLU  56  78.816  -3.376 -11.132
  401   1HG   GLU  56           HG2      GLU  56  79.736  -1.250  -9.931
  402   2HG   GLU  56           HG1      GLU  56  81.286  -2.093  -9.984
  403    H    GLU  57           HN       GLU  57  76.930  -2.728 -10.339
  404    HA   GLU  57           HA       GLU  57  76.611  -0.066  -9.500
  405   1HB   GLU  57           HB2      GLU  57  75.360  -1.279 -11.364
  406   2HB   GLU  57           HB1      GLU  57  74.298  -1.918 -10.109
  407   1HG   GLU  57           HG2      GLU  57  73.401   0.169  -9.608
  408   2HG   GLU  57           HG1      GLU  57  74.819   1.034 -10.204
  409    H    LEU  58           HN       LEU  58  75.813  -3.019  -7.820
  410    HA   LEU  58           HA       LEU  58  73.972  -1.841  -5.926
  411   1HB   LEU  58           HB2      LEU  58  74.743  -4.408  -6.534
  412   2HB   LEU  58           HB1      LEU  58  75.553  -4.145  -4.989
  413    HG   LEU  58           HG       LEU  58  72.690  -3.307  -5.275
  414   1HD1  LEU  58          HD11      LEU  58  73.632  -6.143  -4.748
  415   2HD1  LEU  58          HD13      LEU  58  71.970  -5.572  -4.598
  416   3HD1  LEU  58          HD12      LEU  58  72.752  -5.602  -6.178
  417   1HD2  LEU  58          HD22      LEU  58  74.203  -2.881  -3.250
  418   2HD2  LEU  58          HD21      LEU  58  72.660  -3.667  -2.914
  419   3HD2  LEU  58          HD23      LEU  58  74.142  -4.621  -2.969
  420    H    ASP  59           HN       ASP  59  77.474  -2.519  -5.855
  421    HA   ASP  59           HA       ASP  59  77.952  -1.697  -3.181
  422   1HB   ASP  59           HB2      ASP  59  79.537  -2.723  -5.072
  423   2HB   ASP  59           HB1      ASP  59  79.969  -1.025  -5.281
  424    H    ALA  60           HN       ALA  60  77.965   0.213  -6.198
  425    HA   ALA  60           HA       ALA  60  78.645   2.700  -4.934
  426   1HB   ALA  60           HB1      ALA  60  77.205   2.058  -7.520
  427   2HB   ALA  60           HB3      ALA  60  77.597   3.705  -7.025
  428   3HB   ALA  60           HB2      ALA  60  78.889   2.540  -7.319
  429    H    ILE  61           HN       ILE  61  75.703   0.881  -5.125
  430    HA   ILE  61           HA       ILE  61  73.928   3.125  -4.568
  431    HB   ILE  61           HB       ILE  61  73.595   0.119  -4.485
  432   1HG1  ILE  61          HG12      ILE  61  72.085   2.086  -6.190
  433   2HG1  ILE  61          HG11      ILE  61  73.717   1.597  -6.650
  434   1HG2  ILE  61          HG23      ILE  61  72.192   1.242  -2.731
  435   2HG2  ILE  61          HG22      ILE  61  71.454   2.212  -4.006
  436   3HG2  ILE  61          HG21      ILE  61  71.243   0.460  -3.995
  437   1HD1  ILE  61          HD13      ILE  61  72.361  -0.777  -5.934
  438   2HD1  ILE  61          HD12      ILE  61  71.246   0.139  -6.949
  439   3HD1  ILE  61          HD11      ILE  61  72.852  -0.273  -7.552
  440    H    ILE  62           HN       ILE  62  75.481   0.561  -2.660
  441    HA   ILE  62           HA       ILE  62  74.222   1.104  -0.170
  442    HB   ILE  62           HB       ILE  62  76.978   0.045  -0.847
  443   1HG1  ILE  62          HG12      ILE  62  75.106  -1.716   0.508
  444   2HG1  ILE  62          HG11      ILE  62  74.402  -1.065  -0.970
  445   1HG2  ILE  62          HG23      ILE  62  75.711   0.704   1.773
  446   2HG2  ILE  62          HG22      ILE  62  76.597  -0.818   1.665
  447   3HG2  ILE  62          HG21      ILE  62  77.415   0.705   1.315
  448   1HD1  ILE  62          HD12      ILE  62  77.201  -1.885  -1.286
  449   2HD1  ILE  62          HD11      ILE  62  76.131  -3.216  -0.849
  450   3HD1  ILE  62          HD13      ILE  62  75.801  -2.257  -2.292
  451    H    GLU  63           HN       GLU  63  76.826   2.739  -1.863
  452    HA   GLU  63           HA       GLU  63  77.804   4.272   0.365
  453   1HB   GLU  63           HB2      GLU  63  78.216   4.162  -2.515
  454   2HB   GLU  63           HB1      GLU  63  78.199   5.825  -1.925
  455   1HG   GLU  63           HG2      GLU  63  79.692   4.085  -0.135
  456   2HG   GLU  63           HG1      GLU  63  80.344   4.033  -1.774
  457    H    GLU  64           HN       GLU  64  75.476   5.078  -2.232
  458    HA   GLU  64           HA       GLU  64  74.860   7.679  -1.152
  459   1HB   GLU  64           HB2      GLU  64  73.432   5.863  -3.106
  460   2HB   GLU  64           HB1      GLU  64  72.805   7.451  -2.657
  461   1HG   GLU  64           HG2      GLU  64  75.458   7.988  -3.220
  462   2HG   GLU  64           HG1      GLU  64  75.046   6.764  -4.421
  463    H    VAL  65           HN       VAL  65  74.037   4.550  -0.118
  464    HA   VAL  65           HA       VAL  65  71.486   5.414   1.113
  465    HB   VAL  65           HB       VAL  65  72.893   2.738   1.325
  466   1HG1  VAL  65          HG11      VAL  65  70.849   3.710   2.839
  467   2HG1  VAL  65          HG13      VAL  65  69.948   3.012   1.494
  468   3HG1  VAL  65          HG12      VAL  65  71.040   2.002   2.442
  469   1HG2  VAL  65          HG23      VAL  65  72.073   3.773  -1.017
  470   2HG2  VAL  65          HG22      VAL  65  71.887   2.061  -0.633
  471   3HG2  VAL  65          HG21      VAL  65  70.524   3.164  -0.436
  472    H    ASP  66           HN       ASP  66  74.805   4.618   1.996
  473    HA   ASP  66           HA       ASP  66  74.189   4.894   4.872
  474   1HB   ASP  66           HB2      ASP  66  76.202   3.584   3.352
  475   2HB   ASP  66           HB1      ASP  66  77.009   4.818   4.321
  476    H    GLU  67           HN       GLU  67  73.465   7.236   4.051
  477    HA   GLU  67           HA       GLU  67  75.456   9.197   3.473
  478   1HB   GLU  67           HB2      GLU  67  73.770  10.839   4.219
  479   2HB   GLU  67           HB1      GLU  67  73.035   9.609   3.190
  480   1HG   GLU  67           HG2      GLU  67  72.736   8.426   5.611
  481   2HG   GLU  67           HG1      GLU  67  72.653  10.123   6.088
  482    H    ASP  68           HN       ASP  68  74.811   7.455   6.342
  483    HA   ASP  68           HA       ASP  68  76.019   9.526   8.084
  484   1HB   ASP  68           HB2      ASP  68  75.345   6.772   9.053
  485   2HB   ASP  68           HB1      ASP  68  75.199   8.317   9.889
  486    H    GLY  69           HN       GLY  69  76.643   6.154   7.076
  487   1HA   GLY  69           HA2      GLY  69  78.875   5.393   6.482
  488   2HA   GLY  69           HA1      GLY  69  79.544   6.683   7.484
  489    H    SER  70           HN       SER  70  76.884   4.987   8.847
  490    HA   SER  70           HA       SER  70  78.574   3.970  10.996
  491   1HB   SER  70           HB2      SER  70  76.208   2.831  11.529
  492   2HB   SER  70           HB1      SER  70  76.519   4.530  11.873
  493    HG   SER  70           HG       SER  70  74.567   3.866  10.561
  494    H    GLY  71           HN       GLY  71  77.623   2.796   7.950
  495   1HA   GLY  71           HA2      GLY  71  78.223   0.745   6.940
  496   2HA   GLY  71           HA1      GLY  71  78.877   0.214   8.491
  497    H    THR  72           HN       THR  72  75.649   1.474   8.432
  498    HA   THR  72           HA       THR  72  74.488  -1.254   8.286
  499    HB   THR  72           HB       THR  72  73.085  -0.389  10.392
  500    HG1  THR  72           HG1      THR  72  74.074   1.505  10.775
  501   1HG2  THR  72          HG21      THR  72  75.698  -1.839  10.201
  502   2HG2  THR  72          HG23      THR  72  75.043  -1.479  11.800
  503   3HG2  THR  72          HG22      THR  72  74.109  -2.452  10.662
  504    H    ILE  73           HN       ILE  73  72.398  -1.237   7.453
  505    HA   ILE  73           HA       ILE  73  71.414   1.411   6.529
  506    HB   ILE  73           HB       ILE  73  70.434  -1.350   5.765
  507   1HG1  ILE  73          HG12      ILE  73  72.899  -0.822   5.267
  508   2HG1  ILE  73          HG11      ILE  73  71.900  -1.285   3.890
  509   1HG2  ILE  73          HG23      ILE  73  70.000   1.438   4.685
  510   2HG2  ILE  73          HG22      ILE  73  69.683   0.000   3.715
  511   3HG2  ILE  73          HG21      ILE  73  68.786   0.270   5.210
  512   1HD1  ILE  73          HD13      ILE  73  71.718   1.564   4.302
  513   2HD1  ILE  73          HD12      ILE  73  73.411   1.085   4.186
  514   3HD1  ILE  73          HD11      ILE  73  72.292   0.687   2.883
  515    H    ASP  74           HN       ASP  74  69.531   2.275   7.307
  516    HA   ASP  74           HA       ASP  74  68.001   0.628   9.283
  517   1HB   ASP  74           HB2      ASP  74  68.460   3.618   9.094
  518   2HB   ASP  74           HB1      ASP  74  67.255   2.896  10.163
  519    H    PHE  75           HN       PHE  75  65.668   0.798   9.194
  520    HA   PHE  75           HA       PHE  75  64.422   0.596   6.757
  521   1HB   PHE  75           HB2      PHE  75  63.393   0.316   9.083
  522   2HB   PHE  75           HB1      PHE  75  63.102   2.056   9.051
  523    HD1  PHE  75           HD2      PHE  75  62.927  -0.509   6.337
  524    HD2  PHE  75           HD1      PHE  75  60.800   2.370   8.707
  525    HE1  PHE  75           HE2      PHE  75  60.899  -0.870   4.954
  526    HE2  PHE  75           HE1      PHE  75  58.772   2.013   7.325
  527    HZ   PHE  75           HZ       PHE  75  58.821   0.392   5.448
  528    H    GLU  76           HN       GLU  76  65.480   3.572   8.276
  529    HA   GLU  76           HA       GLU  76  63.910   5.332   6.594
  530   1HB   GLU  76           HB2      GLU  76  66.150   5.629   8.535
  531   2HB   GLU  76           HB1      GLU  76  65.941   6.920   7.352
  532   1HG   GLU  76           HG2      GLU  76  63.398   6.725   8.046
  533   2HG   GLU  76           HG1      GLU  76  64.073   6.014   9.514
  534    H    GLU  77           HN       GLU  77  67.330   4.269   6.491
  535    HA   GLU  77           HA       GLU  77  67.763   5.652   3.950
  536   1HB   GLU  77           HB2      GLU  77  69.548   3.542   5.174
  537   2HB   GLU  77           HB1      GLU  77  70.004   4.852   4.087
  538   1HG   GLU  77           HG2      GLU  77  69.653   6.506   5.772
  539   2HG   GLU  77           HG1      GLU  77  68.817   5.360   6.821
  540    H    PHE  78           HN       PHE  78  66.375   2.672   4.823
  541    HA   PHE  78           HA       PHE  78  67.274   1.076   2.604
  542   1HB   PHE  78           HB2      PHE  78  66.356  -0.287   4.217
  543   2HB   PHE  78           HB1      PHE  78  65.149   0.907   4.690
  544    HD1  PHE  78           HD2      PHE  78  63.196   1.334   3.135
  545    HD2  PHE  78           HD1      PHE  78  65.821  -2.031   2.706
  546    HE1  PHE  78           HE2      PHE  78  61.488   0.180   1.743
  547    HE2  PHE  78           HE1      PHE  78  64.123  -3.188   1.316
  548    HZ   PHE  78           HZ       PHE  78  61.956  -2.082   0.834
  549    H    LEU  79           HN       LEU  79  64.433   3.159   3.146
  550    HA   LEU  79           HA       LEU  79  63.111   2.655   0.686
  551   1HB   LEU  79           HB2      LEU  79  63.247   5.292   2.180
  552   2HB   LEU  79           HB1      LEU  79  61.997   4.799   1.037
  553    HG   LEU  79           HG       LEU  79  62.582   3.092   3.442
  554   1HD1  LEU  79          HD12      LEU  79  62.207   5.499   4.159
  555   2HD1  LEU  79          HD11      LEU  79  60.607   5.388   3.423
  556   3HD1  LEU  79          HD13      LEU  79  61.028   4.345   4.782
  557   1HD2  LEU  79          HD21      LEU  79  60.290   3.569   1.541
  558   2HD2  LEU  79          HD23      LEU  79  61.092   2.049   1.939
  559   3HD2  LEU  79          HD22      LEU  79  60.014   2.811   3.109
  560    H    VAL  80           HN       VAL  80  65.934   4.578   1.443
  561    HA   VAL  80           HA       VAL  80  65.979   6.106  -1.010
  562    HB   VAL  80           HB       VAL  80  68.134   5.352   0.983
  563   1HG1  VAL  80          HG13      VAL  80  68.299   6.657  -1.672
  564   2HG1  VAL  80          HG12      VAL  80  69.145   7.483  -0.364
  565   3HG1  VAL  80          HG11      VAL  80  69.545   5.811  -0.752
  566   1HG2  VAL  80          HG21      VAL  80  66.151   7.499   0.697
  567   2HG2  VAL  80          HG23      VAL  80  67.069   7.002   2.118
  568   3HG2  VAL  80          HG22      VAL  80  67.792   8.098   0.941
  569    H    MET  81           HN       MET  81  67.471   3.046   0.020
  570    HA   MET  81           HA       MET  81  68.973   2.570  -2.358
  571   1HB   MET  81           HB2      MET  81  68.967   1.326  -0.049
  572   2HB   MET  81           HB1      MET  81  67.715   0.333  -0.794
  573   1HG   MET  81           HG2      MET  81  69.198  -0.267  -2.617
  574   2HG   MET  81           HG1      MET  81  70.433   0.847  -2.028
  575   1HE   MET  81           HE2      MET  81  70.749   0.986   0.391
  576   2HE   MET  81           HE1      MET  81  70.210  -0.217   1.557
  577   3HE   MET  81           HE3      MET  81  71.865  -0.263   0.933
  578    H    MET  82           HN       MET  82  65.589   2.035  -1.565
  579    HA   MET  82           HA       MET  82  64.984   0.316  -3.793
  580   1HB   MET  82           HB2      MET  82  63.008   2.241  -2.569
  581   2HB   MET  82           HB1      MET  82  62.712   0.631  -3.225
  582   1HG   MET  82           HG2      MET  82  64.138   1.334  -0.649
  583   2HG   MET  82           HG1      MET  82  62.643   0.420  -0.835
  584   1HE   MET  82           HE2      MET  82  62.725  -1.275  -2.905
  585   2HE   MET  82           HE1      MET  82  63.738  -2.707  -2.751
  586   3HE   MET  82           HE3      MET  82  62.601  -2.281  -1.463
  587    H    VAL  83           HN       VAL  83  64.420   3.829  -3.333
  588    HA   VAL  83           HA       VAL  83  63.693   4.207  -6.119
  589    HB   VAL  83           HB       VAL  83  64.580   6.311  -4.126
  590   1HG1  VAL  83          HG11      VAL  83  63.445   6.307  -6.846
  591   2HG1  VAL  83          HG13      VAL  83  62.599   7.362  -5.714
  592   3HG1  VAL  83          HG12      VAL  83  64.326   7.576  -5.996
  593   1HG2  VAL  83          HG23      VAL  83  62.407   4.534  -3.904
  594   2HG2  VAL  83          HG22      VAL  83  62.646   6.030  -2.998
  595   3HG2  VAL  83          HG21      VAL  83  61.714   6.045  -4.495
  596    H    ARG  84           HN       ARG  84  66.666   3.828  -4.514
  597    HA   ARG  84           HA       ARG  84  68.309   5.592  -6.078
  598   1HB   ARG  84           HB2      ARG  84  68.709   3.815  -3.955
  599   2HB   ARG  84           HB1      ARG  84  69.658   3.138  -5.280
  600   1HG   ARG  84           HG2      ARG  84  71.235   4.643  -4.635
  601   2HG   ARG  84           HG1      ARG  84  70.239   5.805  -5.512
  602   1HD   ARG  84           HD2      ARG  84  69.031   5.544  -2.984
  603   2HD   ARG  84           HD1      ARG  84  70.762   5.638  -2.668
  604    HE   ARG  84           HE       ARG  84  70.777   7.797  -3.885
  605   1HH1  ARG  84          HH21      ARG  84  67.731   6.496  -4.354
  606   2HH1  ARG  84          HH22      ARG  84  66.855   7.926  -3.920
  607   1HH2  ARG  84          HH11      ARG  84  69.657   9.613  -2.766
  608   2HH2  ARG  84          HH12      ARG  84  67.945   9.690  -3.019
  609    H    GLN  85           HN       GLN  85  67.159   2.279  -6.572
  610    HA   GLN  85           HA       GLN  85  68.616   2.207  -9.166
  611   1HB   GLN  85           HB2      GLN  85  69.105   0.200  -8.100
  612   2HB   GLN  85           HB1      GLN  85  67.547   0.135  -7.282
  613   1HG   GLN  85           HG2      GLN  85  67.628  -1.587  -9.008
  614   2HG   GLN  85           HG1      GLN  85  66.457  -0.351  -9.465
  615   1HE2  GLN  85          HE22      GLN  85  69.137  -1.175 -12.174
  616   2HE2  GLN  85          HE21      GLN  85  68.434  -2.237 -11.051
  617    H    MET  86           HN       MET  86  65.403   2.081  -7.708
  618    HA   MET  86           HA       MET  86  63.862   1.334  -9.943
  619   1HB   MET  86           HB2      MET  86  63.385   2.982  -7.507
  620   2HB   MET  86           HB1      MET  86  62.219   3.143  -8.819
  621   1HG   MET  86           HG2      MET  86  61.376   1.066  -8.477
  622   2HG   MET  86           HG1      MET  86  62.975   0.359  -8.255
  623   1HE   MET  86           HE1      MET  86  60.409   2.806  -6.695
  624   2HE   MET  86           HE3      MET  86  59.724   1.175  -6.696
  625   3HE   MET  86           HE2      MET  86  60.062   1.992  -5.172
  626    H    LYS  87           HN       LYS  87  64.316   4.736  -8.904
  627    HA   LYS  87           HA       LYS  87  63.390   5.989 -11.209
  628   1HB   LYS  87           HB2      LYS  87  65.305   6.695  -9.073
  629   2HB   LYS  87           HB1      LYS  87  65.508   7.600 -10.573
  630   1HG   LYS  87           HG2      LYS  87  62.931   7.919 -10.474
  631   2HG   LYS  87           HG1      LYS  87  63.090   7.452  -8.781
  632   1HD   LYS  87           HD2      LYS  87  63.925   9.470  -8.221
  633   2HD   LYS  87           HD1      LYS  87  65.109   9.407  -9.525
  634   1HE   LYS  87           HE2      LYS  87  63.861  10.743 -10.852
  635   2HE   LYS  87           HE1      LYS  87  62.396   9.820 -10.523
  636   1HZ   LYS  87           HZ3      LYS  87  63.411  11.464  -8.349
  637   2HZ   LYS  87           HZ2      LYS  87  62.758  12.299  -9.677
  638   3HZ   LYS  87           HZ1      LYS  87  61.812  11.169  -8.832
  639    H    GLU  88           HN       GLU  88  66.907   5.975 -10.735
  640    HA   GLU  88           HA       GLU  88  67.727   4.361 -12.860
  641   1HB   GLU  88           HB2      GLU  88  66.376   6.733 -13.792
  642   2HB   GLU  88           HB1      GLU  88  68.069   6.784 -14.284
  643   1HG   GLU  88           HG2      GLU  88  67.732   4.333 -15.027
  644   2HG   GLU  88           HG1      GLU  88  66.006   4.670 -14.899
  645    H    ASP  89           HN       ASP  89  68.836   5.026 -10.446
  646    HA   ASP  89           HA       ASP  89  70.766   5.901  -9.415
  647   1HB   ASP  89           HB2      ASP  89  71.934   5.659 -12.197
  648   2HB   ASP  89           HB1      ASP  89  72.777   5.502 -10.655
  649    H    ALA  90           HN       ALA  90  69.647   8.045  -9.256
  650    HA   ALA  90           HA       ALA  90  71.044  10.068 -10.960
  651   1HB   ALA  90           HB2      ALA  90  68.456   9.663 -11.285
  652   2HB   ALA  90           HB1      ALA  90  68.327  10.612  -9.803
  653   3HB   ALA  90           HB3      ALA  90  69.090  11.309 -11.233
   
  No H/Q in entry =         653
  Start of MODEL    4
    1   1H    ALA   1           HT1      ALA   1  68.360  12.341  16.103
    2   2H    ALA   1           HT3      ALA   1  68.386  10.782  15.437
    3   3H    ALA   1           HT2      ALA   1  69.346  11.140  16.791
    4    HA   ALA   1           HA       ALA   1  70.938  12.183  15.596
    5   1HB   ALA   1           HB1      ALA   1  69.716   9.956  14.210
    6   2HB   ALA   1           HB3      ALA   1  70.414  11.089  13.051
    7   3HB   ALA   1           HB2      ALA   1  71.422  10.390  14.320
    8    H    SER   2           HN       SER   2  68.764  11.960  12.815
    9    HA   SER   2           HA       SER   2  67.808  14.613  12.745
   10   1HB   SER   2           HB2      SER   2  69.718  15.062  10.765
   11   2HB   SER   2           HB1      SER   2  69.681  15.813  12.358
   12    HG   SER   2           HG       SER   2  71.654  14.613  11.711
   13    H    MET   3           HN       MET   3  67.986  15.211  10.020
   14    HA   MET   3           HA       MET   3  67.047  12.711   8.683
   15   1HB   MET   3           HB2      MET   3  65.130  13.838   7.771
   16   2HB   MET   3           HB1      MET   3  65.127  14.163   9.505
   17   1HG   MET   3           HG2      MET   3  66.626  16.247   8.670
   18   2HG   MET   3           HG1      MET   3  65.634  16.012   7.231
   19   1HE   MET   3           HE1      MET   3  65.931  16.306  10.852
   20   2HE   MET   3           HE3      MET   3  64.511  17.175  11.454
   21   3HE   MET   3           HE2      MET   3  64.436  15.435  11.181
   22    H    THR   4           HN       THR   4  67.400  12.687   6.403
   23    HA   THR   4           HA       THR   4  69.288  14.810   5.468
   24    HB   THR   4           HB       THR   4  69.744  12.834   3.716
   25    HG1  THR   4           HG1      THR   4  69.119  10.952   4.409
   26   1HG2  THR   4          HG22      THR   4  71.321  13.951   5.366
   27   2HG2  THR   4          HG21      THR   4  70.862  12.701   6.523
   28   3HG2  THR   4          HG23      THR   4  71.670  12.259   5.020
   29    H    ASP   5           HN       ASP   5  69.100  15.416   3.178
   30    HA   ASP   5           HA       ASP   5  66.357  15.829   2.385
   31   1HB   ASP   5           HB2      ASP   5  68.631  16.087   0.444
   32   2HB   ASP   5           HB1      ASP   5  67.222  17.127   0.655
   33    H    GLN   6           HN       GLN   6  68.678  13.322   1.769
   34    HA   GLN   6           HA       GLN   6  67.672  12.313  -0.696
   35   1HB   GLN   6           HB2      GLN   6  68.674  10.148   0.031
   36   2HB   GLN   6           HB1      GLN   6  69.776  11.507   0.254
   37   1HG   GLN   6           HG2      GLN   6  68.740  11.628   2.651
   38   2HG   GLN   6           HG1      GLN   6  68.234   9.970   2.328
   39   1HE2  GLN   6          HE22      GLN   6  71.449   8.648   2.873
   40   2HE2  GLN   6          HE21      GLN   6  69.792   8.355   2.653
   41    H    GLN   7           HN       GLN   7  66.647  11.754   2.658
   42    HA   GLN   7           HA       GLN   7  64.653   9.769   1.908
   43   1HB   GLN   7           HB2      GLN   7  64.530  11.359   4.457
   44   2HB   GLN   7           HB1      GLN   7  64.133   9.662   4.187
   45   1HG   GLN   7           HG2      GLN   7  66.688   9.467   3.566
   46   2HG   GLN   7           HG1      GLN   7  66.825  10.942   4.524
   47   1HE2  GLN   7          HE22      GLN   7  67.194   8.638   7.235
   48   2HE2  GLN   7          HE21      GLN   7  68.043   9.644   6.163
   49    H    ALA   8           HN       ALA   8  64.800  13.205   1.896
   50    HA   ALA   8           HA       ALA   8  61.979  13.731   2.254
   51   1HB   ALA   8           HB1      ALA   8  64.224  15.298   2.140
   52   2HB   ALA   8           HB3      ALA   8  63.503  15.607   0.560
   53   3HB   ALA   8           HB2      ALA   8  62.576  15.916   2.029
   54    H    GLU   9           HN       GLU   9  64.055  13.224  -0.591
   55    HA   GLU   9           HA       GLU   9  61.758  13.529  -2.406
   56   1HB   GLU   9           HB2      GLU   9  64.568  13.728  -2.656
   57   2HB   GLU   9           HB1      GLU   9  64.078  12.363  -3.661
   58   1HG   GLU   9           HG2      GLU   9  63.754  14.103  -5.157
   59   2HG   GLU   9           HG1      GLU   9  62.157  14.034  -4.409
   60    H    ALA  10           HN       ALA  10  63.657  10.947  -0.952
   61    HA   ALA  10           HA       ALA  10  62.701   8.825  -2.639
   62   1HB   ALA  10           HB3      ALA  10  63.918   8.937   0.114
   63   2HB   ALA  10           HB2      ALA  10  63.307   7.415  -0.534
   64   3HB   ALA  10           HB1      ALA  10  64.603   8.274  -1.368
   65    H    ARG  11           HN       ARG  11  61.642   9.949   0.589
   66    HA   ARG  11           HA       ARG  11  59.443   8.122   0.789
   67   1HB   ARG  11           HB2      ARG  11  60.607   9.900   2.493
   68   2HB   ARG  11           HB1      ARG  11  59.130  10.769   2.077
   69   1HG   ARG  11           HG2      ARG  11  57.864   9.373   3.314
   70   2HG   ARG  11           HG1      ARG  11  58.593   7.954   2.562
   71   1HD   ARG  11           HD2      ARG  11  59.191   7.777   4.849
   72   2HD   ARG  11           HD1      ARG  11  60.632   8.426   4.067
   73    HE   ARG  11           HE       ARG  11  59.886  10.688   4.891
   74   1HH1  ARG  11          HH11      ARG  11  57.477  10.927   6.008
   75   2HH1  ARG  11          HH12      ARG  11  57.541  10.292   7.618
   76   1HH2  ARG  11          HH21      ARG  11  60.472   8.517   7.088
   77   2HH2  ARG  11          HH22      ARG  11  59.236   8.927   8.230
   78    H    ALA  12           HN       ALA  12  59.769  11.326  -0.661
   79    HA   ALA  12           HA       ALA  12  56.930  11.707  -1.090
   80   1HB   ALA  12           HB1      ALA  12  59.236  13.266  -1.374
   81   2HB   ALA  12           HB3      ALA  12  58.628  13.073  -3.019
   82   3HB   ALA  12           HB2      ALA  12  57.588  13.755  -1.768
   83    H    PHE  13           HN       PHE  13  59.496  10.094  -2.853
   84    HA   PHE  13           HA       PHE  13  57.834   9.835  -5.274
   85   1HB   PHE  13           HB2      PHE  13  60.269  10.137  -5.510
   86   2HB   PHE  13           HB1      PHE  13  60.545   8.657  -4.591
   87    HD1  PHE  13           HD2      PHE  13  59.915   6.454  -5.522
   88    HD2  PHE  13           HD1      PHE  13  59.501  10.069  -7.804
   89    HE1  PHE  13           HE2      PHE  13  59.669   5.117  -7.597
   90    HE2  PHE  13           HE1      PHE  13  59.255   8.733  -9.878
   91    HZ   PHE  13           HZ       PHE  13  59.339   6.256  -9.775
   92    H    LEU  14           HN       LEU  14  58.484   8.067  -2.373
   93    HA   LEU  14           HA       LEU  14  57.519   5.526  -3.550
   94   1HB   LEU  14           HB2      LEU  14  58.419   6.208  -0.732
   95   2HB   LEU  14           HB1      LEU  14  57.991   4.594  -1.298
   96    HG   LEU  14           HG       LEU  14  60.182   6.300  -2.512
   97   1HD1  LEU  14          HD12      LEU  14  60.153   4.767  -0.092
   98   2HD1  LEU  14          HD11      LEU  14  61.163   3.929  -1.270
   99   3HD1  LEU  14          HD13      LEU  14  61.514   5.602  -0.839
  100   1HD2  LEU  14          HD23      LEU  14  58.784   3.985  -3.415
  101   2HD2  LEU  14          HD22      LEU  14  60.186   4.760  -4.154
  102   3HD2  LEU  14          HD21      LEU  14  60.412   3.477  -2.966
  103    H    SER  15           HN       SER  15  55.439   4.824  -3.311
  104    HA   SER  15           HA       SER  15  53.495   6.616  -2.050
  105   1HB   SER  15           HB2      SER  15  53.438   4.331  -3.889
  106   2HB   SER  15           HB1      SER  15  52.137   4.292  -2.703
  107    HG   SER  15           HG       SER  15  51.806   6.565  -3.310
  108    H    GLU  16           HN       GLU  16  51.871   5.691  -0.475
  109    HA   GLU  16           HA       GLU  16  53.164   4.661   1.840
  110   1HB   GLU  16           HB2      GLU  16  50.800   4.219   2.640
  111   2HB   GLU  16           HB1      GLU  16  51.098   5.870   2.092
  112   1HG   GLU  16           HG2      GLU  16  49.971   5.517   0.041
  113   2HG   GLU  16           HG1      GLU  16  50.034   3.762   0.212
  114    H    GLU  17           HN       GLU  17  51.436   3.045  -0.786
  115    HA   GLU  17           HA       GLU  17  51.337   0.454   0.477
  116   1HB   GLU  17           HB2      GLU  17  50.782  -0.388  -1.744
  117   2HB   GLU  17           HB1      GLU  17  49.916   1.125  -1.470
  118   1HG   GLU  17           HG2      GLU  17  52.488   1.744  -2.571
  119   2HG   GLU  17           HG1      GLU  17  51.730   0.509  -3.579
  120    H    MET  18           HN       MET  18  53.840   2.222  -1.159
  121    HA   MET  18           HA       MET  18  55.444  -0.182  -1.697
  122   1HB   MET  18           HB2      MET  18  55.383   2.368  -2.777
  123   2HB   MET  18           HB1      MET  18  56.848   2.386  -1.794
  124   1HG   MET  18           HG2      MET  18  57.928   1.070  -3.269
  125   2HG   MET  18           HG1      MET  18  56.628  -0.120  -3.227
  126   1HE   MET  18           HE2      MET  18  58.575   2.246  -4.782
  127   2HE   MET  18           HE1      MET  18  57.960   2.507  -6.412
  128   3HE   MET  18           HE3      MET  18  57.451   3.566  -5.089
  129    H    ILE  19           HN       ILE  19  55.928   2.755   0.312
  130    HA   ILE  19           HA       ILE  19  58.180   1.823   1.730
  131    HB   ILE  19           HB       ILE  19  55.935   3.663   2.595
  132   1HG1  ILE  19          HG12      ILE  19  58.607   4.771   2.242
  133   2HG1  ILE  19          HG11      ILE  19  58.044   3.968   0.776
  134   1HG2  ILE  19          HG22      ILE  19  58.575   3.023   3.945
  135   2HG2  ILE  19          HG21      ILE  19  57.555   4.399   4.367
  136   3HG2  ILE  19          HG23      ILE  19  56.961   2.755   4.601
  137   1HD1  ILE  19          HD12      ILE  19  55.901   5.509   1.965
  138   2HD1  ILE  19          HD11      ILE  19  57.311   6.530   1.687
  139   3HD1  ILE  19          HD13      ILE  19  56.593   5.634   0.348
  140    H    ALA  20           HN       ALA  20  54.748   1.178   2.259
  141    HA   ALA  20           HA       ALA  20  55.057  -0.082   4.828
  142   1HB   ALA  20           HB2      ALA  20  52.933   0.301   2.856
  143   2HB   ALA  20           HB1      ALA  20  52.839  -1.270   3.651
  144   3HB   ALA  20           HB3      ALA  20  52.826   0.207   4.613
  145    H    GLU  21           HN       GLU  21  54.944  -1.379   1.504
  146    HA   GLU  21           HA       GLU  21  55.188  -4.133   2.317
  147   1HB   GLU  21           HB2      GLU  21  55.630  -4.588  -0.031
  148   2HB   GLU  21           HB1      GLU  21  54.353  -3.375   0.078
  149   1HG   GLU  21           HG2      GLU  21  55.738  -1.651  -0.631
  150   2HG   GLU  21           HG1      GLU  21  57.206  -2.468  -0.102
  151    H    PHE  22           HN       PHE  22  57.491  -1.554   1.849
  152    HA   PHE  22           HA       PHE  22  59.829  -3.208   1.512
  153   1HB   PHE  22           HB2      PHE  22  59.362  -0.350   2.336
  154   2HB   PHE  22           HB1      PHE  22  60.974  -1.054   2.444
  155    HD1  PHE  22           HD1      PHE  22  61.138  -2.822   0.147
  156    HD2  PHE  22           HD2      PHE  22  59.324   1.059   0.462
  157    HE1  PHE  22           HE1      PHE  22  61.458  -2.475  -2.287
  158    HE2  PHE  22           HE2      PHE  22  59.645   1.406  -1.972
  159    HZ   PHE  22           HZ       PHE  22  60.711  -0.360  -3.347
  160    H    LYS  23           HN       LYS  23  58.084  -1.981   4.325
  161    HA   LYS  23           HA       LYS  23  60.074  -2.593   6.287
  162   1HB   LYS  23           HB2      LYS  23  58.255  -1.194   6.956
  163   2HB   LYS  23           HB1      LYS  23  57.060  -2.381   6.431
  164   1HG   LYS  23           HG2      LYS  23  57.299  -2.425   8.881
  165   2HG   LYS  23           HG1      LYS  23  57.852  -3.946   8.176
  166   1HD   LYS  23           HD2      LYS  23  59.594  -3.450   9.652
  167   2HD   LYS  23           HD1      LYS  23  60.196  -2.763   8.143
  168   1HE   LYS  23           HE2      LYS  23  59.031  -0.580   8.903
  169   2HE   LYS  23           HE1      LYS  23  58.975  -1.330  10.499
  170   1HZ   LYS  23           HZ1      LYS  23  61.413  -1.712  10.259
  171   2HZ   LYS  23           HZ3      LYS  23  61.380  -0.743   8.867
  172   3HZ   LYS  23           HZ2      LYS  23  60.963  -0.077  10.374
  173    H    ALA  24           HN       ALA  24  57.842  -4.594   4.514
  174    HA   ALA  24           HA       ALA  24  57.702  -6.828   6.273
  175   1HB   ALA  24           HB2      ALA  24  56.486  -6.350   3.990
  176   2HB   ALA  24           HB1      ALA  24  57.870  -7.193   3.294
  177   3HB   ALA  24           HB3      ALA  24  56.830  -8.015   4.459
  178    H    ALA  25           HN       ALA  25  59.992  -6.145   3.611
  179    HA   ALA  25           HA       ALA  25  61.604  -8.489   4.160
  180   1HB   ALA  25           HB2      ALA  25  61.469  -6.525   2.142
  181   2HB   ALA  25           HB1      ALA  25  63.075  -6.365   2.852
  182   3HB   ALA  25           HB3      ALA  25  62.552  -7.917   2.197
  183    H    PHE  26           HN       PHE  26  61.480  -5.254   5.438
  184    HA   PHE  26           HA       PHE  26  64.130  -4.992   6.420
  185   1HB   PHE  26           HB2      PHE  26  62.191  -3.278   6.434
  186   2HB   PHE  26           HB1      PHE  26  61.711  -4.039   7.951
  187    HD1  PHE  26           HD1      PHE  26  64.349  -2.109   6.237
  188    HD2  PHE  26           HD2      PHE  26  63.060  -3.823   9.956
  189    HE1  PHE  26           HE1      PHE  26  66.084  -0.805   7.437
  190    HE2  PHE  26           HE2      PHE  26  64.795  -2.519  11.160
  191    HZ   PHE  26           HZ       PHE  26  66.306  -1.010   9.898
  192    H    ASP  27           HN       ASP  27  61.339  -5.782   8.514
  193    HA   ASP  27           HA       ASP  27  62.855  -6.844  10.635
  194   1HB   ASP  27           HB2      ASP  27  60.096  -7.767   9.779
  195   2HB   ASP  27           HB1      ASP  27  60.795  -7.894  11.394
  196    H    MET  28           HN       MET  28  62.223  -8.213   7.535
  197    HA   MET  28           HA       MET  28  62.505 -10.994   8.284
  198   1HB   MET  28           HB2      MET  28  61.874  -9.587   5.944
  199   2HB   MET  28           HB1      MET  28  63.394 -10.406   5.579
  200   1HG   MET  28           HG2      MET  28  62.168 -12.445   6.776
  201   2HG   MET  28           HG1      MET  28  60.727 -11.573   6.255
  202   1HE   MET  28           HE2      MET  28  60.872 -10.303   3.904
  203   2HE   MET  28           HE1      MET  28  62.612 -10.149   3.676
  204   3HE   MET  28           HE3      MET  28  61.627 -10.978   2.464
  205    H    PHE  29           HN       PHE  29  64.770  -8.623   6.848
  206    HA   PHE  29           HA       PHE  29  67.007 -10.502   7.269
  207   1HB   PHE  29           HB2      PHE  29  67.369  -7.664   6.357
  208   2HB   PHE  29           HB1      PHE  29  68.260  -9.111   5.880
  209    HD1  PHE  29           HD1      PHE  29  66.016 -10.974   5.303
  210    HD2  PHE  29           HD2      PHE  29  66.535  -6.829   4.296
  211    HE1  PHE  29           HE1      PHE  29  64.500 -11.260   3.363
  212    HE2  PHE  29           HE2      PHE  29  65.010  -7.116   2.356
  213    HZ   PHE  29           HZ       PHE  29  63.996  -9.330   1.891
  214    H    ASP  30           HN       ASP  30  65.400  -8.979   9.451
  215    HA   ASP  30           HA       ASP  30  67.705  -7.602  10.751
  216   1HB   ASP  30           HB2      ASP  30  65.659  -6.262  10.616
  217   2HB   ASP  30           HB1      ASP  30  64.740  -7.550  11.396
  218    H    ALA  31           HN       ALA  31  67.897 -10.367  10.688
  219    HA   ALA  31           HA       ALA  31  66.695 -11.779  12.830
  220   1HB   ALA  31           HB3      ALA  31  69.101 -12.110  11.137
  221   2HB   ALA  31           HB2      ALA  31  69.164 -12.929  12.699
  222   3HB   ALA  31           HB1      ALA  31  67.857 -13.285  11.570
  223    H    ASP  32           HN       ASP  32  69.026  -9.254  12.885
  224    HA   ASP  32           HA       ASP  32  70.271  -9.962  15.409
  225   1HB   ASP  32           HB2      ASP  32  70.717  -8.052  13.408
  226   2HB   ASP  32           HB1      ASP  32  70.274  -7.112  14.834
  227    H    GLY  33           HN       GLY  33  67.504  -7.979  14.441
  228   1HA   GLY  33           HA2      GLY  33  65.638  -7.405  15.791
  229   2HA   GLY  33           HA1      GLY  33  66.459  -8.121  17.178
  230    H    GLY  34           HN       GLY  34  68.799  -6.270  15.947
  231   1HA   GLY  34           HA2      GLY  34  68.631  -4.268  17.976
  232   2HA   GLY  34           HA1      GLY  34  69.706  -4.200  16.580
  233    H    GLY  35           HN       GLY  35  66.985  -4.563  15.010
  234   1HA   GLY  35           HA2      GLY  35  65.175  -3.084  14.400
  235   2HA   GLY  35           HA1      GLY  35  65.954  -1.796  15.321
  236    H    ASP  36           HN       ASP  36  67.790  -3.806  13.121
  237    HA   ASP  36           HA       ASP  36  67.587  -1.977  10.867
  238   1HB   ASP  36           HB2      ASP  36  70.011  -1.279  10.986
  239   2HB   ASP  36           HB1      ASP  36  68.993  -0.569  12.241
  240    H    ILE  37           HN       ILE  37  68.698  -2.820   9.017
  241    HA   ILE  37           HA       ILE  37  69.609  -5.635   9.392
  242    HB   ILE  37           HB       ILE  37  67.883  -5.773   7.857
  243   1HG1  ILE  37          HG12      ILE  37  70.306  -5.126   6.153
  244   2HG1  ILE  37          HG11      ILE  37  69.804  -6.722   6.716
  245   1HG2  ILE  37          HG23      ILE  37  68.791  -3.089   6.791
  246   2HG2  ILE  37          HG22      ILE  37  67.457  -4.026   6.120
  247   3HG2  ILE  37          HG21      ILE  37  67.358  -3.406   7.769
  248   1HD1  ILE  37          HD12      ILE  37  67.533  -5.751   5.457
  249   2HD1  ILE  37          HD11      ILE  37  68.843  -5.164   4.432
  250   3HD1  ILE  37          HD13      ILE  37  68.685  -6.891   4.759
  251    H    SER  38           HN       SER  38  71.333  -6.302   7.764
  252    HA   SER  38           HA       SER  38  73.487  -4.260   7.838
  253   1HB   SER  38           HB2      SER  38  73.988  -6.528   8.690
  254   2HB   SER  38           HB1      SER  38  73.579  -7.208   7.117
  255    HG   SER  38           HG       SER  38  75.669  -5.391   7.747
  256    H    THR  39           HN       THR  39  74.656  -3.680   5.909
  257    HA   THR  39           HA       THR  39  73.010  -3.498   3.553
  258    HB   THR  39           HB       THR  39  74.795  -2.318   2.553
  259    HG1  THR  39           HG1      THR  39  76.927  -2.547   3.314
  260   1HG2  THR  39          HG23      THR  39  74.293  -1.916   5.407
  261   2HG2  THR  39          HG22      THR  39  75.856  -1.280   4.895
  262   3HG2  THR  39          HG21      THR  39  74.380  -0.731   4.103
  263    H    LYS  40           HN       LYS  40  75.007  -5.961   4.784
  264    HA   LYS  40           HA       LYS  40  75.843  -7.127   2.261
  265   1HB   LYS  40           HB2      LYS  40  75.484  -8.548   4.914
  266   2HB   LYS  40           HB1      LYS  40  76.537  -9.021   3.579
  267   1HG   LYS  40           HG2      LYS  40  76.996  -6.281   4.565
  268   2HG   LYS  40           HG1      LYS  40  77.353  -7.544   5.742
  269   1HD   LYS  40           HD2      LYS  40  79.307  -7.897   4.686
  270   2HD   LYS  40           HD1      LYS  40  78.392  -8.472   3.291
  271   1HE   LYS  40           HE2      LYS  40  78.480  -5.540   3.529
  272   2HE   LYS  40           HE1      LYS  40  80.058  -6.283   3.274
  273   1HZ   LYS  40           HZ3      LYS  40  77.796  -7.185   1.642
  274   2HZ   LYS  40           HZ2      LYS  40  78.519  -5.694   1.268
  275   3HZ   LYS  40           HZ1      LYS  40  79.446  -7.117   1.255
  276    H    ALA  41           HN       ALA  41  72.984  -7.303   4.271
  277    HA   ALA  41           HA       ALA  41  71.899  -9.630   2.843
  278   1HB   ALA  41           HB2      ALA  41  71.398  -9.184   5.258
  279   2HB   ALA  41           HB1      ALA  41  70.517  -7.736   4.770
  280   3HB   ALA  41           HB3      ALA  41  69.945  -9.328   4.268
  281    H    LEU  42           HN       LEU  42  72.292  -6.448   2.030
  282    HA   LEU  42           HA       LEU  42  69.739  -5.714   0.985
  283   1HB   LEU  42           HB2      LEU  42  72.547  -4.828   0.614
  284   2HB   LEU  42           HB1      LEU  42  71.425  -4.426  -0.689
  285    HG   LEU  42           HG       LEU  42  71.518  -2.655   1.068
  286   1HD1  LEU  42          HD12      LEU  42  69.404  -3.378  -0.295
  287   2HD1  LEU  42          HD11      LEU  42  68.828  -3.984   1.258
  288   3HD1  LEU  42          HD13      LEU  42  69.211  -2.273   1.065
  289   1HD2  LEU  42          HD22      LEU  42  71.670  -4.735   2.828
  290   2HD2  LEU  42          HD21      LEU  42  71.198  -3.097   3.283
  291   3HD2  LEU  42          HD23      LEU  42  69.963  -4.315   2.960
  292    H    GLY  43           HN       GLY  43  72.496  -7.407  -0.518
  293   1HA   GLY  43           HA2      GLY  43  71.465  -7.619  -3.138
  294   2HA   GLY  43           HA1      GLY  43  72.542  -8.809  -2.403
  295    H    THR  44           HN       THR  44  70.547  -9.280  -0.207
  296    HA   THR  44           HA       THR  44  69.083 -11.419  -1.527
  297    HB   THR  44           HB       THR  44  68.797 -10.345   1.297
  298    HG1  THR  44           HG1      THR  44  70.538 -11.424   1.732
  299   1HG2  THR  44          HG21      THR  44  67.382 -12.350  -0.185
  300   2HG2  THR  44          HG23      THR  44  68.330 -13.141   1.075
  301   3HG2  THR  44          HG22      THR  44  67.173 -11.881   1.501
  302    H    VAL  45           HN       VAL  45  68.228  -8.270  -0.112
  303    HA   VAL  45           HA       VAL  45  65.395  -8.527  -0.451
  304    HB   VAL  45           HB       VAL  45  66.776  -5.873  -0.706
  305   1HG1  VAL  45          HG12      VAL  45  64.181  -6.975   0.203
  306   2HG1  VAL  45          HG11      VAL  45  64.830  -5.663   1.187
  307   3HG1  VAL  45          HG13      VAL  45  64.546  -5.414  -0.536
  308   1HG2  VAL  45          HG21      VAL  45  67.023  -7.818   1.516
  309   2HG2  VAL  45          HG23      VAL  45  68.063  -6.464   1.086
  310   3HG2  VAL  45          HG22      VAL  45  66.579  -6.179   1.992
  311    H    MET  46           HN       MET  46  67.769  -6.750  -2.470
  312    HA   MET  46           HA       MET  46  66.096  -6.000  -4.564
  313   1HB   MET  46           HB2      MET  46  68.977  -6.871  -4.502
  314   2HB   MET  46           HB1      MET  46  68.204  -6.478  -6.039
  315   1HG   MET  46           HG2      MET  46  68.357  -4.272  -5.616
  316   2HG   MET  46           HG1      MET  46  67.559  -4.473  -4.057
  317   1HE   MET  46           HE3      MET  46  68.929  -2.401  -4.084
  318   2HE   MET  46           HE2      MET  46  70.288  -2.356  -2.963
  319   3HE   MET  46           HE1      MET  46  70.587  -2.414  -4.699
  320    H    ARG  47           HN       ARG  47  67.144  -9.203  -3.700
  321    HA   ARG  47           HA       ARG  47  66.475 -10.426  -6.256
  322   1HB   ARG  47           HB2      ARG  47  66.970 -11.547  -3.487
  323   2HB   ARG  47           HB1      ARG  47  66.590 -12.563  -4.879
  324   1HG   ARG  47           HG2      ARG  47  68.641 -10.703  -5.632
  325   2HG   ARG  47           HG1      ARG  47  69.125 -11.507  -4.138
  326   1HD   ARG  47           HD2      ARG  47  68.113 -13.610  -5.561
  327   2HD   ARG  47           HD1      ARG  47  68.794 -12.621  -6.852
  328    HE   ARG  47           HE       ARG  47  70.333 -14.204  -5.085
  329   1HH1  ARG  47          HH11      ARG  47  71.091 -11.774  -3.695
  330   2HH1  ARG  47          HH12      ARG  47  72.365 -11.118  -4.665
  331   1HH2  ARG  47          HH21      ARG  47  71.578 -13.017  -7.458
  332   2HH2  ARG  47          HH22      ARG  47  72.642 -11.821  -6.795
  333    H    MET  48           HN       MET  48  64.865 -10.198  -3.074
  334    HA   MET  48           HA       MET  48  62.503 -11.626  -3.924
  335   1HB   MET  48           HB2      MET  48  63.243  -9.906  -1.583
  336   2HB   MET  48           HB1      MET  48  61.537 -10.253  -1.869
  337   1HG   MET  48           HG2      MET  48  62.527 -11.935  -0.364
  338   2HG   MET  48           HG1      MET  48  62.033 -12.673  -1.889
  339   1HE   MET  48           HE2      MET  48  64.125 -12.329   0.668
  340   2HE   MET  48           HE1      MET  48  65.518 -13.336   0.282
  341   3HE   MET  48           HE3      MET  48  65.624 -11.577   0.129
  342    H    LEU  49           HN       LEU  49  62.957  -8.136  -3.229
  343    HA   LEU  49           HA       LEU  49  60.551  -7.143  -4.161
  344   1HB   LEU  49           HB2      LEU  49  63.147  -5.826  -4.968
  345   2HB   LEU  49           HB1      LEU  49  61.624  -5.060  -4.517
  346    HG   LEU  49           HG       LEU  49  63.605  -6.469  -2.720
  347   1HD1  LEU  49          HD11      LEU  49  62.739  -3.712  -3.257
  348   2HD1  LEU  49          HD13      LEU  49  62.753  -4.124  -1.542
  349   3HD1  LEU  49          HD12      LEU  49  64.222  -4.298  -2.503
  350   1HD2  LEU  49          HD23      LEU  49  61.325  -7.279  -2.183
  351   2HD2  LEU  49          HD22      LEU  49  61.947  -6.230  -0.907
  352   3HD2  LEU  49          HD21      LEU  49  60.767  -5.610  -2.061
  353    H    GLY  50           HN       GLY  50  63.417  -7.145  -6.310
  354   1HA   GLY  50           HA2      GLY  50  62.504  -8.670  -8.423
  355   2HA   GLY  50           HA1      GLY  50  61.704  -7.117  -8.669
  356    H    GLN  51           HN       GLN  51  63.435  -5.211  -8.208
  357    HA   GLN  51           HA       GLN  51  65.164  -5.032 -10.355
  358   1HB   GLN  51           HB2      GLN  51  66.307  -3.263  -9.195
  359   2HB   GLN  51           HB1      GLN  51  64.627  -3.216  -8.661
  360   1HG   GLN  51           HG2      GLN  51  65.479  -4.834  -6.771
  361   2HG   GLN  51           HG1      GLN  51  67.057  -4.156  -7.171
  362   1HE2  GLN  51          HE22      GLN  51  64.644  -2.024  -4.834
  363   2HE2  GLN  51          HE21      GLN  51  64.475  -3.689  -5.115
  364    H    ASN  52           HN       ASN  52  66.785  -6.375 -10.968
  365    HA   ASN  52           HA       ASN  52  68.446  -7.626  -8.816
  366   1HB   ASN  52           HB2      ASN  52  68.236  -8.735 -11.607
  367   2HB   ASN  52           HB1      ASN  52  68.647  -9.573 -10.110
  368   1HD2  ASN  52          HD22      ASN  52  65.249 -10.077  -9.142
  369   2HD2  ASN  52          HD21      ASN  52  66.852 -10.036  -8.585
  370    HA   PRO  53           HA       PRO  53  71.212  -4.857 -11.219
  371   1HB   PRO  53           HB2      PRO  53  72.422  -3.788  -8.993
  372   2HB   PRO  53           HB1      PRO  53  70.945  -3.127  -9.718
  373   1HG   PRO  53           HG2      PRO  53  71.258  -4.718  -7.215
  374   2HG   PRO  53           HG1      PRO  53  70.006  -3.542  -7.648
  375   1HD   PRO  53           HD2      PRO  53  69.730  -6.359  -7.722
  376   2HD   PRO  53           HD1      PRO  53  68.622  -5.181  -8.460
  377    H    THR  54           HN       THR  54  73.612  -4.964 -11.310
  378    HA   THR  54           HA       THR  54  74.599  -7.626 -10.693
  379    HB   THR  54           HB       THR  54  76.565  -6.985 -11.864
  380    HG1  THR  54           HG1      THR  54  77.151  -5.136 -10.855
  381   1HG2  THR  54          HG22      THR  54  74.400  -6.977 -13.189
  382   2HG2  THR  54          HG21      THR  54  74.416  -5.219 -13.052
  383   3HG2  THR  54          HG23      THR  54  75.718  -6.050 -13.902
  384    H    LYS  55           HN       LYS  55  76.148  -8.197  -9.132
  385    HA   LYS  55           HA       LYS  55  76.090  -7.084  -6.605
  386   1HB   LYS  55           HB2      LYS  55  78.438  -8.052  -6.316
  387   2HB   LYS  55           HB1      LYS  55  77.210  -9.179  -6.895
  388   1HG   LYS  55           HG2      LYS  55  78.003  -8.390  -9.273
  389   2HG   LYS  55           HG1      LYS  55  79.461  -7.894  -8.414
  390   1HD   LYS  55           HD2      LYS  55  80.136 -10.037  -8.071
  391   2HD   LYS  55           HD1      LYS  55  78.501 -10.592  -7.708
  392   1HE   LYS  55           HE2      LYS  55  79.014 -11.674  -9.743
  393   2HE   LYS  55           HE1      LYS  55  78.052 -10.281 -10.242
  394   1HZ   LYS  55           HZ3      LYS  55  81.017 -10.278 -10.132
  395   2HZ   LYS  55           HZ2      LYS  55  80.129 -10.623 -11.538
  396   3HZ   LYS  55           HZ1      LYS  55  80.012  -9.092 -10.811
  397    H    GLU  56           HN       GLU  56  78.317  -6.181  -9.237
  398    HA   GLU  56           HA       GLU  56  79.904  -4.325  -7.824
  399   1HB   GLU  56           HB2      GLU  56  78.953  -4.140 -10.700
  400   2HB   GLU  56           HB1      GLU  56  80.331  -3.279 -10.015
  401   1HG   GLU  56           HG2      GLU  56  81.622  -5.057 -10.499
  402   2HG   GLU  56           HG1      GLU  56  80.690  -6.000  -9.335
  403    H    GLU  57           HN       GLU  57  76.844  -3.740  -9.586
  404    HA   GLU  57           HA       GLU  57  76.707  -0.952  -8.915
  405   1HB   GLU  57           HB2      GLU  57  74.674  -2.990  -9.813
  406   2HB   GLU  57           HB1      GLU  57  74.186  -1.349  -9.391
  407   1HG   GLU  57           HG2      GLU  57  76.506  -1.207 -11.070
  408   2HG   GLU  57           HG1      GLU  57  75.313  -2.251 -11.844
  409    H    LEU  58           HN       LEU  58  75.906  -3.854  -7.159
  410    HA   LEU  58           HA       LEU  58  74.118  -2.616  -5.251
  411   1HB   LEU  58           HB2      LEU  58  74.097  -5.032  -5.536
  412   2HB   LEU  58           HB1      LEU  58  75.800  -5.135  -5.086
  413    HG   LEU  58           HG       LEU  58  75.078  -4.004  -2.872
  414   1HD1  LEU  58          HD13      LEU  58  72.424  -4.900  -4.017
  415   2HD1  LEU  58          HD12      LEU  58  72.674  -4.596  -2.298
  416   3HD1  LEU  58          HD11      LEU  58  72.864  -3.285  -3.463
  417   1HD2  LEU  58          HD21      LEU  58  75.635  -6.504  -3.377
  418   2HD2  LEU  58          HD23      LEU  58  74.797  -6.117  -1.875
  419   3HD2  LEU  58          HD22      LEU  58  73.892  -6.750  -3.250
  420    H    ASP  59           HN       ASP  59  77.600  -3.414  -5.175
  421    HA   ASP  59           HA       ASP  59  78.101  -2.437  -2.550
  422   1HB   ASP  59           HB2      ASP  59  79.679  -3.210  -4.887
  423   2HB   ASP  59           HB1      ASP  59  80.422  -1.891  -3.982
  424    H    ALA  60           HN       ALA  60  78.176  -0.776  -5.703
  425    HA   ALA  60           HA       ALA  60  79.045   1.753  -4.628
  426   1HB   ALA  60           HB1      ALA  60  77.860   0.807  -7.204
  427   2HB   ALA  60           HB3      ALA  60  77.806   2.535  -6.858
  428   3HB   ALA  60           HB2      ALA  60  79.356   1.695  -6.918
  429    H    ILE  61           HN       ILE  61  75.937   0.174  -4.884
  430    HA   ILE  61           HA       ILE  61  74.373   2.590  -4.439
  431    HB   ILE  61           HB       ILE  61  73.767  -0.368  -4.362
  432   1HG1  ILE  61          HG12      ILE  61  72.735   1.924  -6.064
  433   2HG1  ILE  61          HG11      ILE  61  73.991   0.787  -6.553
  434   1HG2  ILE  61          HG21      ILE  61  72.337   1.761  -3.008
  435   2HG2  ILE  61          HG23      ILE  61  71.339   1.047  -4.274
  436   3HG2  ILE  61          HG22      ILE  61  72.013   0.028  -3.005
  437   1HD1  ILE  61          HD13      ILE  61  72.213  -1.039  -5.963
  438   2HD1  ILE  61          HD12      ILE  61  71.057   0.285  -6.113
  439   3HD1  ILE  61          HD11      ILE  61  72.066  -0.166  -7.489
  440    H    ILE  62           HN       ILE  62  75.802   0.083  -2.412
  441    HA   ILE  62           HA       ILE  62  74.439   0.723   0.018
  442    HB   ILE  62           HB       ILE  62  77.190  -0.445  -0.489
  443   1HG1  ILE  62          HG12      ILE  62  74.938  -1.994   0.686
  444   2HG1  ILE  62          HG11      ILE  62  74.773  -1.548  -1.012
  445   1HG2  ILE  62          HG21      ILE  62  76.032   0.573   1.945
  446   2HG2  ILE  62          HG23      ILE  62  76.190  -1.180   2.061
  447   3HG2  ILE  62          HG22      ILE  62  77.605  -0.189   1.708
  448   1HD1  ILE  62          HD12      ILE  62  77.439  -2.572  -0.255
  449   2HD1  ILE  62          HD11      ILE  62  76.133  -3.752  -0.143
  450   3HD1  ILE  62          HD13      ILE  62  76.454  -2.937  -1.672
  451    H    GLU  63           HN       GLU  63  77.549   1.881  -1.309
  452    HA   GLU  63           HA       GLU  63  78.126   3.649   0.880
  453   1HB   GLU  63           HB2      GLU  63  79.341   2.913  -1.586
  454   2HB   GLU  63           HB1      GLU  63  79.200   4.672  -1.580
  455   1HG   GLU  63           HG2      GLU  63  81.219   4.398  -0.460
  456   2HG   GLU  63           HG1      GLU  63  80.092   4.421   0.896
  457    H    GLU  64           HN       GLU  64  76.121   3.959  -1.980
  458    HA   GLU  64           HA       GLU  64  75.872   6.865  -1.731
  459   1HB   GLU  64           HB2      GLU  64  74.781   4.747  -3.516
  460   2HB   GLU  64           HB1      GLU  64  73.811   6.208  -3.334
  461   1HG   GLU  64           HG2      GLU  64  75.696   7.599  -3.999
  462   2HG   GLU  64           HG1      GLU  64  76.755   6.188  -4.061
  463    H    VAL  65           HN       VAL  65  74.540   4.203  -0.114
  464    HA   VAL  65           HA       VAL  65  72.016   5.629   0.527
  465    HB   VAL  65           HB       VAL  65  73.024   2.839   1.126
  466   1HG1  VAL  65          HG12      VAL  65  70.887   4.451   2.406
  467   2HG1  VAL  65          HG11      VAL  65  70.432   2.815   1.929
  468   3HG1  VAL  65          HG13      VAL  65  71.783   3.067   3.036
  469   1HG2  VAL  65          HG23      VAL  65  71.067   4.112  -0.733
  470   2HG2  VAL  65          HG22      VAL  65  72.119   2.719  -0.991
  471   3HG2  VAL  65          HG21      VAL  65  70.634   2.541  -0.057
  472    H    ASP  66           HN       ASP  66  74.889   4.277   2.151
  473    HA   ASP  66           HA       ASP  66  74.105   5.420   4.730
  474   1HB   ASP  66           HB2      ASP  66  76.271   3.698   3.692
  475   2HB   ASP  66           HB1      ASP  66  76.749   4.775   5.005
  476    H    GLU  67           HN       GLU  67  73.910   7.662   3.749
  477    HA   GLU  67           HA       GLU  67  76.249   9.065   2.839
  478   1HB   GLU  67           HB2      GLU  67  73.482   9.763   3.640
  479   2HB   GLU  67           HB1      GLU  67  74.672  11.051   3.826
  480   1HG   GLU  67           HG2      GLU  67  74.964   9.600   1.298
  481   2HG   GLU  67           HG1      GLU  67  73.389  10.377   1.461
  482    H    ASP  68           HN       ASP  68  75.376   7.926   5.905
  483    HA   ASP  68           HA       ASP  68  76.903  10.047   7.319
  484   1HB   ASP  68           HB2      ASP  68  76.169   8.631   9.361
  485   2HB   ASP  68           HB1      ASP  68  74.920   9.529   8.498
  486    H    GLY  69           HN       GLY  69  77.197   6.786   6.172
  487   1HA   GLY  69           HA2      GLY  69  79.113   5.418   6.098
  488   2HA   GLY  69           HA1      GLY  69  80.017   6.729   6.856
  489    H    SER  70           HN       SER  70  77.096   5.177   8.136
  490    HA   SER  70           HA       SER  70  78.446   4.738  10.693
  491   1HB   SER  70           HB2      SER  70  76.195   3.646  11.264
  492   2HB   SER  70           HB1      SER  70  76.155   5.360  10.857
  493    HG   SER  70           HG       SER  70  75.005   3.252   9.608
  494    H    GLY  71           HN       GLY  71  77.370   2.763   7.962
  495   1HA   GLY  71           HA2      GLY  71  78.594   0.717   7.400
  496   2HA   GLY  71           HA1      GLY  71  78.940   0.504   9.116
  497    H    THR  72           HN       THR  72  75.766   1.548   8.675
  498    HA   THR  72           HA       THR  72  74.687  -1.206   8.407
  499    HB   THR  72           HB       THR  72  73.128  -0.274  10.439
  500    HG1  THR  72           HG1      THR  72  74.201   1.416  11.136
  501   1HG2  THR  72          HG23      THR  72  75.592  -1.976  10.336
  502   2HG2  THR  72          HG22      THR  72  74.860  -1.627  11.902
  503   3HG2  THR  72          HG21      THR  72  73.922  -2.446  10.654
  504    H    ILE  73           HN       ILE  73  72.298  -1.160   8.061
  505    HA   ILE  73           HA       ILE  73  71.461   1.436   6.827
  506    HB   ILE  73           HB       ILE  73  70.697  -1.402   6.077
  507   1HG1  ILE  73          HG12      ILE  73  73.002  -0.471   5.427
  508   2HG1  ILE  73          HG11      ILE  73  71.994  -1.060   4.106
  509   1HG2  ILE  73          HG22      ILE  73  69.680   1.298   5.222
  510   2HG2  ILE  73          HG21      ILE  73  69.661  -0.052   4.087
  511   3HG2  ILE  73          HG23      ILE  73  68.765  -0.163   5.602
  512   1HD1  ILE  73          HD13      ILE  73  71.461   1.745   4.699
  513   2HD1  ILE  73          HD12      ILE  73  73.153   1.475   4.285
  514   3HD1  ILE  73          HD11      ILE  73  71.882   0.989   3.162
  515    H    ASP  74           HN       ASP  74  69.403   2.205   7.328
  516    HA   ASP  74           HA       ASP  74  67.864   0.619   9.346
  517   1HB   ASP  74           HB2      ASP  74  67.710   3.614   9.245
  518   2HB   ASP  74           HB1      ASP  74  67.465   2.530  10.616
  519    H    PHE  75           HN       PHE  75  65.480   1.202   9.321
  520    HA   PHE  75           HA       PHE  75  64.346   0.879   6.771
  521   1HB   PHE  75           HB2      PHE  75  63.248   0.688   9.120
  522   2HB   PHE  75           HB1      PHE  75  62.908   2.408   8.932
  523    HD1  PHE  75           HD2      PHE  75  62.901  -0.500   6.564
  524    HD2  PHE  75           HD1      PHE  75  60.686   2.745   8.298
  525    HE1  PHE  75           HE2      PHE  75  60.967  -1.043   5.108
  526    HE2  PHE  75           HE1      PHE  75  58.754   2.205   6.842
  527    HZ   PHE  75           HZ       PHE  75  58.894   0.310   5.248
  528    H    GLU  76           HN       GLU  76  65.254   3.849   8.446
  529    HA   GLU  76           HA       GLU  76  63.899   5.656   6.666
  530   1HB   GLU  76           HB2      GLU  76  66.198   5.914   8.592
  531   2HB   GLU  76           HB1      GLU  76  65.795   7.251   7.514
  532   1HG   GLU  76           HG2      GLU  76  63.411   7.080   8.348
  533   2HG   GLU  76           HG1      GLU  76  63.992   5.942   9.564
  534    H    GLU  77           HN       GLU  77  67.212   4.333   6.691
  535    HA   GLU  77           HA       GLU  77  67.912   5.736   4.221
  536   1HB   GLU  77           HB2      GLU  77  69.304   3.539   5.784
  537   2HB   GLU  77           HB1      GLU  77  69.986   4.320   4.357
  538   1HG   GLU  77           HG2      GLU  77  69.923   6.494   5.466
  539   2HG   GLU  77           HG1      GLU  77  69.131   5.782   6.872
  540    H    PHE  78           HN       PHE  78  66.168   2.928   4.973
  541    HA   PHE  78           HA       PHE  78  66.926   1.250   2.760
  542   1HB   PHE  78           HB2      PHE  78  65.236   1.004   4.948
  543   2HB   PHE  78           HB1      PHE  78  64.122   1.035   3.581
  544    HD1  PHE  78           HD1      PHE  78  67.057  -0.698   5.041
  545    HD2  PHE  78           HD2      PHE  78  64.037  -0.761   1.989
  546    HE1  PHE  78           HE1      PHE  78  67.664  -3.038   4.492
  547    HE2  PHE  78           HE2      PHE  78  64.643  -3.103   1.438
  548    HZ   PHE  78           HZ       PHE  78  66.456  -4.241   2.689
  549    H    LEU  79           HN       LEU  79  63.980   3.237   3.203
  550    HA   LEU  79           HA       LEU  79  62.929   3.075   0.638
  551   1HB   LEU  79           HB2      LEU  79  63.106   5.629   2.271
  552   2HB   LEU  79           HB1      LEU  79  61.920   5.268   1.015
  553    HG   LEU  79           HG       LEU  79  62.248   3.715   3.600
  554   1HD1  LEU  79          HD12      LEU  79  60.490   5.979   2.748
  555   2HD1  LEU  79          HD11      LEU  79  59.801   4.735   3.792
  556   3HD1  LEU  79          HD13      LEU  79  61.211   5.652   4.324
  557   1HD2  LEU  79          HD21      LEU  79  61.436   2.390   1.646
  558   2HD2  LEU  79          HD23      LEU  79  60.205   2.569   2.895
  559   3HD2  LEU  79          HD22      LEU  79  60.128   3.553   1.435
  560    H    VAL  80           HN       VAL  80  65.797   4.782   1.692
  561    HA   VAL  80           HA       VAL  80  66.103   6.419  -0.669
  562    HB   VAL  80           HB       VAL  80  68.051   5.477   1.448
  563   1HG1  VAL  80          HG12      VAL  80  68.478   7.016  -1.088
  564   2HG1  VAL  80          HG11      VAL  80  69.392   7.484   0.347
  565   3HG1  VAL  80          HG13      VAL  80  69.537   5.848  -0.298
  566   1HG2  VAL  80          HG21      VAL  80  66.639   8.088   0.837
  567   2HG2  VAL  80          HG23      VAL  80  66.460   7.085   2.276
  568   3HG2  VAL  80          HG22      VAL  80  67.966   7.955   1.990
  569    H    MET  81           HN       MET  81  67.709   3.380   0.352
  570    HA   MET  81           HA       MET  81  69.203   2.957  -2.002
  571   1HB   MET  81           HB2      MET  81  69.050   1.606   0.279
  572   2HB   MET  81           HB1      MET  81  67.935   0.607  -0.652
  573   1HG   MET  81           HG2      MET  81  69.616   0.208  -2.353
  574   2HG   MET  81           HG1      MET  81  70.725   1.341  -1.580
  575   1HE   MET  81           HE3      MET  81  71.175   1.116   1.062
  576   2HE   MET  81           HE2      MET  81  72.143  -0.316   1.405
  577   3HE   MET  81           HE1      MET  81  72.501   0.660  -0.015
  578    H    MET  82           HN       MET  82  65.817   2.197  -1.296
  579    HA   MET  82           HA       MET  82  65.303   0.642  -3.637
  580   1HB   MET  82           HB2      MET  82  63.405   2.439  -2.094
  581   2HB   MET  82           HB1      MET  82  62.932   1.165  -3.220
  582   1HG   MET  82           HG2      MET  82  64.654   0.647  -0.786
  583   2HG   MET  82           HG1      MET  82  62.896   0.503  -0.765
  584   1HE   MET  82           HE1      MET  82  66.111  -0.280  -2.211
  585   2HE   MET  82           HE3      MET  82  66.092  -1.810  -1.325
  586   3HE   MET  82           HE2      MET  82  66.009  -1.807  -3.084
  587    H    VAL  83           HN       VAL  83  64.211   4.013  -3.089
  588    HA   VAL  83           HA       VAL  83  63.653   4.577  -5.800
  589    HB   VAL  83           HB       VAL  83  64.631   6.503  -3.669
  590   1HG1  VAL  83          HG13      VAL  83  63.434   6.827  -6.402
  591   2HG1  VAL  83          HG12      VAL  83  63.059   8.015  -5.156
  592   3HG1  VAL  83          HG11      VAL  83  64.733   7.744  -5.638
  593   1HG2  VAL  83          HG23      VAL  83  61.849   5.577  -4.456
  594   2HG2  VAL  83          HG22      VAL  83  62.658   5.275  -2.919
  595   3HG2  VAL  83          HG21      VAL  83  62.181   6.915  -3.355
  596    H    ARG  84           HN       ARG  84  66.687   4.199  -4.224
  597    HA   ARG  84           HA       ARG  84  68.292   5.872  -5.927
  598   1HB   ARG  84           HB2      ARG  84  68.795   3.619  -4.033
  599   2HB   ARG  84           HB1      ARG  84  70.062   4.000  -5.198
  600   1HG   ARG  84           HG2      ARG  84  69.263   6.497  -4.269
  601   2HG   ARG  84           HG1      ARG  84  69.220   5.485  -2.825
  602   1HD   ARG  84           HD2      ARG  84  71.468   5.452  -2.719
  603   2HD   ARG  84           HD1      ARG  84  71.578   4.881  -4.384
  604    HE   ARG  84           HE       ARG  84  72.373   7.058  -4.805
  605   1HH1  ARG  84          HH11      ARG  84  71.418   7.581  -1.777
  606   2HH1  ARG  84          HH12      ARG  84  70.587   9.078  -2.037
  607   1HH2  ARG  84          HH21      ARG  84  70.583   8.782  -5.492
  608   2HH2  ARG  84          HH22      ARG  84  70.112   9.757  -4.140
  609    H    GLN  85           HN       GLN  85  67.571   2.365  -6.034
  610    HA   GLN  85           HA       GLN  85  68.985   1.943  -8.512
  611   1HB   GLN  85           HB2      GLN  85  67.668   0.335  -6.612
  612   2HB   GLN  85           HB1      GLN  85  66.803   0.076  -8.128
  613   1HG   GLN  85           HG2      GLN  85  69.618   0.141  -8.678
  614   2HG   GLN  85           HG1      GLN  85  69.327  -0.993  -7.359
  615   1HE2  GLN  85          HE22      GLN  85  67.424  -1.733 -10.941
  616   2HE2  GLN  85          HE21      GLN  85  67.715  -0.124 -10.482
  617    H    MET  86           HN       MET  86  65.754   3.024  -7.717
  618    HA   MET  86           HA       MET  86  64.545   2.511 -10.273
  619   1HB   MET  86           HB2      MET  86  63.931   4.517  -8.089
  620   2HB   MET  86           HB1      MET  86  62.940   4.344  -9.538
  621   1HG   MET  86           HG2      MET  86  62.312   2.130  -8.985
  622   2HG   MET  86           HG1      MET  86  63.614   1.967  -7.807
  623   1HE   MET  86           HE2      MET  86  62.494   1.025  -6.331
  624   2HE   MET  86           HE1      MET  86  62.340   2.060  -4.914
  625   3HE   MET  86           HE3      MET  86  60.895   1.387  -5.684
  626    H    LYS  87           HN       LYS  87  66.262   5.331  -8.935
  627    HA   LYS  87           HA       LYS  87  66.816   6.210 -11.709
  628   1HB   LYS  87           HB2      LYS  87  66.230   8.598 -10.971
  629   2HB   LYS  87           HB1      LYS  87  64.872   7.517 -11.289
  630   1HG   LYS  87           HG2      LYS  87  64.405   7.220  -9.010
  631   2HG   LYS  87           HG1      LYS  87  66.021   7.728  -8.516
  632   1HD   LYS  87           HD2      LYS  87  65.066   9.948  -9.865
  633   2HD   LYS  87           HD1      LYS  87  63.634   9.352  -9.025
  634   1HE   LYS  87           HE2      LYS  87  65.873   9.189  -7.241
  635   2HE   LYS  87           HE1      LYS  87  65.817  10.813  -7.928
  636   1HZ   LYS  87           HZ2      LYS  87  63.204  10.028  -7.317
  637   2HZ   LYS  87           HZ1      LYS  87  64.169   9.709  -5.955
  638   3HZ   LYS  87           HZ3      LYS  87  64.120  11.273  -6.610
  639    H    GLU  88           HN       GLU  88  69.025   5.823 -11.391
  640    HA   GLU  88           HA       GLU  88  70.382   6.864  -9.009
  641   1HB   GLU  88           HB2      GLU  88  70.968   4.966 -11.080
  642   2HB   GLU  88           HB1      GLU  88  72.258   6.168 -11.034
  643   1HG   GLU  88           HG2      GLU  88  72.550   5.807  -8.631
  644   2HG   GLU  88           HG1      GLU  88  71.206   4.665  -8.619
  645    H    ASP  89           HN       ASP  89  69.847   7.840 -12.335
  646    HA   ASP  89           HA       ASP  89  70.574   9.744 -13.518
  647   1HB   ASP  89           HB2      ASP  89  69.215  10.492 -11.248
  648   2HB   ASP  89           HB1      ASP  89  70.722  11.391 -11.081
  649    H    ALA  90           HN       ALA  90  72.712   9.175 -14.076
  650    HA   ALA  90           HA       ALA  90  74.797  10.797 -12.950
  651   1HB   ALA  90           HB3      ALA  90  74.323   8.268 -11.654
  652   2HB   ALA  90           HB2      ALA  90  75.892   8.227 -12.455
  653   3HB   ALA  90           HB1      ALA  90  75.539   9.488 -11.274
   
  No H/Q in entry =         653
  Start of MODEL    5
    1   1H    ALA   1           HT2      ALA   1  70.835  10.678   9.513
    2   2H    ALA   1           HT1      ALA   1  72.411  10.109   9.233
    3   3H    ALA   1           HT3      ALA   1  71.580   9.643  10.636
    4    HA   ALA   1           HA       ALA   1  72.802  11.270  11.575
    5   1HB   ALA   1           HB1      ALA   1  72.899  12.339   8.761
    6   2HB   ALA   1           HB3      ALA   1  73.392  13.354  10.116
    7   3HB   ALA   1           HB2      ALA   1  74.233  11.837   9.799
    8    H    SER   2           HN       SER   2  70.878  13.107   9.182
    9    HA   SER   2           HA       SER   2  69.070  13.933  11.404
   10   1HB   SER   2           HB2      SER   2  70.541  15.796  11.269
   11   2HB   SER   2           HB1      SER   2  70.598  15.726   9.510
   12    HG   SER   2           HG       SER   2  69.110  17.228   9.771
   13    H    MET   3           HN       MET   3  69.151  15.328   8.174
   14    HA   MET   3           HA       MET   3  66.890  13.603   7.326
   15   1HB   MET   3           HB2      MET   3  66.471  16.156   8.415
   16   2HB   MET   3           HB1      MET   3  66.341  16.378   6.670
   17   1HG   MET   3           HG2      MET   3  64.171  15.728   7.140
   18   2HG   MET   3           HG1      MET   3  64.899  14.149   6.847
   19   1HE   MET   3           HE3      MET   3  64.094  16.874   9.148
   20   2HE   MET   3           HE2      MET   3  62.608  15.970   9.430
   21   3HE   MET   3           HE1      MET   3  63.767  16.180  10.741
   22    H    THR   4           HN       THR   4  69.051  13.090   6.070
   23    HA   THR   4           HA       THR   4  70.077  14.852   4.106
   24    HB   THR   4           HB       THR   4  70.720  12.743   2.882
   25    HG1  THR   4           HG1      THR   4  70.130  10.804   3.822
   26   1HG2  THR   4          HG23      THR   4  72.011  13.752   4.823
   27   2HG2  THR   4          HG22      THR   4  71.223  12.562   5.858
   28   3HG2  THR   4          HG21      THR   4  72.283  12.030   4.553
   29    H    ASP   5           HN       ASP   5  69.600  14.973   1.805
   30    HA   ASP   5           HA       ASP   5  66.779  15.130   1.239
   31   1HB   ASP   5           HB2      ASP   5  69.105  15.132  -0.707
   32   2HB   ASP   5           HB1      ASP   5  67.473  15.716  -1.032
   33    H    GLN   6           HN       GLN   6  68.922  12.509   1.282
   34    HA   GLN   6           HA       GLN   6  67.951  10.961  -0.922
   35   1HB   GLN   6           HB2      GLN   6  69.032  10.003   1.747
   36   2HB   GLN   6           HB1      GLN   6  68.894   9.030   0.282
   37   1HG   GLN   6           HG2      GLN   6  70.323  10.894  -0.829
   38   2HG   GLN   6           HG1      GLN   6  70.728  11.359   0.824
   39   1HE2  GLN   6          HE22      GLN   6  71.924   7.717   1.162
   40   2HE2  GLN   6          HE21      GLN   6  70.485   8.442   1.700
   41    H    GLN   7           HN       GLN   7  66.967  11.039   2.514
   42    HA   GLN   7           HA       GLN   7  64.770   9.175   2.046
   43   1HB   GLN   7           HB2      GLN   7  65.252  11.005   4.418
   44   2HB   GLN   7           HB1      GLN   7  64.194   9.594   4.377
   45   1HG   GLN   7           HG2      GLN   7  66.002   8.089   4.245
   46   2HG   GLN   7           HG1      GLN   7  67.125   9.342   3.717
   47   1HE2  GLN   7          HE22      GLN   7  67.970   8.904   7.255
   48   2HE2  GLN   7          HE21      GLN   7  68.208   8.106   5.776
   49    H    ALA   8           HN       ALA   8  65.235  12.592   1.787
   50    HA   ALA   8           HA       ALA   8  62.477  13.379   2.168
   51   1HB   ALA   8           HB1      ALA   8  64.832  14.701   0.803
   52   2HB   ALA   8           HB3      ALA   8  63.244  15.461   0.911
   53   3HB   ALA   8           HB2      ALA   8  64.142  15.084   2.381
   54    H    GLU   9           HN       GLU   9  64.398  13.329  -0.861
   55    HA   GLU   9           HA       GLU   9  62.100  13.454  -2.558
   56   1HB   GLU   9           HB2      GLU   9  64.482  13.977  -3.229
   57   2HB   GLU   9           HB1      GLU   9  64.784  12.239  -3.263
   58   1HG   GLU   9           HG2      GLU   9  62.357  12.904  -4.716
   59   2HG   GLU   9           HG1      GLU   9  63.743  13.792  -5.354
   60    H    ALA  10           HN       ALA  10  64.098  10.676  -1.527
   61    HA   ALA  10           HA       ALA  10  62.769   8.661  -2.979
   62   1HB   ALA  10           HB3      ALA  10  64.851   8.413  -1.542
   63   2HB   ALA  10           HB2      ALA  10  63.777   8.336  -0.144
   64   3HB   ALA  10           HB1      ALA  10  63.681   7.101  -1.400
   65    H    ARG  11           HN       ARG  11  61.951  10.013   0.220
   66    HA   ARG  11           HA       ARG  11  59.688   8.277   0.634
   67   1HB   ARG  11           HB2      ARG  11  60.971   9.709   2.367
   68   2HB   ARG  11           HB1      ARG  11  59.951  11.040   1.816
   69   1HG   ARG  11           HG2      ARG  11  57.936   9.755   2.357
   70   2HG   ARG  11           HG1      ARG  11  58.926   8.379   2.850
   71   1HD   ARG  11           HD2      ARG  11  59.926   9.705   4.647
   72   2HD   ARG  11           HD1      ARG  11  59.026  11.129   4.127
   73    HE   ARG  11           HE       ARG  11  57.044   9.268   4.593
   74   1HH1  ARG  11          HH21      ARG  11  59.549   8.579   6.487
   75   2HH1  ARG  11          HH22      ARG  11  58.906   9.185   7.976
   76   1HH2  ARG  11          HH11      ARG  11  56.282  10.872   6.465
   77   2HH2  ARG  11          HH12      ARG  11  57.056  10.483   7.963
   78    H    ALA  12           HN       ALA  12  60.093  11.429  -0.913
   79    HA   ALA  12           HA       ALA  12  57.310  12.075  -1.116
   80   1HB   ALA  12           HB3      ALA  12  59.574  13.426  -1.682
   81   2HB   ALA  12           HB2      ALA  12  59.131  12.920  -3.312
   82   3HB   ALA  12           HB1      ALA  12  58.007  13.880  -2.351
   83    H    PHE  13           HN       PHE  13  59.479  10.199  -3.209
   84    HA   PHE  13           HA       PHE  13  57.451   9.852  -5.276
   85   1HB   PHE  13           HB2      PHE  13  59.933   9.773  -5.702
   86   2HB   PHE  13           HB1      PHE  13  59.980   8.237  -4.833
   87    HD1  PHE  13           HD1      PHE  13  57.903   9.875  -7.503
   88    HD2  PHE  13           HD2      PHE  13  59.870   6.313  -6.128
   89    HE1  PHE  13           HE1      PHE  13  57.188   8.685  -9.560
   90    HE2  PHE  13           HE2      PHE  13  59.155   5.123  -8.185
   91    HZ   PHE  13           HZ       PHE  13  57.814   6.310  -9.900
   92    H    LEU  14           HN       LEU  14  58.483   8.109  -2.407
   93    HA   LEU  14           HA       LEU  14  56.785   5.791  -3.133
   94   1HB   LEU  14           HB2      LEU  14  58.394   6.202  -0.602
   95   2HB   LEU  14           HB1      LEU  14  57.776   4.680  -1.247
   96    HG   LEU  14           HG       LEU  14  59.740   6.424  -2.750
   97   1HD1  LEU  14          HD11      LEU  14  60.316   5.151  -0.383
   98   2HD1  LEU  14          HD13      LEU  14  60.707   3.904  -1.567
   99   3HD1  LEU  14          HD12      LEU  14  61.491   5.481  -1.654
  100   1HD2  LEU  14          HD22      LEU  14  58.401   3.798  -3.156
  101   2HD2  LEU  14          HD21      LEU  14  58.935   4.985  -4.348
  102   3HD2  LEU  14          HD23      LEU  14  60.102   3.885  -3.614
  103    H    SER  15           HN       SER  15  54.819   5.389  -2.172
  104    HA   SER  15           HA       SER  15  53.833   7.461  -0.264
  105   1HB   SER  15           HB2      SER  15  52.519   5.738  -2.333
  106   2HB   SER  15           HB1      SER  15  51.573   6.250  -0.939
  107    HG   SER  15           HG       SER  15  52.646   8.414  -1.564
  108    H    GLU  16           HN       GLU  16  52.142   6.500   1.333
  109    HA   GLU  16           HA       GLU  16  53.430   4.588   3.001
  110   1HB   GLU  16           HB2      GLU  16  50.491   5.340   2.896
  111   2HB   GLU  16           HB1      GLU  16  51.289   4.511   4.233
  112   1HG   GLU  16           HG2      GLU  16  52.922   6.549   4.198
  113   2HG   GLU  16           HG1      GLU  16  51.632   7.352   3.302
  114    H    GLU  17           HN       GLU  17  51.599   4.158   0.142
  115    HA   GLU  17           HA       GLU  17  50.484   1.558   0.706
  116   1HB   GLU  17           HB2      GLU  17  50.198   3.353  -1.329
  117   2HB   GLU  17           HB1      GLU  17  51.236   2.147  -2.091
  118   1HG   GLU  17           HG2      GLU  17  48.984   1.058  -0.507
  119   2HG   GLU  17           HG1      GLU  17  48.527   1.934  -1.968
  120    H    MET  18           HN       MET  18  53.143   2.301  -1.576
  121    HA   MET  18           HA       MET  18  54.155  -0.392  -1.500
  122   1HB   MET  18           HB2      MET  18  55.515   2.183  -2.356
  123   2HB   MET  18           HB1      MET  18  56.113   0.559  -2.694
  124   1HG   MET  18           HG2      MET  18  54.129   0.047  -4.004
  125   2HG   MET  18           HG1      MET  18  53.402   1.595  -3.570
  126   1HE   MET  18           HE1      MET  18  55.845  -0.431  -5.103
  127   2HE   MET  18           HE3      MET  18  55.661   0.148  -6.765
  128   3HE   MET  18           HE2      MET  18  57.085   0.590  -5.827
  129    H    ILE  19           HN       ILE  19  55.228   2.632   0.050
  130    HA   ILE  19           HA       ILE  19  57.519   1.666   1.363
  131    HB   ILE  19           HB       ILE  19  55.472   3.703   2.281
  132   1HG1  ILE  19          HG12      ILE  19  58.156   3.901   0.877
  133   2HG1  ILE  19          HG11      ILE  19  56.578   4.315   0.202
  134   1HG2  ILE  19          HG22      ILE  19  58.168   2.908   3.391
  135   2HG2  ILE  19          HG21      ILE  19  57.476   4.504   3.678
  136   3HG2  ILE  19          HG23      ILE  19  56.635   3.062   4.252
  137   1HD1  ILE  19          HD12      ILE  19  56.679   5.793   2.551
  138   2HD1  ILE  19          HD11      ILE  19  58.327   5.897   1.931
  139   3HD1  ILE  19          HD13      ILE  19  56.972   6.418   0.929
  140    H    ALA  20           HN       ALA  20  54.136   1.108   2.081
  141    HA   ALA  20           HA       ALA  20  54.507   0.168   4.784
  142   1HB   ALA  20           HB1      ALA  20  52.332  -0.300   2.728
  143   2HB   ALA  20           HB3      ALA  20  52.261  -0.954   4.366
  144   3HB   ALA  20           HB2      ALA  20  52.286   0.792   4.113
  145    H    GLU  21           HN       GLU  21  54.415  -1.415   1.615
  146    HA   GLU  21           HA       GLU  21  54.697  -4.092   2.650
  147   1HB   GLU  21           HB2      GLU  21  53.888  -4.121   0.481
  148   2HB   GLU  21           HB1      GLU  21  54.884  -2.759  -0.022
  149   1HG   GLU  21           HG2      GLU  21  55.687  -4.793  -1.101
  150   2HG   GLU  21           HG1      GLU  21  56.887  -4.237   0.065
  151    H    PHE  22           HN       PHE  22  56.978  -1.574   1.662
  152    HA   PHE  22           HA       PHE  22  59.336  -3.186   1.641
  153   1HB   PHE  22           HB2      PHE  22  58.838  -0.246   2.107
  154   2HB   PHE  22           HB1      PHE  22  60.462  -0.925   2.209
  155    HD1  PHE  22           HD1      PHE  22  60.530  -2.954   0.141
  156    HD2  PHE  22           HD2      PHE  22  58.673   0.920   0.080
  157    HE1  PHE  22           HE1      PHE  22  60.707  -2.908  -2.330
  158    HE2  PHE  22           HE2      PHE  22  58.852   0.965  -2.393
  159    HZ   PHE  22           HZ       PHE  22  59.868  -0.948  -3.599
  160    H    LYS  23           HN       LYS  23  57.496  -1.724   4.249
  161    HA   LYS  23           HA       LYS  23  59.448  -1.854   6.312
  162   1HB   LYS  23           HB2      LYS  23  56.654  -1.331   6.112
  163   2HB   LYS  23           HB1      LYS  23  56.876  -2.549   7.369
  164   1HG   LYS  23           HG2      LYS  23  58.403   0.066   7.203
  165   2HG   LYS  23           HG1      LYS  23  57.035  -0.237   8.273
  166   1HD   LYS  23           HD2      LYS  23  58.288  -2.110   9.319
  167   2HD   LYS  23           HD1      LYS  23  59.670  -1.738   8.285
  168   1HE   LYS  23           HE2      LYS  23  60.207   0.167   9.450
  169   2HE   LYS  23           HE1      LYS  23  58.526   0.521   9.850
  170   1HZ   LYS  23           HZ3      LYS  23  58.760  -1.635  11.261
  171   2HZ   LYS  23           HZ2      LYS  23  60.419  -1.275  11.194
  172   3HZ   LYS  23           HZ1      LYS  23  59.330  -0.156  11.864
  173    H    ALA  24           HN       ALA  24  57.504  -4.346   4.805
  174    HA   ALA  24           HA       ALA  24  57.904  -6.340   6.864
  175   1HB   ALA  24           HB1      ALA  24  56.210  -6.228   4.818
  176   2HB   ALA  24           HB3      ALA  24  57.501  -7.109   3.999
  177   3HB   ALA  24           HB2      ALA  24  56.761  -7.780   5.453
  178    H    ALA  25           HN       ALA  25  59.593  -5.522   3.843
  179    HA   ALA  25           HA       ALA  25  61.434  -7.720   3.917
  180   1HB   ALA  25           HB2      ALA  25  60.964  -6.116   1.968
  181   2HB   ALA  25           HB1      ALA  25  62.048  -4.988   2.780
  182   3HB   ALA  25           HB3      ALA  25  62.652  -6.552   2.235
  183    H    PHE  26           HN       PHE  26  61.668  -4.380   5.147
  184    HA   PHE  26           HA       PHE  26  64.313  -4.443   6.094
  185   1HB   PHE  26           HB2      PHE  26  62.711  -2.471   6.096
  186   2HB   PHE  26           HB1      PHE  26  62.003  -3.150   7.562
  187    HD1  PHE  26           HD1      PHE  26  65.460  -2.582   6.208
  188    HD2  PHE  26           HD2      PHE  26  62.774  -2.211   9.537
  189    HE1  PHE  26           HE1      PHE  26  67.274  -1.558   7.555
  190    HE2  PHE  26           HE2      PHE  26  64.587  -1.187  10.887
  191    HZ   PHE  26           HZ       PHE  26  66.837  -0.860   9.895
  192    H    ASP  27           HN       ASP  27  61.422  -5.036   8.127
  193    HA   ASP  27           HA       ASP  27  62.818  -6.057  10.358
  194   1HB   ASP  27           HB2      ASP  27  60.693  -7.003  11.069
  195   2HB   ASP  27           HB1      ASP  27  60.400  -5.426  10.332
  196    H    MET  28           HN       MET  28  62.380  -7.498   7.280
  197    HA   MET  28           HA       MET  28  62.481 -10.263   8.183
  198   1HB   MET  28           HB2      MET  28  62.190  -8.847   5.671
  199   2HB   MET  28           HB1      MET  28  63.352 -10.165   5.518
  200   1HG   MET  28           HG2      MET  28  61.776 -11.785   5.924
  201   2HG   MET  28           HG1      MET  28  60.847 -10.756   7.015
  202   1HE   MET  28           HE2      MET  28  61.973 -11.376   3.392
  203   2HE   MET  28           HE1      MET  28  60.961 -10.294   2.440
  204   3HE   MET  28           HE3      MET  28  62.183  -9.633   3.536
  205    H    PHE  29           HN       PHE  29  64.880  -7.859   7.181
  206    HA   PHE  29           HA       PHE  29  66.994  -9.945   7.386
  207   1HB   PHE  29           HB2      PHE  29  67.058  -7.107   6.331
  208   2HB   PHE  29           HB1      PHE  29  68.479  -8.143   6.449
  209    HD1  PHE  29           HD2      PHE  29  65.024  -8.039   5.020
  210    HD2  PHE  29           HD1      PHE  29  68.990  -9.653   4.718
  211    HE1  PHE  29           HE2      PHE  29  64.427  -9.097   2.859
  212    HE2  PHE  29           HE1      PHE  29  68.395 -10.714   2.557
  213    HZ   PHE  29           HZ       PHE  29  66.113 -10.435   1.627
  214    H    ASP  30           HN       ASP  30  65.461  -8.174   9.574
  215    HA   ASP  30           HA       ASP  30  67.984  -7.504  11.040
  216   1HB   ASP  30           HB2      ASP  30  66.819  -5.701  12.151
  217   2HB   ASP  30           HB1      ASP  30  66.568  -5.518  10.415
  218    H    ALA  31           HN       ALA  31  67.612  -9.946  11.544
  219    HA   ALA  31           HA       ALA  31  65.467 -10.690  13.315
  220   1HB   ALA  31           HB1      ALA  31  68.213 -11.931  12.963
  221   2HB   ALA  31           HB3      ALA  31  66.848 -12.688  13.783
  222   3HB   ALA  31           HB2      ALA  31  66.765 -12.361  12.052
  223    H    ASP  32           HN       ASP  32  68.110  -8.667  13.800
  224    HA   ASP  32           HA       ASP  32  68.749  -9.374  16.539
  225   1HB   ASP  32           HB2      ASP  32  69.980  -7.277  16.583
  226   2HB   ASP  32           HB1      ASP  32  70.269  -8.068  15.033
  227    H    GLY  33           HN       GLY  33  65.969  -8.120  15.212
  228   1HA   GLY  33           HA2      GLY  33  64.144  -6.946  16.110
  229   2HA   GLY  33           HA1      GLY  33  64.688  -7.586  17.661
  230    H    GLY  34           HN       GLY  34  66.900  -5.614  15.869
  231   1HA   GLY  34           HA2      GLY  34  66.609  -3.506  17.947
  232   2HA   GLY  34           HA1      GLY  34  68.024  -3.736  16.918
  233    H    GLY  35           HN       GLY  35  66.360  -4.060  14.486
  234   1HA   GLY  35           HA2      GLY  35  64.825  -2.646  13.184
  235   2HA   GLY  35           HA1      GLY  35  65.278  -1.289  14.215
  236    H    ASP  36           HN       ASP  36  67.524  -3.622  12.786
  237    HA   ASP  36           HA       ASP  36  68.348  -1.723  10.704
  238   1HB   ASP  36           HB2      ASP  36  70.750  -1.761  11.584
  239   2HB   ASP  36           HB1      ASP  36  69.613  -0.760  12.488
  240    H    ILE  37           HN       ILE  37  69.600  -2.746   9.093
  241    HA   ILE  37           HA       ILE  37  70.086  -5.666   9.519
  242    HB   ILE  37           HB       ILE  37  68.345  -5.802   8.010
  243   1HG1  ILE  37          HG12      ILE  37  70.733  -5.222   6.229
  244   2HG1  ILE  37          HG11      ILE  37  70.203  -6.802   6.810
  245   1HG2  ILE  37          HG21      ILE  37  69.267  -3.123   6.949
  246   2HG2  ILE  37          HG23      ILE  37  67.937  -4.046   6.247
  247   3HG2  ILE  37          HG22      ILE  37  67.824  -3.457   7.905
  248   1HD1  ILE  37          HD11      ILE  37  67.947  -5.640   5.576
  249   2HD1  ILE  37          HD13      ILE  37  69.304  -5.325   4.494
  250   3HD1  ILE  37          HD12      ILE  37  68.921  -6.980   4.969
  251    H    SER  38           HN       SER  38  71.727  -6.493   7.845
  252    HA   SER  38           HA       SER  38  74.061  -4.712   7.949
  253   1HB   SER  38           HB2      SER  38  74.234  -7.263   6.450
  254   2HB   SER  38           HB1      SER  38  75.310  -6.607   7.680
  255    HG   SER  38           HG       SER  38  74.111  -8.454   8.387
  256    H    THR  39           HN       THR  39  75.098  -3.822   6.133
  257    HA   THR  39           HA       THR  39  73.428  -3.228   3.862
  258    HB   THR  39           HB       THR  39  75.670  -2.356   2.912
  259    HG1  THR  39           HG1      THR  39  76.897  -3.751   4.330
  260   1HG2  THR  39          HG22      THR  39  74.523  -1.398   5.544
  261   2HG2  THR  39          HG21      THR  39  75.691  -0.475   4.599
  262   3HG2  THR  39          HG23      THR  39  74.101  -0.838   3.925
  263    H    LYS  40           HN       LYS  40  75.700  -5.764   4.579
  264    HA   LYS  40           HA       LYS  40  76.130  -6.553   1.809
  265   1HB   LYS  40           HB2      LYS  40  77.302  -8.437   2.710
  266   2HB   LYS  40           HB1      LYS  40  77.672  -7.078   3.773
  267   1HG   LYS  40           HG2      LYS  40  75.924  -7.812   5.342
  268   2HG   LYS  40           HG1      LYS  40  75.527  -9.162   4.279
  269   1HD   LYS  40           HD2      LYS  40  78.271  -8.718   5.486
  270   2HD   LYS  40           HD1      LYS  40  77.053  -9.788   6.179
  271   1HE   LYS  40           HE2      LYS  40  76.995 -11.074   4.063
  272   2HE   LYS  40           HE1      LYS  40  78.248 -10.023   3.401
  273   1HZ   LYS  40           HZ3      LYS  40  78.549 -11.641   5.872
  274   2HZ   LYS  40           HZ2      LYS  40  79.113 -12.115   4.342
  275   3HZ   LYS  40           HZ1      LYS  40  79.756 -10.736   5.097
  276    H    ALA  41           HN       ALA  41  73.512  -6.813   3.926
  277    HA   ALA  41           HA       ALA  41  72.538  -9.377   2.840
  278   1HB   ALA  41           HB1      ALA  41  71.959  -7.718   5.144
  279   2HB   ALA  41           HB3      ALA  41  70.474  -8.114   4.279
  280   3HB   ALA  41           HB2      ALA  41  71.530  -9.403   4.857
  281    H    LEU  42           HN       LEU  42  72.370  -6.044   2.072
  282    HA   LEU  42           HA       LEU  42  69.772  -5.834   0.943
  283   1HB   LEU  42           HB2      LEU  42  72.404  -4.493   0.365
  284   2HB   LEU  42           HB1      LEU  42  71.007  -4.172  -0.655
  285    HG   LEU  42           HG       LEU  42  70.120  -2.778   0.885
  286   1HD1  LEU  42          HD11      LEU  42  70.689  -4.967   2.905
  287   2HD1  LEU  42          HD13      LEU  42  69.893  -3.449   3.320
  288   3HD1  LEU  42          HD12      LEU  42  69.135  -4.560   2.179
  289   1HD2  LEU  42          HD23      LEU  42  72.840  -3.334   2.007
  290   2HD2  LEU  42          HD22      LEU  42  72.218  -1.859   1.267
  291   3HD2  LEU  42          HD21      LEU  42  71.734  -2.297   2.906
  292    H    GLY  43           HN       GLY  43  72.841  -6.885  -0.570
  293   1HA   GLY  43           HA2      GLY  43  71.966  -7.316  -3.182
  294   2HA   GLY  43           HA1      GLY  43  73.132  -8.373  -2.379
  295    H    THR  44           HN       THR  44  71.382  -9.276  -0.301
  296    HA   THR  44           HA       THR  44  69.994 -11.391  -1.739
  297    HB   THR  44           HB       THR  44  70.226 -10.646   1.184
  298    HG1  THR  44           HG1      THR  44  72.017 -11.649   0.492
  299   1HG2  THR  44          HG21      THR  44  68.717 -12.968  -0.050
  300   2HG2  THR  44          HG23      THR  44  69.045 -12.769   1.671
  301   3HG2  THR  44          HG22      THR  44  68.002 -11.620   0.835
  302    H    VAL  45           HN       VAL  45  69.044  -8.442  -0.006
  303    HA   VAL  45           HA       VAL  45  66.217  -8.982  -0.047
  304    HB   VAL  45           HB       VAL  45  67.531  -6.254  -0.076
  305   1HG1  VAL  45          HG11      VAL  45  64.889  -6.908  -0.179
  306   2HG1  VAL  45          HG13      VAL  45  65.143  -6.869   1.566
  307   3HG1  VAL  45          HG12      VAL  45  65.502  -5.444   0.592
  308   1HG2  VAL  45          HG22      VAL  45  68.110  -8.270   1.721
  309   2HG2  VAL  45          HG21      VAL  45  68.244  -6.544   2.061
  310   3HG2  VAL  45          HG23      VAL  45  66.785  -7.423   2.519
  311    H    MET  46           HN       MET  46  68.442  -7.981  -2.490
  312    HA   MET  46           HA       MET  46  66.671  -6.526  -4.195
  313   1HB   MET  46           HB2      MET  46  69.012  -8.304  -4.952
  314   2HB   MET  46           HB1      MET  46  68.258  -7.098  -5.997
  315   1HG   MET  46           HG2      MET  46  69.634  -6.542  -3.350
  316   2HG   MET  46           HG1      MET  46  70.280  -6.172  -4.950
  317   1HE   MET  46           HE2      MET  46  70.457  -3.997  -3.190
  318   2HE   MET  46           HE1      MET  46  70.556  -3.621  -4.908
  319   3HE   MET  46           HE3      MET  46  69.566  -2.621  -3.837
  320    H    ARG  47           HN       ARG  47  67.814  -9.850  -4.858
  321    HA   ARG  47           HA       ARG  47  65.844 -10.588  -6.675
  322   1HB   ARG  47           HB2      ARG  47  67.652 -12.005  -4.858
  323   2HB   ARG  47           HB1      ARG  47  66.166 -12.902  -5.173
  324   1HG   ARG  47           HG2      ARG  47  67.351 -11.647  -7.563
  325   2HG   ARG  47           HG1      ARG  47  68.352 -12.899  -6.830
  326   1HD   ARG  47           HD2      ARG  47  65.426 -13.425  -7.215
  327   2HD   ARG  47           HD1      ARG  47  66.505 -13.550  -8.604
  328    HE   ARG  47           HE       ARG  47  66.283 -15.506  -6.548
  329   1HH1  ARG  47          HH11      ARG  47  67.887 -15.168  -9.310
  330   2HH1  ARG  47          HH12      ARG  47  69.429 -15.747  -8.774
  331   1HH2  ARG  47          HH21      ARG  47  68.599 -15.630  -5.410
  332   2HH2  ARG  47          HH22      ARG  47  69.832 -16.008  -6.565
  333    H    MET  48           HN       MET  48  65.580 -10.376  -3.168
  334    HA   MET  48           HA       MET  48  63.105 -11.760  -2.859
  335   1HB   MET  48           HB2      MET  48  64.322  -9.471  -1.289
  336   2HB   MET  48           HB1      MET  48  62.863 -10.331  -0.789
  337   1HG   MET  48           HG2      MET  48  65.241 -11.986  -1.490
  338   2HG   MET  48           HG1      MET  48  65.304 -11.089   0.027
  339   1HE   MET  48           HE2      MET  48  65.644 -13.233   1.168
  340   2HE   MET  48           HE1      MET  48  64.574 -12.263   2.179
  341   3HE   MET  48           HE3      MET  48  64.278 -13.996   1.979
  342    H    LEU  49           HN       LEU  49  63.353  -8.221  -2.499
  343    HA   LEU  49           HA       LEU  49  60.707  -7.576  -2.978
  344   1HB   LEU  49           HB2      LEU  49  62.970  -5.961  -4.176
  345   2HB   LEU  49           HB1      LEU  49  61.420  -5.372  -3.576
  346    HG   LEU  49           HG       LEU  49  63.730  -6.475  -1.966
  347   1HD1  LEU  49          HD12      LEU  49  62.406  -3.836  -2.374
  348   2HD1  LEU  49          HD11      LEU  49  62.967  -4.210  -0.744
  349   3HD1  LEU  49          HD13      LEU  49  64.106  -4.209  -2.091
  350   1HD2  LEU  49          HD22      LEU  49  60.900  -5.867  -1.050
  351   2HD2  LEU  49          HD21      LEU  49  61.626  -7.472  -1.142
  352   3HD2  LEU  49          HD23      LEU  49  62.250  -6.286   0.006
  353    H    GLY  50           HN       GLY  50  63.105  -7.191  -5.604
  354   1HA   GLY  50           HA2      GLY  50  61.966  -8.872  -7.522
  355   2HA   GLY  50           HA1      GLY  50  61.060  -7.363  -7.640
  356    H    GLN  51           HN       GLN  51  62.923  -5.429  -7.273
  357    HA   GLN  51           HA       GLN  51  64.205  -5.165  -9.753
  358   1HB   GLN  51           HB2      GLN  51  65.644  -3.453  -8.626
  359   2HB   GLN  51           HB1      GLN  51  63.930  -3.259  -8.257
  360   1HG   GLN  51           HG2      GLN  51  64.248  -4.480  -6.133
  361   2HG   GLN  51           HG1      GLN  51  65.964  -4.664  -6.497
  362   1HE2  GLN  51          HE21      GLN  51  63.826  -1.797  -6.933
  363   2HE2  GLN  51          HE22      GLN  51  64.757  -0.769  -5.955
  364    H    ASN  52           HN       ASN  52  66.392  -5.499 -10.433
  365    HA   ASN  52           HA       ASN  52  68.154  -7.061  -8.637
  366   1HB   ASN  52           HB2      ASN  52  67.706  -8.098 -11.423
  367   2HB   ASN  52           HB1      ASN  52  68.306  -8.954 -10.002
  368   1HD2  ASN  52          HD22      ASN  52  65.075  -9.818  -8.823
  369   2HD2  ASN  52          HD21      ASN  52  66.739  -9.797  -8.483
  370    HA   PRO  53           HA       PRO  53  70.441  -4.030 -11.193
  371   1HB   PRO  53           HB2      PRO  53  71.935  -3.085  -9.087
  372   2HB   PRO  53           HB1      PRO  53  70.342  -2.443  -9.522
  373   1HG   PRO  53           HG2      PRO  53  71.091  -4.214  -7.243
  374   2HG   PRO  53           HG1      PRO  53  69.745  -3.071  -7.381
  375   1HD   PRO  53           HD2      PRO  53  69.567  -5.882  -7.659
  376   2HD   PRO  53           HD1      PRO  53  68.317  -4.705  -8.118
  377    H    THR  54           HN       THR  54  72.883  -3.903 -11.475
  378    HA   THR  54           HA       THR  54  74.026  -6.571 -11.441
  379    HB   THR  54           HB       THR  54  76.103  -5.304 -12.251
  380    HG1  THR  54           HG1      THR  54  76.029  -3.233 -12.063
  381   1HG2  THR  54          HG22      THR  54  73.432  -5.090 -13.654
  382   2HG2  THR  54          HG21      THR  54  74.960  -4.679 -14.435
  383   3HG2  THR  54          HG23      THR  54  74.672  -6.326 -13.875
  384    H    LYS  55           HN       LYS  55  75.456  -7.431  -9.965
  385    HA   LYS  55           HA       LYS  55  75.645  -6.539  -7.339
  386   1HB   LYS  55           HB2      LYS  55  77.174  -8.392  -9.034
  387   2HB   LYS  55           HB1      LYS  55  78.116  -7.712  -7.707
  388   1HG   LYS  55           HG2      LYS  55  75.349  -8.729  -7.152
  389   2HG   LYS  55           HG1      LYS  55  76.672  -9.885  -7.313
  390   1HD   LYS  55           HD2      LYS  55  77.534  -9.324  -5.303
  391   2HD   LYS  55           HD1      LYS  55  77.400  -7.599  -5.645
  392   1HE   LYS  55           HE2      LYS  55  75.806  -7.661  -4.013
  393   2HE   LYS  55           HE1      LYS  55  74.776  -8.238  -5.324
  394   1HZ   LYS  55           HZ3      LYS  55  76.401 -10.121  -3.738
  395   2HZ   LYS  55           HZ2      LYS  55  74.885  -9.596  -3.176
  396   3HZ   LYS  55           HZ1      LYS  55  75.007 -10.428  -4.653
  397    H    GLU  56           HN       GLU  56  77.519  -5.482 -10.122
  398    HA   GLU  56           HA       GLU  56  79.579  -4.091  -8.709
  399   1HB   GLU  56           HB2      GLU  56  79.607  -4.586 -11.165
  400   2HB   GLU  56           HB1      GLU  56  78.360  -3.357 -11.388
  401   1HG   GLU  56           HG2      GLU  56  79.861  -1.678 -11.250
  402   2HG   GLU  56           HG1      GLU  56  80.596  -2.362  -9.799
  403    H    GLU  57           HN       GLU  57  76.862  -2.535 -10.444
  404    HA   GLU  57           HA       GLU  57  77.038  -0.034  -9.202
  405   1HB   GLU  57           HB2      GLU  57  75.006  -1.510 -10.695
  406   2HB   GLU  57           HB1      GLU  57  74.297  -0.425  -9.498
  407   1HG   GLU  57           HG2      GLU  57  75.412   1.476 -10.416
  408   2HG   GLU  57           HG1      GLU  57  76.466   0.465 -11.408
  409    H    LEU  58           HN       LEU  58  75.879  -3.037  -7.884
  410    HA   LEU  58           HA       LEU  58  74.275  -1.982  -5.754
  411   1HB   LEU  58           HB2      LEU  58  74.163  -4.343  -6.330
  412   2HB   LEU  58           HB1      LEU  58  75.871  -4.553  -5.946
  413    HG   LEU  58           HG       LEU  58  74.319  -3.345  -3.761
  414   1HD1  LEU  58          HD12      LEU  58  72.980  -5.339  -5.129
  415   2HD1  LEU  58          HD11      LEU  58  73.826  -6.238  -3.871
  416   3HD1  LEU  58          HD13      LEU  58  72.730  -4.928  -3.433
  417   1HD2  LEU  58          HD23      LEU  58  76.655  -4.934  -4.195
  418   2HD2  LEU  58          HD22      LEU  58  76.101  -4.210  -2.685
  419   3HD2  LEU  58          HD21      LEU  58  75.583  -5.838  -3.126
  420    H    ASP  59           HN       ASP  59  77.711  -2.982  -5.832
  421    HA   ASP  59           HA       ASP  59  78.350  -2.342  -3.157
  422   1HB   ASP  59           HB2      ASP  59  79.771  -3.036  -5.519
  423   2HB   ASP  59           HB1      ASP  59  80.534  -1.586  -4.864
  424    H    ALA  60           HN       ALA  60  78.441  -0.256  -6.054
  425    HA   ALA  60           HA       ALA  60  79.344   2.092  -4.674
  426   1HB   ALA  60           HB3      ALA  60  78.503   1.390  -7.333
  427   2HB   ALA  60           HB2      ALA  60  77.677   2.869  -6.842
  428   3HB   ALA  60           HB1      ALA  60  79.439   2.793  -6.812
  429    H    ILE  61           HN       ILE  61  76.206   0.593  -5.040
  430    HA   ILE  61           HA       ILE  61  74.665   2.913  -4.235
  431    HB   ILE  61           HB       ILE  61  74.067  -0.050  -4.377
  432   1HG1  ILE  61          HG12      ILE  61  72.647   2.140  -5.859
  433   2HG1  ILE  61          HG11      ILE  61  74.259   1.661  -6.393
  434   1HG2  ILE  61          HG22      ILE  61  72.549   2.153  -3.076
  435   2HG2  ILE  61          HG21      ILE  61  71.622   1.071  -4.113
  436   3HG2  ILE  61          HG23      ILE  61  72.524   0.421  -2.746
  437   1HD1  ILE  61          HD13      ILE  61  72.696  -0.697  -5.852
  438   2HD1  ILE  61          HD12      ILE  61  71.803   0.358  -6.948
  439   3HD1  ILE  61          HD11      ILE  61  73.426  -0.184  -7.374
  440    H    ILE  62           HN       ILE  62  76.335   0.328  -2.546
  441    HA   ILE  62           HA       ILE  62  75.065   0.520  -0.015
  442    HB   ILE  62           HB       ILE  62  78.013   0.027  -0.525
  443   1HG1  ILE  62          HG12      ILE  62  75.614  -1.824  -0.619
  444   2HG1  ILE  62          HG11      ILE  62  76.752  -1.484  -1.924
  445   1HG2  ILE  62          HG21      ILE  62  77.298   0.421   1.846
  446   2HG2  ILE  62          HG23      ILE  62  76.188  -0.942   1.693
  447   3HG2  ILE  62          HG22      ILE  62  77.927  -1.204   1.570
  448   1HD1  ILE  62          HD12      ILE  62  78.537  -2.351  -0.185
  449   2HD1  ILE  62          HD11      ILE  62  77.142  -3.145   0.544
  450   3HD1  ILE  62          HD13      ILE  62  77.588  -3.504  -1.125
  451    H    GLU  63           HN       GLU  63  78.000   2.220  -1.173
  452    HA   GLU  63           HA       GLU  63  78.204   3.907   1.146
  453   1HB   GLU  63           HB2      GLU  63  79.716   3.449  -1.175
  454   2HB   GLU  63           HB1      GLU  63  79.247   5.148  -1.264
  455   1HG   GLU  63           HG2      GLU  63  79.933   4.974   1.360
  456   2HG   GLU  63           HG1      GLU  63  81.031   3.779   0.666
  457    H    GLU  64           HN       GLU  64  75.998   3.892  -1.437
  458    HA   GLU  64           HA       GLU  64  75.481   6.804  -1.288
  459   1HB   GLU  64           HB2      GLU  64  74.172   4.607  -2.919
  460   2HB   GLU  64           HB1      GLU  64  73.770   6.322  -3.035
  461   1HG   GLU  64           HG2      GLU  64  76.650   5.645  -3.268
  462   2HG   GLU  64           HG1      GLU  64  75.626   5.136  -4.611
  463    H    VAL  65           HN       VAL  65  74.304   3.822   0.029
  464    HA   VAL  65           HA       VAL  65  71.740   5.041   0.865
  465    HB   VAL  65           HB       VAL  65  72.793   2.318   1.651
  466   1HG1  VAL  65          HG13      VAL  65  70.158   3.740   1.632
  467   2HG1  VAL  65          HG12      VAL  65  70.171   1.994   1.384
  468   3HG1  VAL  65          HG11      VAL  65  70.848   2.680   2.862
  469   1HG2  VAL  65          HG21      VAL  65  72.083   3.308  -0.989
  470   2HG2  VAL  65          HG23      VAL  65  72.740   1.738  -0.530
  471   3HG2  VAL  65          HG22      VAL  65  70.999   2.012  -0.482
  472    H    ASP  66           HN       ASP  66  74.841   4.030   2.221
  473    HA   ASP  66           HA       ASP  66  74.000   4.607   4.969
  474   1HB   ASP  66           HB2      ASP  66  76.340   3.446   3.632
  475   2HB   ASP  66           HB1      ASP  66  76.765   4.496   4.983
  476    H    GLU  67           HN       GLU  67  73.311   6.867   4.436
  477    HA   GLU  67           HA       GLU  67  75.146   8.864   3.548
  478   1HB   GLU  67           HB2      GLU  67  73.557  10.443   4.788
  479   2HB   GLU  67           HB1      GLU  67  72.824   9.420   3.552
  480   1HG   GLU  67           HG2      GLU  67  71.407   8.650   5.123
  481   2HG   GLU  67           HG1      GLU  67  72.785   7.891   5.919
  482    H    ASP  68           HN       ASP  68  74.421   7.595   6.780
  483    HA   ASP  68           HA       ASP  68  76.403   9.448   7.971
  484   1HB   ASP  68           HB2      ASP  68  75.673   8.210  10.115
  485   2HB   ASP  68           HB1      ASP  68  74.469   9.233   9.328
  486    H    GLY  69           HN       GLY  69  76.564   6.589   6.362
  487   1HA   GLY  69           HA2      GLY  69  78.035   4.745   6.427
  488   2HA   GLY  69           HA1      GLY  69  79.208   5.970   6.914
  489    H    SER  70           HN       SER  70  76.350   4.937   8.745
  490    HA   SER  70           HA       SER  70  77.948   4.596  11.145
  491   1HB   SER  70           HB2      SER  70  75.757   3.692  12.072
  492   2HB   SER  70           HB1      SER  70  75.686   5.331  11.434
  493    HG   SER  70           HG       SER  70  75.217   3.259   9.642
  494    H    GLY  71           HN       GLY  71  77.488   2.644   8.460
  495   1HA   GLY  71           HA2      GLY  71  78.402   0.470   8.143
  496   2HA   GLY  71           HA1      GLY  71  78.604   0.328   9.890
  497    H    THR  72           HN       THR  72  75.517   1.456   9.236
  498    HA   THR  72           HA       THR  72  74.358  -1.266   8.951
  499    HB   THR  72           HB       THR  72  72.701  -0.202  10.846
  500    HG1  THR  72           HG1      THR  72  73.902   0.847  12.337
  501   1HG2  THR  72          HG23      THR  72  73.920  -2.469  10.670
  502   2HG2  THR  72          HG22      THR  72  75.198  -1.708  11.619
  503   3HG2  THR  72          HG21      THR  72  73.573  -1.861  12.288
  504    H    ILE  73           HN       ILE  73  72.116  -1.201   8.241
  505    HA   ILE  73           HA       ILE  73  71.417   1.414   6.972
  506    HB   ILE  73           HB       ILE  73  70.768  -1.442   6.208
  507   1HG1  ILE  73          HG12      ILE  73  72.985  -0.335   5.569
  508   2HG1  ILE  73          HG11      ILE  73  72.021  -0.953   4.228
  509   1HG2  ILE  73          HG22      ILE  73  69.331   1.066   5.644
  510   2HG2  ILE  73          HG21      ILE  73  69.763   0.150   4.200
  511   3HG2  ILE  73          HG23      ILE  73  68.793  -0.604   5.465
  512   1HD1  ILE  73          HD11      ILE  73  71.295   1.788   4.915
  513   2HD1  ILE  73          HD13      ILE  73  72.998   1.645   4.480
  514   3HD1  ILE  73          HD12      ILE  73  71.753   1.112   3.351
  515    H    ASP  74           HN       ASP  74  69.260   2.171   7.164
  516    HA   ASP  74           HA       ASP  74  67.591   0.727   9.186
  517   1HB   ASP  74           HB2      ASP  74  68.261   3.654   8.933
  518   2HB   ASP  74           HB1      ASP  74  66.759   3.146   9.706
  519    H    PHE  75           HN       PHE  75  65.242   1.136   8.921
  520    HA   PHE  75           HA       PHE  75  64.216   0.664   6.406
  521   1HB   PHE  75           HB2      PHE  75  62.972   0.787   8.654
  522   2HB   PHE  75           HB1      PHE  75  62.787   2.509   8.323
  523    HD1  PHE  75           HD2      PHE  75  62.670  -0.522   6.121
  524    HD2  PHE  75           HD1      PHE  75  60.602   2.930   7.617
  525    HE1  PHE  75           HE2      PHE  75  60.758  -1.016   4.618
  526    HE2  PHE  75           HE1      PHE  75  58.688   2.438   6.117
  527    HZ   PHE  75           HZ       PHE  75  58.767   0.463   4.617
  528    H    GLU  76           HN       GLU  76  64.811   3.879   7.835
  529    HA   GLU  76           HA       GLU  76  63.792   5.438   5.698
  530   1HB   GLU  76           HB2      GLU  76  66.153   6.033   7.511
  531   2HB   GLU  76           HB1      GLU  76  65.288   7.222   6.536
  532   1HG   GLU  76           HG2      GLU  76  63.187   6.161   7.820
  533   2HG   GLU  76           HG1      GLU  76  64.430   5.830   9.028
  534    H    GLU  77           HN       GLU  77  67.108   4.202   6.217
  535    HA   GLU  77           HA       GLU  77  68.102   5.263   3.719
  536   1HB   GLU  77           HB2      GLU  77  69.211   2.943   5.325
  537   2HB   GLU  77           HB1      GLU  77  70.087   3.947   4.168
  538   1HG   GLU  77           HG2      GLU  77  69.719   5.923   5.601
  539   2HG   GLU  77           HG1      GLU  77  68.849   4.919   6.761
  540    H    PHE  78           HN       PHE  78  66.164   2.550   4.510
  541    HA   PHE  78           HA       PHE  78  66.975   0.771   2.396
  542   1HB   PHE  78           HB2      PHE  78  65.167   0.666   4.510
  543   2HB   PHE  78           HB1      PHE  78  64.134   0.641   3.080
  544    HD1  PHE  78           HD1      PHE  78  66.888  -1.077   4.853
  545    HD2  PHE  78           HD2      PHE  78  64.176  -1.210   1.526
  546    HE1  PHE  78           HE1      PHE  78  67.487  -3.452   4.463
  547    HE2  PHE  78           HE2      PHE  78  64.772  -3.586   1.135
  548    HZ   PHE  78           HZ       PHE  78  66.428  -4.706   2.605
  549    H    LEU  79           HN       LEU  79  64.046   2.824   2.626
  550    HA   LEU  79           HA       LEU  79  63.100   2.602   0.037
  551   1HB   LEU  79           HB2      LEU  79  63.312   5.199   1.597
  552   2HB   LEU  79           HB1      LEU  79  62.188   4.869   0.276
  553    HG   LEU  79           HG       LEU  79  62.286   3.383   2.918
  554   1HD1  LEU  79          HD13      LEU  79  61.192   5.876   2.355
  555   2HD1  LEU  79          HD12      LEU  79  59.825   4.776   2.175
  556   3HD1  LEU  79          HD11      LEU  79  60.725   4.823   3.691
  557   1HD2  LEU  79          HD22      LEU  79  61.120   2.768   0.325
  558   2HD2  LEU  79          HD21      LEU  79  61.210   1.762   1.771
  559   3HD2  LEU  79          HD23      LEU  79  59.875   2.897   1.568
  560    H    VAL  80           HN       VAL  80  66.015   4.216   1.099
  561    HA   VAL  80           HA       VAL  80  66.456   5.811  -1.250
  562    HB   VAL  80           HB       VAL  80  68.487   4.604   0.655
  563   1HG1  VAL  80          HG12      VAL  80  68.627   6.570  -1.598
  564   2HG1  VAL  80          HG11      VAL  80  69.648   6.846  -0.188
  565   3HG1  VAL  80          HG13      VAL  80  69.797   5.347  -1.106
  566   1HG2  VAL  80          HG22      VAL  80  66.727   7.030   0.735
  567   2HG2  VAL  80          HG21      VAL  80  67.209   5.954   2.047
  568   3HG2  VAL  80          HG23      VAL  80  68.349   7.145   1.419
  569    H    MET  81           HN       MET  81  67.722   2.588  -0.322
  570    HA   MET  81           HA       MET  81  69.195   2.082  -2.670
  571   1HB   MET  81           HB2      MET  81  69.282   0.636  -0.675
  572   2HB   MET  81           HB1      MET  81  67.626   0.112  -0.979
  573   1HG   MET  81           HG2      MET  81  68.215  -1.148  -2.825
  574   2HG   MET  81           HG1      MET  81  69.621  -0.151  -3.186
  575   1HE   MET  81           HE2      MET  81  71.197   0.350  -1.412
  576   2HE   MET  81           HE1      MET  81  71.095  -0.393   0.183
  577   3HE   MET  81           HE3      MET  81  72.298  -0.957  -0.985
  578    H    MET  82           HN       MET  82  65.737   1.715  -2.021
  579    HA   MET  82           HA       MET  82  65.057   0.311  -4.418
  580   1HB   MET  82           HB2      MET  82  63.633   1.840  -2.325
  581   2HB   MET  82           HB1      MET  82  62.827   1.801  -3.896
  582   1HG   MET  82           HG2      MET  82  62.007  -0.151  -2.964
  583   2HG   MET  82           HG1      MET  82  63.443  -0.767  -3.780
  584   1HE   MET  82           HE3      MET  82  65.621  -0.690  -2.902
  585   2HE   MET  82           HE2      MET  82  66.103  -1.107  -1.259
  586   3HE   MET  82           HE1      MET  82  65.291  -2.306  -2.261
  587    H    VAL  83           HN       VAL  83  64.241   3.715  -3.759
  588    HA   VAL  83           HA       VAL  83  63.809   4.471  -6.433
  589    HB   VAL  83           HB       VAL  83  65.029   6.305  -4.361
  590   1HG1  VAL  83          HG11      VAL  83  64.703   7.206  -6.639
  591   2HG1  VAL  83          HG13      VAL  83  63.007   6.731  -6.581
  592   3HG1  VAL  83          HG12      VAL  83  63.609   7.977  -5.489
  593   1HG2  VAL  83          HG22      VAL  83  62.662   4.721  -4.121
  594   2HG2  VAL  83          HG21      VAL  83  63.244   5.976  -3.026
  595   3HG2  VAL  83          HG23      VAL  83  62.169   6.397  -4.359
  596    H    ARG  84           HN       ARG  84  66.796   3.774  -4.853
  597    HA   ARG  84           HA       ARG  84  68.537   5.388  -6.476
  598   1HB   ARG  84           HB2      ARG  84  68.822   3.531  -4.359
  599   2HB   ARG  84           HB1      ARG  84  69.785   2.905  -5.698
  600   1HG   ARG  84           HG2      ARG  84  71.377   4.374  -5.054
  601   2HG   ARG  84           HG1      ARG  84  70.335   5.627  -5.732
  602   1HD   ARG  84           HD2      ARG  84  69.135   5.544  -3.418
  603   2HD   ARG  84           HD1      ARG  84  70.611   4.755  -2.865
  604    HE   ARG  84           HE       ARG  84  71.402   6.973  -2.726
  605   1HH1  ARG  84          HH21      ARG  84  72.180   6.784  -5.607
  606   2HH1  ARG  84          HH22      ARG  84  71.408   8.176  -6.287
  607   1HH2  ARG  84          HH11      ARG  84  69.277   8.641  -3.593
  608   2HH2  ARG  84          HH12      ARG  84  69.764   9.227  -5.148
  609    H    GLN  85           HN       GLN  85  67.306   2.068  -6.803
  610    HA   GLN  85           HA       GLN  85  68.788   1.590  -9.265
  611   1HB   GLN  85           HB2      GLN  85  67.313   0.028  -7.417
  612   2HB   GLN  85           HB1      GLN  85  66.514  -0.151  -8.978
  613   1HG   GLN  85           HG2      GLN  85  69.507  -0.426  -8.630
  614   2HG   GLN  85           HG1      GLN  85  68.402  -1.798  -8.533
  615   1HE2  GLN  85          HE22      GLN  85  69.552  -0.537 -12.142
  616   2HE2  GLN  85          HE21      GLN  85  70.331  -0.101 -10.697
  617    H    MET  86           HN       MET  86  65.297   2.029  -8.540
  618    HA   MET  86           HA       MET  86  64.360   2.050 -11.183
  619   1HB   MET  86           HB2      MET  86  62.396   3.039 -10.362
  620   2HB   MET  86           HB1      MET  86  63.060   2.262  -8.927
  621   1HG   MET  86           HG2      MET  86  62.632   4.373  -8.074
  622   2HG   MET  86           HG1      MET  86  64.285   4.608  -8.647
  623   1HE   MET  86           HE2      MET  86  63.498   7.197  -8.397
  624   2HE   MET  86           HE1      MET  86  62.202   7.919  -9.346
  625   3HE   MET  86           HE3      MET  86  61.828   6.724  -8.096
  626    H    LYS  87           HN       LYS  87  66.061   4.564  -9.415
  627    HA   LYS  87           HA       LYS  87  65.564   6.862 -10.867
  628   1HB   LYS  87           HB2      LYS  87  67.962   5.749  -9.523
  629   2HB   LYS  87           HB1      LYS  87  68.268   7.044 -10.680
  630   1HG   LYS  87           HG2      LYS  87  66.877   8.568  -9.514
  631   2HG   LYS  87           HG1      LYS  87  66.118   7.283  -8.574
  632   1HD   LYS  87           HD2      LYS  87  67.619   7.757  -6.956
  633   2HD   LYS  87           HD1      LYS  87  68.823   6.999  -7.999
  634   1HE   LYS  87           HE2      LYS  87  69.754   9.117  -7.602
  635   2HE   LYS  87           HE1      LYS  87  68.942   9.337  -9.151
  636   1HZ   LYS  87           HZ3      LYS  87  67.111   9.800  -7.072
  637   2HZ   LYS  87           HZ2      LYS  87  68.504  10.726  -6.780
  638   3HZ   LYS  87           HZ1      LYS  87  67.667  10.884  -8.251
  639    H    GLU  88           HN       GLU  88  68.431   4.918 -11.736
  640    HA   GLU  88           HA       GLU  88  67.926   5.665 -14.576
  641   1HB   GLU  88           HB2      GLU  88  70.320   5.284 -12.930
  642   2HB   GLU  88           HB1      GLU  88  70.410   4.434 -14.473
  643   1HG   GLU  88           HG2      GLU  88  70.549   6.363 -15.659
  644   2HG   GLU  88           HG1      GLU  88  69.306   7.151 -14.686
  645    H    ASP  89           HN       ASP  89  68.694   3.868 -16.161
  646    HA   ASP  89           HA       ASP  89  68.173   1.756 -17.051
  647   1HB   ASP  89           HB2      ASP  89  69.370   1.240 -14.354
  648   2HB   ASP  89           HB1      ASP  89  68.660  -0.118 -15.228
  649    H    ALA  90           HN       ALA  90  65.852   2.867 -16.628
  650    HA   ALA  90           HA       ALA  90  64.223   0.721 -15.382
  651   1HB   ALA  90           HB3      ALA  90  64.679   3.132 -14.064
  652   2HB   ALA  90           HB2      ALA  90  63.113   3.368 -14.839
  653   3HB   ALA  90           HB1      ALA  90  63.357   2.010 -13.740
   
  No H/Q in entry =         653
  Start of MODEL    6
    1   1H    ALA   1           HT3      ALA   1  66.936  19.259   7.194
    2   2H    ALA   1           HT2      ALA   1  66.805  20.646   8.167
    3   3H    ALA   1           HT1      ALA   1  68.179  20.413   7.196
    4    HA   ALA   1           HA       ALA   1  68.837  18.505   8.499
    5   1HB   ALA   1           HB1      ALA   1  68.940  21.167   9.277
    6   2HB   ALA   1           HB3      ALA   1  68.312  20.354  10.710
    7   3HB   ALA   1           HB2      ALA   1  69.851  19.849  10.013
    8    H    SER   2           HN       SER   2  67.392  16.776   8.748
    9    HA   SER   2           HA       SER   2  66.081  16.518  11.286
   10   1HB   SER   2           HB2      SER   2  64.515  17.683   9.120
   11   2HB   SER   2           HB1      SER   2  63.800  16.184   9.709
   12    HG   SER   2           HG       SER   2  63.785  17.037  11.773
   13    H    MET   3           HN       MET   3  66.031  15.446   7.884
   14    HA   MET   3           HA       MET   3  66.598  12.700   8.776
   15   1HB   MET   3           HB2      MET   3  64.671  11.704   7.666
   16   2HB   MET   3           HB1      MET   3  64.104  12.882   8.852
   17   1HG   MET   3           HG2      MET   3  64.608  14.127   6.267
   18   2HG   MET   3           HG1      MET   3  63.434  12.817   6.139
   19   1HE   MET   3           HE1      MET   3  64.304  16.053   6.667
   20   2HE   MET   3           HE3      MET   3  62.701  16.423   6.020
   21   3HE   MET   3           HE2      MET   3  63.134  16.922   7.654
   22    H    THR   4           HN       THR   4  67.973  14.735   7.185
   23    HA   THR   4           HA       THR   4  69.206  14.870   5.201
   24    HB   THR   4           HB       THR   4  68.852  12.310   4.046
   25    HG1  THR   4           HG1      THR   4  69.354  11.070   5.977
   26   1HG2  THR   4          HG21      THR   4  70.974  13.431   5.896
   27   2HG2  THR   4          HG23      THR   4  71.165  11.977   4.915
   28   3HG2  THR   4          HG22      THR   4  70.952  13.544   4.136
   29    H    ASP   5           HN       ASP   5  68.820  15.417   3.044
   30    HA   ASP   5           HA       ASP   5  66.062  15.715   2.251
   31   1HB   ASP   5           HB2      ASP   5  68.657  16.058   0.722
   32   2HB   ASP   5           HB1      ASP   5  67.073  16.459   0.059
   33    H    GLN   6           HN       GLN   6  68.473  13.251   1.738
   34    HA   GLN   6           HA       GLN   6  67.443  12.025  -0.610
   35   1HB   GLN   6           HB2      GLN   6  69.236  11.281   1.586
   36   2HB   GLN   6           HB1      GLN   6  68.325   9.910   0.950
   37   1HG   GLN   6           HG2      GLN   6  69.228  10.131  -1.192
   38   2HG   GLN   6           HG1      GLN   6  69.626  11.833  -0.955
   39   1HE2  GLN   6          HE22      GLN   6  72.348   8.999   0.001
   40   2HE2  GLN   6          HE21      GLN   6  70.859   8.606  -0.714
   41    H    GLN   7           HN       GLN   7  66.431  11.805   2.768
   42    HA   GLN   7           HA       GLN   7  64.531   9.648   2.256
   43   1HB   GLN   7           HB2      GLN   7  64.471  11.532   4.617
   44   2HB   GLN   7           HB1      GLN   7  63.936   9.854   4.544
   45   1HG   GLN   7           HG2      GLN   7  66.804  10.810   4.306
   46   2HG   GLN   7           HG1      GLN   7  66.095  10.011   5.710
   47   1HE2  GLN   7          HE22      GLN   7  67.756   7.333   3.764
   48   2HE2  GLN   7          HE21      GLN   7  68.243   8.689   4.662
   49    H    ALA   8           HN       ALA   8  64.474  13.156   2.244
   50    HA   ALA   8           HA       ALA   8  61.595  13.422   2.312
   51   1HB   ALA   8           HB3      ALA   8  63.628  15.185   2.580
   52   2HB   ALA   8           HB2      ALA   8  63.208  15.477   0.894
   53   3HB   ALA   8           HB1      ALA   8  61.989  15.676   2.153
   54    H    GLU   9           HN       GLU   9  63.978  12.970  -0.252
   55    HA   GLU   9           HA       GLU   9  61.961  13.387  -2.355
   56   1HB   GLU   9           HB2      GLU   9  64.812  13.386  -2.212
   57   2HB   GLU   9           HB1      GLU   9  64.331  12.136  -3.360
   58   1HG   GLU   9           HG2      GLU   9  63.462  15.041  -3.398
   59   2HG   GLU   9           HG1      GLU   9  64.556  14.257  -4.541
   60    H    ALA  10           HN       ALA  10  64.063  10.644  -1.387
   61    HA   ALA  10           HA       ALA  10  62.922   8.658  -2.980
   62   1HB   ALA  10           HB2      ALA  10  64.889   8.370  -1.436
   63   2HB   ALA  10           HB1      ALA  10  63.753   8.268  -0.091
   64   3HB   ALA  10           HB3      ALA  10  63.726   7.046  -1.360
   65    H    ARG  11           HN       ARG  11  61.868   9.555   0.328
   66    HA   ARG  11           HA       ARG  11  59.575   7.808   0.274
   67   1HB   ARG  11           HB2      ARG  11  60.847   9.333   2.204
   68   2HB   ARG  11           HB1      ARG  11  59.313  10.177   1.984
   69   1HG   ARG  11           HG2      ARG  11  58.055   8.182   2.447
   70   2HG   ARG  11           HG1      ARG  11  59.507   7.184   2.392
   71   1HD   ARG  11           HD2      ARG  11  59.090   7.497   4.706
   72   2HD   ARG  11           HD1      ARG  11  60.374   8.643   4.327
   73    HE   ARG  11           HE       ARG  11  58.444  10.351   4.105
   74   1HH1  ARG  11          HH21      ARG  11  56.199   8.552   4.742
   75   2HH1  ARG  11          HH22      ARG  11  56.006   8.756   6.450
   76   1HH2  ARG  11          HH11      ARG  11  59.134  10.186   6.899
   77   2HH2  ARG  11          HH12      ARG  11  57.667   9.683   7.673
   78    H    ALA  12           HN       ALA  12  60.174  11.036  -0.908
   79    HA   ALA  12           HA       ALA  12  57.456  11.935  -1.047
   80   1HB   ALA  12           HB2      ALA  12  60.046  12.709  -2.288
   81   2HB   ALA  12           HB1      ALA  12  58.587  13.222  -3.135
   82   3HB   ALA  12           HB3      ALA  12  58.852  13.709  -1.461
   83    H    PHE  13           HN       PHE  13  59.444   9.968  -3.217
   84    HA   PHE  13           HA       PHE  13  57.305   9.893  -5.242
   85   1HB   PHE  13           HB2      PHE  13  59.549   9.907  -6.109
   86   2HB   PHE  13           HB1      PHE  13  60.026   8.575  -5.055
   87    HD1  PHE  13           HD1      PHE  13  57.568   9.429  -7.754
   88    HD2  PHE  13           HD2      PHE  13  59.905   6.373  -5.843
   89    HE1  PHE  13           HE1      PHE  13  56.856   7.802  -9.483
   90    HE2  PHE  13           HE2      PHE  13  59.192   4.746  -7.573
   91    HZ   PHE  13           HZ       PHE  13  57.668   5.460  -9.394
   92    H    LEU  14           HN       LEU  14  58.287   8.113  -2.466
   93    HA   LEU  14           HA       LEU  14  56.901   5.653  -3.344
   94   1HB   LEU  14           HB2      LEU  14  58.248   6.325  -0.709
   95   2HB   LEU  14           HB1      LEU  14  57.653   4.734  -1.187
   96    HG   LEU  14           HG       LEU  14  59.690   6.259  -2.820
   97   1HD1  LEU  14          HD12      LEU  14  60.107   4.257  -0.583
   98   2HD1  LEU  14          HD11      LEU  14  61.355   4.689  -1.752
   99   3HD1  LEU  14          HD13      LEU  14  60.710   5.912  -0.659
  100   1HD2  LEU  14          HD23      LEU  14  58.714   3.394  -2.710
  101   2HD2  LEU  14          HD22      LEU  14  58.596   4.520  -4.063
  102   3HD2  LEU  14          HD21      LEU  14  60.168   3.877  -3.585
  103    H    SER  15           HN       SER  15  54.945   4.947  -2.443
  104    HA   SER  15           HA       SER  15  53.393   7.057  -1.042
  105   1HB   SER  15           HB2      SER  15  52.141   4.494  -1.915
  106   2HB   SER  15           HB1      SER  15  51.494   6.130  -1.964
  107    HG   SER  15           HG       SER  15  52.162   5.118  -4.030
  108    H    GLU  16           HN       GLU  16  52.084   6.450   0.835
  109    HA   GLU  16           HA       GLU  16  53.497   5.044   2.839
  110   1HB   GLU  16           HB2      GLU  16  50.979   6.393   2.600
  111   2HB   GLU  16           HB1      GLU  16  50.711   4.852   3.415
  112   1HG   GLU  16           HG2      GLU  16  52.400   5.360   5.072
  113   2HG   GLU  16           HG1      GLU  16  52.876   6.819   4.201
  114    H    GLU  17           HN       GLU  17  51.018   3.915   0.571
  115    HA   GLU  17           HA       GLU  17  50.719   1.302   1.749
  116   1HB   GLU  17           HB2      GLU  17  49.653   2.740  -0.484
  117   2HB   GLU  17           HB1      GLU  17  50.239   1.180  -1.061
  118   1HG   GLU  17           HG2      GLU  17  48.371   0.240  -0.229
  119   2HG   GLU  17           HG1      GLU  17  48.949   0.648   1.387
  120    H    MET  18           HN       MET  18  52.905   2.658  -0.672
  121    HA   MET  18           HA       MET  18  54.015   0.080  -1.435
  122   1HB   MET  18           HB2      MET  18  54.962   2.929  -1.839
  123   2HB   MET  18           HB1      MET  18  55.819   1.524  -2.476
  124   1HG   MET  18           HG2      MET  18  52.984   1.382  -3.090
  125   2HG   MET  18           HG1      MET  18  53.690   2.877  -3.702
  126   1HE   MET  18           HE3      MET  18  56.023   2.881  -4.294
  127   2HE   MET  18           HE2      MET  18  57.013   1.473  -4.670
  128   3HE   MET  18           HE1      MET  18  56.189   2.334  -5.969
  129    H    ILE  19           HN       ILE  19  54.552   2.322   1.152
  130    HA   ILE  19           HA       ILE  19  57.241   1.297   1.753
  131    HB   ILE  19           HB       ILE  19  55.386   3.247   3.130
  132   1HG1  ILE  19          HG12      ILE  19  58.069   4.137   2.517
  133   2HG1  ILE  19          HG11      ILE  19  57.310   3.459   1.076
  134   1HG2  ILE  19          HG21      ILE  19  58.071   2.179   4.039
  135   2HG2  ILE  19          HG23      ILE  19  57.334   3.648   4.679
  136   3HG2  ILE  19          HG22      ILE  19  56.540   2.090   4.910
  137   1HD1  ILE  19          HD13      ILE  19  55.350   5.029   2.429
  138   2HD1  ILE  19          HD12      ILE  19  56.821   5.995   2.305
  139   3HD1  ILE  19          HD11      ILE  19  56.079   5.326   0.850
  140    H    ALA  20           HN       ALA  20  53.944   0.625   2.646
  141    HA   ALA  20           HA       ALA  20  54.502  -0.744   5.126
  142   1HB   ALA  20           HB3      ALA  20  52.211   0.011   3.773
  143   2HB   ALA  20           HB2      ALA  20  52.204  -1.742   3.589
  144   3HB   ALA  20           HB1      ALA  20  52.250  -1.026   5.199
  145    H    GLU  21           HN       GLU  21  54.611  -1.601   1.752
  146    HA   GLU  21           HA       GLU  21  54.773  -4.475   2.215
  147   1HB   GLU  21           HB2      GLU  21  53.961  -4.042   0.087
  148   2HB   GLU  21           HB1      GLU  21  54.985  -2.625  -0.130
  149   1HG   GLU  21           HG2      GLU  21  55.733  -4.450  -1.589
  150   2HG   GLU  21           HG1      GLU  21  56.955  -4.104  -0.367
  151    H    PHE  22           HN       PHE  22  57.126  -1.973   1.179
  152    HA   PHE  22           HA       PHE  22  59.424  -3.617   1.191
  153   1HB   PHE  22           HB2      PHE  22  59.072  -0.672   1.791
  154   2HB   PHE  22           HB1      PHE  22  60.657  -1.441   1.698
  155    HD1  PHE  22           HD1      PHE  22  60.272  -3.402  -0.463
  156    HD2  PHE  22           HD2      PHE  22  58.915   0.661  -0.149
  157    HE1  PHE  22           HE1      PHE  22  60.215  -3.230  -2.936
  158    HE2  PHE  22           HE2      PHE  22  58.857   0.834  -2.623
  159    HZ   PHE  22           HZ       PHE  22  59.508  -1.112  -4.017
  160    H    LYS  23           HN       LYS  23  57.733  -2.041   3.858
  161    HA   LYS  23           HA       LYS  23  59.726  -2.372   5.866
  162   1HB   LYS  23           HB2      LYS  23  57.740  -0.999   6.246
  163   2HB   LYS  23           HB1      LYS  23  56.702  -2.419   6.108
  164   1HG   LYS  23           HG2      LYS  23  57.161  -1.787   8.481
  165   2HG   LYS  23           HG1      LYS  23  57.725  -3.411   8.086
  166   1HD   LYS  23           HD2      LYS  23  59.947  -2.821   8.207
  167   2HD   LYS  23           HD1      LYS  23  59.645  -1.163   7.685
  168   1HE   LYS  23           HE2      LYS  23  58.643  -0.652   9.882
  169   2HE   LYS  23           HE1      LYS  23  58.948  -2.307  10.407
  170   1HZ   LYS  23           HZ2      LYS  23  61.325  -1.266   9.370
  171   2HZ   LYS  23           HZ1      LYS  23  60.697  -0.122  10.457
  172   3HZ   LYS  23           HZ3      LYS  23  60.985  -1.712  10.973
  173    H    ALA  24           HN       ALA  24  57.298  -4.602   4.587
  174    HA   ALA  24           HA       ALA  24  57.501  -6.643   6.541
  175   1HB   ALA  24           HB2      ALA  24  55.833  -6.615   4.693
  176   2HB   ALA  24           HB1      ALA  24  57.125  -6.989   3.552
  177   3HB   ALA  24           HB3      ALA  24  56.686  -8.156   4.798
  178    H    ALA  25           HN       ALA  25  59.462  -6.079   3.614
  179    HA   ALA  25           HA       ALA  25  61.131  -8.401   4.020
  180   1HB   ALA  25           HB2      ALA  25  60.796  -6.489   2.007
  181   2HB   ALA  25           HB1      ALA  25  62.438  -6.225   2.593
  182   3HB   ALA  25           HB3      ALA  25  61.958  -7.816   2.004
  183    H    PHE  26           HN       PHE  26  61.321  -5.016   5.029
  184    HA   PHE  26           HA       PHE  26  63.991  -4.905   5.907
  185   1HB   PHE  26           HB2      PHE  26  62.217  -3.046   5.937
  186   2HB   PHE  26           HB1      PHE  26  61.697  -3.723   7.481
  187    HD1  PHE  26           HD1      PHE  26  64.883  -2.756   5.740
  188    HD2  PHE  26           HD2      PHE  26  62.660  -2.855   9.415
  189    HE1  PHE  26           HE1      PHE  26  66.726  -1.558   6.887
  190    HE2  PHE  26           HE2      PHE  26  64.505  -1.657  10.562
  191    HZ   PHE  26           HZ       PHE  26  66.537  -1.009   9.299
  192    H    ASP  27           HN       ASP  27  61.220  -5.542   8.084
  193    HA   ASP  27           HA       ASP  27  62.760  -6.532  10.238
  194   1HB   ASP  27           HB2      ASP  27  59.920  -7.149   9.386
  195   2HB   ASP  27           HB1      ASP  27  60.616  -7.710  10.907
  196    H    MET  28           HN       MET  28  62.075  -7.983   7.198
  197    HA   MET  28           HA       MET  28  62.221 -10.747   7.986
  198   1HB   MET  28           HB2      MET  28  61.930  -9.275   5.561
  199   2HB   MET  28           HB1      MET  28  63.276 -10.394   5.350
  200   1HG   MET  28           HG2      MET  28  61.036 -11.637   6.745
  201   2HG   MET  28           HG1      MET  28  60.572 -11.036   5.154
  202   1HE   MET  28           HE3      MET  28  62.109 -11.005   3.361
  203   2HE   MET  28           HE2      MET  28  63.346 -12.190   2.948
  204   3HE   MET  28           HE1      MET  28  61.646 -12.571   2.683
  205    H    PHE  29           HN       PHE  29  64.683  -8.489   6.706
  206    HA   PHE  29           HA       PHE  29  66.781 -10.482   7.386
  207   1HB   PHE  29           HB2      PHE  29  67.513  -7.850   6.202
  208   2HB   PHE  29           HB1      PHE  29  68.122  -9.460   5.822
  209    HD1  PHE  29           HD1      PHE  29  66.652 -11.048   4.491
  210    HD2  PHE  29           HD2      PHE  29  65.760  -6.870   4.938
  211    HE1  PHE  29           HE1      PHE  29  65.115 -11.170   2.547
  212    HE2  PHE  29           HE2      PHE  29  64.221  -6.992   2.995
  213    HZ   PHE  29           HZ       PHE  29  63.899  -9.141   1.800
  214    H    ASP  30           HN       ASP  30  65.185  -8.657   9.288
  215    HA   ASP  30           HA       ASP  30  67.314  -6.948  10.397
  216   1HB   ASP  30           HB2      ASP  30  65.638  -6.168  11.945
  217   2HB   ASP  30           HB1      ASP  30  64.875  -6.271  10.359
  218    H    ALA  31           HN       ALA  31  68.050  -9.658  10.402
  219    HA   ALA  31           HA       ALA  31  67.447 -11.145  12.719
  220   1HB   ALA  31           HB3      ALA  31  69.171 -11.460  10.609
  221   2HB   ALA  31           HB2      ALA  31  70.292 -11.181  11.942
  222   3HB   ALA  31           HB1      ALA  31  69.132 -12.507  12.028
  223    H    ASP  32           HN       ASP  32  69.233  -8.199  12.393
  224    HA   ASP  32           HA       ASP  32  70.739  -8.451  14.868
  225   1HB   ASP  32           HB2      ASP  32  70.700  -6.672  12.688
  226   2HB   ASP  32           HB1      ASP  32  70.219  -5.707  14.084
  227    H    GLY  33           HN       GLY  33  67.835  -6.566  13.942
  228   1HA   GLY  33           HA2      GLY  33  65.902  -6.268  15.333
  229   2HA   GLY  33           HA1      GLY  33  66.823  -6.890  16.702
  230    H    GLY  34           HN       GLY  34  68.631  -4.645  14.942
  231   1HA   GLY  34           HA2      GLY  34  68.156  -2.610  17.057
  232   2HA   GLY  34           HA1      GLY  34  69.565  -2.674  15.997
  233    H    GLY  35           HN       GLY  35  66.499  -3.176  14.501
  234   1HA   GLY  35           HA2      GLY  35  65.196  -1.805  13.102
  235   2HA   GLY  35           HA1      GLY  35  65.878  -0.408  13.939
  236    H    ASP  36           HN       ASP  36  67.986  -2.780  12.486
  237    HA   ASP  36           HA       ASP  36  68.271  -1.390   9.948
  238   1HB   ASP  36           HB2      ASP  36  70.587  -0.590  10.354
  239   2HB   ASP  36           HB1      ASP  36  69.423   0.226  11.396
  240    H    ILE  37           HN       ILE  37  69.195  -2.797   8.491
  241    HA   ILE  37           HA       ILE  37  70.485  -5.232   9.643
  242    HB   ILE  37           HB       ILE  37  69.013  -6.416   8.418
  243   1HG1  ILE  37          HG12      ILE  37  70.925  -6.196   6.696
  244   2HG1  ILE  37          HG11      ILE  37  69.349  -6.698   6.086
  245   1HG2  ILE  37          HG22      ILE  37  68.208  -3.791   7.137
  246   2HG2  ILE  37          HG21      ILE  37  67.324  -5.308   6.974
  247   3HG2  ILE  37          HG23      ILE  37  67.467  -4.535   8.552
  248   1HD1  ILE  37          HD13      ILE  37  69.582  -3.798   6.142
  249   2HD1  ILE  37          HD12      ILE  37  70.863  -4.527   5.174
  250   3HD1  ILE  37          HD11      ILE  37  69.174  -4.858   4.794
  251    H    SER  38           HN       SER  38  72.390  -6.021   8.607
  252    HA   SER  38           HA       SER  38  74.216  -4.026   7.708
  253   1HB   SER  38           HB2      SER  38  74.465  -6.961   7.040
  254   2HB   SER  38           HB1      SER  38  75.754  -5.801   7.350
  255    HG   SER  38           HG       SER  38  74.438  -5.662   9.495
  256    H    THR  39           HN       THR  39  74.848  -3.410   5.620
  257    HA   THR  39           HA       THR  39  72.896  -3.682   3.537
  258    HB   THR  39           HB       THR  39  74.267  -2.302   2.253
  259    HG1  THR  39           HG1      THR  39  76.500  -3.242   3.720
  260   1HG2  THR  39          HG22      THR  39  74.127  -1.792   5.033
  261   2HG2  THR  39          HG21      THR  39  75.752  -1.337   4.521
  262   3HG2  THR  39          HG23      THR  39  74.347  -0.618   3.736
  263    H    LYS  40           HN       LYS  40  75.563  -5.661   4.502
  264    HA   LYS  40           HA       LYS  40  76.229  -6.932   2.064
  265   1HB   LYS  40           HB2      LYS  40  76.861  -8.882   3.464
  266   2HB   LYS  40           HB1      LYS  40  77.444  -7.371   4.161
  267   1HG   LYS  40           HG2      LYS  40  76.217  -7.673   6.026
  268   2HG   LYS  40           HG1      LYS  40  74.756  -7.963   5.080
  269   1HD   LYS  40           HD2      LYS  40  75.073 -10.257   5.031
  270   2HD   LYS  40           HD1      LYS  40  76.824 -10.123   5.193
  271   1HE   LYS  40           HE2      LYS  40  76.520  -9.371   7.547
  272   2HE   LYS  40           HE1      LYS  40  74.780  -9.612   7.374
  273   1HZ   LYS  40           HZ3      LYS  40  76.839 -11.720   6.998
  274   2HZ   LYS  40           HZ2      LYS  40  75.886 -11.524   8.391
  275   3HZ   LYS  40           HZ1      LYS  40  75.159 -11.934   6.911
  276    H    ALA  41           HN       ALA  41  73.368  -7.129   4.029
  277    HA   ALA  41           HA       ALA  41  72.380  -9.534   2.629
  278   1HB   ALA  41           HB1      ALA  41  71.862  -8.319   5.131
  279   2HB   ALA  41           HB3      ALA  41  70.371  -8.179   4.198
  280   3HB   ALA  41           HB2      ALA  41  71.096  -9.764   4.466
  281    H    LEU  42           HN       LEU  42  72.011  -6.046   2.554
  282    HA   LEU  42           HA       LEU  42  69.598  -5.650   1.265
  283   1HB   LEU  42           HB2      LEU  42  72.227  -4.309   1.185
  284   2HB   LEU  42           HB1      LEU  42  71.231  -4.024  -0.239
  285    HG   LEU  42           HG       LEU  42  70.669  -2.288   1.295
  286   1HD1  LEU  42          HD13      LEU  42  68.773  -4.061   0.397
  287   2HD1  LEU  42          HD12      LEU  42  68.430  -4.009   2.128
  288   3HD1  LEU  42          HD11      LEU  42  68.419  -2.520   1.179
  289   1HD2  LEU  42          HD23      LEU  42  71.067  -4.438   3.267
  290   2HD2  LEU  42          HD22      LEU  42  71.316  -2.698   3.429
  291   3HD2  LEU  42          HD21      LEU  42  69.700  -3.381   3.623
  292    H    GLY  43           HN       GLY  43  72.419  -7.269  -0.005
  293   1HA   GLY  43           HA2      GLY  43  71.769  -7.148  -2.787
  294   2HA   GLY  43           HA1      GLY  43  72.766  -8.394  -2.034
  295    H    THR  44           HN       THR  44  71.099  -9.717  -0.378
  296    HA   THR  44           HA       THR  44  69.470 -11.263  -2.186
  297    HB   THR  44           HB       THR  44  69.730 -11.222   0.828
  298    HG1  THR  44           HG1      THR  44  71.359 -12.073  -0.789
  299   1HG2  THR  44          HG21      THR  44  67.625 -12.346  -0.789
  300   2HG2  THR  44          HG23      THR  44  68.553 -13.642  -0.035
  301   3HG2  THR  44          HG22      THR  44  67.815 -12.389   0.964
  302    H    VAL  45           HN       VAL  45  68.716  -8.891   0.355
  303    HA   VAL  45           HA       VAL  45  65.930  -9.041   0.394
  304    HB   VAL  45           HB       VAL  45  67.627  -6.527   0.447
  305   1HG1  VAL  45          HG11      VAL  45  64.748  -7.104   0.940
  306   2HG1  VAL  45          HG13      VAL  45  65.545  -6.003   2.062
  307   3HG1  VAL  45          HG12      VAL  45  65.513  -5.635   0.336
  308   1HG2  VAL  45          HG22      VAL  45  66.849  -8.571   2.524
  309   2HG2  VAL  45          HG21      VAL  45  68.446  -7.906   2.179
  310   3HG2  VAL  45          HG23      VAL  45  67.234  -6.913   2.986
  311    H    MET  46           HN       MET  46  67.890  -6.969  -1.772
  312    HA   MET  46           HA       MET  46  65.833  -5.866  -3.308
  313   1HB   MET  46           HB2      MET  46  68.688  -6.519  -3.785
  314   2HB   MET  46           HB1      MET  46  67.705  -6.270  -5.229
  315   1HG   MET  46           HG2      MET  46  66.889  -4.206  -3.585
  316   2HG   MET  46           HG1      MET  46  68.613  -4.322  -3.231
  317   1HE   MET  46           HE3      MET  46  67.800  -1.958  -3.959
  318   2HE   MET  46           HE2      MET  46  69.435  -1.871  -4.613
  319   3HE   MET  46           HE1      MET  46  68.072  -1.336  -5.594
  320    H    ARG  47           HN       ARG  47  67.608  -8.881  -4.098
  321    HA   ARG  47           HA       ARG  47  66.178  -9.694  -6.332
  322   1HB   ARG  47           HB2      ARG  47  67.119 -11.437  -4.034
  323   2HB   ARG  47           HB1      ARG  47  66.665 -12.033  -5.632
  324   1HG   ARG  47           HG2      ARG  47  68.420 -10.210  -6.437
  325   2HG   ARG  47           HG1      ARG  47  69.067 -10.444  -4.812
  326   1HD   ARG  47           HD2      ARG  47  70.115 -12.286  -5.575
  327   2HD   ARG  47           HD1      ARG  47  68.529 -13.031  -5.778
  328    HE   ARG  47           HE       ARG  47  68.547 -12.133  -8.121
  329   1HH1  ARG  47          HH11      ARG  47  70.446 -10.332  -8.750
  330   2HH1  ARG  47          HH12      ARG  47  71.922 -11.185  -9.059
  331   1HH2  ARG  47          HH21      ARG  47  70.893 -14.084  -7.458
  332   2HH2  ARG  47          HH22      ARG  47  72.176 -13.308  -8.328
  333    H    MET  48           HN       MET  48  65.174  -9.946  -2.939
  334    HA   MET  48           HA       MET  48  62.782 -11.472  -3.512
  335   1HB   MET  48           HB2      MET  48  64.111 -10.424  -1.193
  336   2HB   MET  48           HB1      MET  48  62.414  -9.946  -1.142
  337   1HG   MET  48           HG2      MET  48  61.653 -12.139  -1.083
  338   2HG   MET  48           HG1      MET  48  63.090 -12.767  -1.891
  339   1HE   MET  48           HE3      MET  48  65.155 -12.748  -1.217
  340   2HE   MET  48           HE2      MET  48  65.838 -12.171   0.299
  341   3HE   MET  48           HE1      MET  48  65.378 -13.862   0.138
  342    H    LEU  49           HN       LEU  49  63.491  -8.010  -3.178
  343    HA   LEU  49           HA       LEU  49  60.748  -7.149  -3.320
  344   1HB   LEU  49           HB2      LEU  49  63.102  -5.522  -4.282
  345   2HB   LEU  49           HB1      LEU  49  61.612  -4.953  -3.526
  346    HG   LEU  49           HG       LEU  49  63.909  -6.429  -2.223
  347   1HD1  LEU  49          HD12      LEU  49  63.853  -3.875  -2.498
  348   2HD1  LEU  49          HD11      LEU  49  62.502  -3.895  -1.364
  349   3HD1  LEU  49          HD13      LEU  49  64.085  -4.486  -0.860
  350   1HD2  LEU  49          HD22      LEU  49  61.735  -7.422  -1.513
  351   2HD2  LEU  49          HD21      LEU  49  62.533  -6.560  -0.197
  352   3HD2  LEU  49          HD23      LEU  49  61.179  -5.814  -1.047
  353    H    GLY  50           HN       GLY  50  63.041  -8.215  -5.694
  354   1HA   GLY  50           HA2      GLY  50  61.998  -8.951  -7.856
  355   2HA   GLY  50           HA1      GLY  50  61.103  -7.432  -7.836
  356    H    GLN  51           HN       GLN  51  63.889  -6.423  -6.642
  357    HA   GLN  51           HA       GLN  51  64.875  -5.574  -9.298
  358   1HB   GLN  51           HB2      GLN  51  64.818  -4.430  -6.665
  359   2HB   GLN  51           HB1      GLN  51  66.495  -4.526  -7.206
  360   1HG   GLN  51           HG2      GLN  51  66.092  -2.658  -8.408
  361   2HG   GLN  51           HG1      GLN  51  65.105  -3.665  -9.467
  362   1HE2  GLN  51          HE22      GLN  51  63.090  -0.784  -7.978
  363   2HE2  GLN  51          HE21      GLN  51  64.616  -0.814  -8.721
  364    H    ASN  52           HN       ASN  52  66.617  -6.529 -10.236
  365    HA   ASN  52           HA       ASN  52  68.500  -8.041  -8.473
  366   1HB   ASN  52           HB2      ASN  52  67.352  -8.875 -11.152
  367   2HB   ASN  52           HB1      ASN  52  68.725  -9.675 -10.387
  368   1HD2  ASN  52          HD22      ASN  52  65.146 -10.934  -9.343
  369   2HD2  ASN  52          HD21      ASN  52  65.562 -10.215 -10.824
  370    HA   PRO  53           HA       PRO  53  70.730  -5.018 -11.174
  371   1HB   PRO  53           HB2      PRO  53  72.014  -3.744  -9.104
  372   2HB   PRO  53           HB1      PRO  53  70.430  -3.250  -9.725
  373   1HG   PRO  53           HG2      PRO  53  71.089  -4.690  -7.198
  374   2HG   PRO  53           HG1      PRO  53  69.705  -3.648  -7.567
  375   1HD   PRO  53           HD2      PRO  53  69.676  -6.476  -7.507
  376   2HD   PRO  53           HD1      PRO  53  68.413  -5.434  -8.198
  377    H    THR  54           HN       THR  54  73.263  -4.604 -10.995
  378    HA   THR  54           HA       THR  54  74.505  -7.245 -10.692
  379    HB   THR  54           HB       THR  54  76.588  -5.673 -11.311
  380    HG1  THR  54           HG1      THR  54  74.517  -4.295 -12.588
  381   1HG2  THR  54          HG21      THR  54  74.353  -6.608 -13.121
  382   2HG2  THR  54          HG23      THR  54  75.881  -5.975 -13.733
  383   3HG2  THR  54          HG22      THR  54  75.863  -7.442 -12.754
  384    H    LYS  55           HN       LYS  55  75.664  -7.892  -8.931
  385    HA   LYS  55           HA       LYS  55  75.649  -6.547  -6.473
  386   1HB   LYS  55           HB2      LYS  55  77.062  -8.834  -7.622
  387   2HB   LYS  55           HB1      LYS  55  78.032  -7.986  -6.417
  388   1HG   LYS  55           HG2      LYS  55  76.094  -8.089  -4.845
  389   2HG   LYS  55           HG1      LYS  55  75.219  -9.050  -6.037
  390   1HD   LYS  55           HD2      LYS  55  76.897 -10.805  -5.934
  391   2HD   LYS  55           HD1      LYS  55  77.907  -9.824  -4.873
  392   1HE   LYS  55           HE2      LYS  55  75.799  -9.776  -3.326
  393   2HE   LYS  55           HE1      LYS  55  75.295 -11.183  -4.261
  394   1HZ   LYS  55           HZ2      LYS  55  78.008 -11.442  -3.549
  395   2HZ   LYS  55           HZ1      LYS  55  77.100 -11.104  -2.154
  396   3HZ   LYS  55           HZ3      LYS  55  76.698 -12.436  -3.123
  397    H    GLU  56           HN       GLU  56  78.033  -6.349  -9.094
  398    HA   GLU  56           HA       GLU  56  80.067  -4.895  -7.825
  399   1HB   GLU  56           HB2      GLU  56  78.985  -4.522 -10.636
  400   2HB   GLU  56           HB1      GLU  56  80.540  -3.918 -10.062
  401   1HG   GLU  56           HG2      GLU  56  79.973  -6.808  -9.621
  402   2HG   GLU  56           HG1      GLU  56  80.296  -6.301 -11.279
  403    H    GLU  57           HN       GLU  57  77.246  -3.506  -9.551
  404    HA   GLU  57           HA       GLU  57  77.798  -0.825  -8.635
  405   1HB   GLU  57           HB2      GLU  57  75.569  -2.201 -10.059
  406   2HB   GLU  57           HB1      GLU  57  75.190  -0.677  -9.256
  407   1HG   GLU  57           HG2      GLU  57  76.659   0.548 -10.591
  408   2HG   GLU  57           HG1      GLU  57  77.643  -0.864 -10.980
  409    H    LEU  58           HN       LEU  58  76.209  -3.567  -7.232
  410    HA   LEU  58           HA       LEU  58  74.470  -2.225  -5.403
  411   1HB   LEU  58           HB2      LEU  58  74.673  -4.763  -5.957
  412   2HB   LEU  58           HB1      LEU  58  75.918  -4.774  -4.707
  413    HG   LEU  58           HG       LEU  58  73.940  -3.366  -3.456
  414   1HD1  LEU  58          HD11      LEU  58  72.645  -4.307  -5.685
  415   2HD1  LEU  58          HD13      LEU  58  72.316  -5.587  -4.518
  416   3HD1  LEU  58          HD12      LEU  58  71.851  -3.925  -4.158
  417   1HD2  LEU  58          HD22      LEU  58  75.327  -5.571  -2.922
  418   2HD2  LEU  58          HD21      LEU  58  73.850  -5.198  -2.034
  419   3HD2  LEU  58          HD23      LEU  58  73.812  -6.358  -3.363
  420    H    ASP  59           HN       ASP  59  77.830  -3.389  -4.983
  421    HA   ASP  59           HA       ASP  59  78.203  -2.489  -2.330
  422   1HB   ASP  59           HB2      ASP  59  79.786  -3.798  -4.032
  423   2HB   ASP  59           HB1      ASP  59  80.448  -2.182  -4.284
  424    H    ALA  60           HN       ALA  60  78.707  -0.754  -5.407
  425    HA   ALA  60           HA       ALA  60  79.605   1.694  -4.216
  426   1HB   ALA  60           HB2      ALA  60  79.038   0.720  -6.838
  427   2HB   ALA  60           HB1      ALA  60  78.148   2.227  -6.626
  428   3HB   ALA  60           HB3      ALA  60  79.896   2.194  -6.392
  429    H    ILE  61           HN       ILE  61  76.445   0.285  -4.667
  430    HA   ILE  61           HA       ILE  61  74.975   2.764  -4.251
  431    HB   ILE  61           HB       ILE  61  74.212  -0.161  -4.243
  432   1HG1  ILE  61          HG12      ILE  61  73.520   2.197  -6.023
  433   2HG1  ILE  61          HG11      ILE  61  74.636   0.892  -6.424
  434   1HG2  ILE  61          HG23      ILE  61  72.726   2.192  -3.216
  435   2HG2  ILE  61          HG22      ILE  61  71.825   1.130  -4.300
  436   3HG2  ILE  61          HG21      ILE  61  72.541   0.483  -2.824
  437   1HD1  ILE  61          HD12      ILE  61  72.768  -0.738  -6.186
  438   2HD1  ILE  61          HD11      ILE  61  71.666   0.606  -5.889
  439   3HD1  ILE  61          HD13      ILE  61  72.463   0.449  -7.454
  440    H    ILE  62           HN       ILE  62  76.229   0.182  -2.217
  441    HA   ILE  62           HA       ILE  62  74.753   0.765   0.159
  442    HB   ILE  62           HB       ILE  62  77.536  -0.370  -0.241
  443   1HG1  ILE  62          HG12      ILE  62  75.035  -1.809   0.642
  444   2HG1  ILE  62          HG11      ILE  62  75.387  -1.568  -1.068
  445   1HG2  ILE  62          HG21      ILE  62  75.841  -0.074   2.250
  446   2HG2  ILE  62          HG23      ILE  62  77.185  -1.210   2.132
  447   3HG2  ILE  62          HG22      ILE  62  77.479   0.523   1.987
  448   1HD1  ILE  62          HD13      ILE  62  77.738  -2.535  -0.467
  449   2HD1  ILE  62          HD12      ILE  62  76.925  -3.164   0.966
  450   3HD1  ILE  62          HD11      ILE  62  76.380  -3.648  -0.640
  451    H    GLU  63           HN       GLU  63  77.816   2.064  -1.106
  452    HA   GLU  63           HA       GLU  63  78.373   3.731   1.173
  453   1HB   GLU  63           HB2      GLU  63  79.741   3.049  -1.110
  454   2HB   GLU  63           HB1      GLU  63  79.297   4.723  -1.446
  455   1HG   GLU  63           HG2      GLU  63  80.732   5.528   0.108
  456   2HG   GLU  63           HG1      GLU  63  80.247   4.320   1.299
  457    H    GLU  64           HN       GLU  64  76.558   4.237  -1.827
  458    HA   GLU  64           HA       GLU  64  76.126   7.065  -1.366
  459   1HB   GLU  64           HB2      GLU  64  74.814   5.023  -3.168
  460   2HB   GLU  64           HB1      GLU  64  74.278   6.702  -3.105
  461   1HG   GLU  64           HG2      GLU  64  76.799   7.269  -3.470
  462   2HG   GLU  64           HG1      GLU  64  76.921   5.602  -4.035
  463    H    VAL  65           HN       VAL  65  74.577   4.141  -0.273
  464    HA   VAL  65           HA       VAL  65  72.125   5.538   0.557
  465    HB   VAL  65           HB       VAL  65  73.078   2.727   1.188
  466   1HG1  VAL  65          HG13      VAL  65  71.192   4.039   2.544
  467   2HG1  VAL  65          HG12      VAL  65  70.212   3.573   1.154
  468   3HG1  VAL  65          HG11      VAL  65  71.005   2.336   2.129
  469   1HG2  VAL  65          HG21      VAL  65  72.323   3.808  -1.278
  470   2HG2  VAL  65          HG23      VAL  65  72.350   2.096  -0.856
  471   3HG2  VAL  65          HG22      VAL  65  70.860   3.023  -0.681
  472    H    ASP  66           HN       ASP  66  75.175   4.518   1.946
  473    HA   ASP  66           HA       ASP  66  74.267   5.101   4.691
  474   1HB   ASP  66           HB2      ASP  66  76.575   3.783   3.431
  475   2HB   ASP  66           HB1      ASP  66  77.005   4.789   4.815
  476    H    GLU  67           HN       GLU  67  73.774   7.404   3.829
  477    HA   GLU  67           HA       GLU  67  75.821   9.235   3.131
  478   1HB   GLU  67           HB2      GLU  67  74.205  10.922   4.316
  479   2HB   GLU  67           HB1      GLU  67  73.648  10.075   2.872
  480   1HG   GLU  67           HG2      GLU  67  73.177   8.526   5.303
  481   2HG   GLU  67           HG1      GLU  67  72.369  10.094   5.346
  482    H    ASP  68           HN       ASP  68  75.224   7.646   6.112
  483    HA   ASP  68           HA       ASP  68  76.839   9.660   7.603
  484   1HB   ASP  68           HB2      ASP  68  76.155   8.037   9.563
  485   2HB   ASP  68           HB1      ASP  68  74.979   9.189   8.929
  486    H    GLY  69           HN       GLY  69  76.890   6.395   6.362
  487   1HA   GLY  69           HA2      GLY  69  78.764   4.985   6.078
  488   2HA   GLY  69           HA1      GLY  69  79.761   6.224   6.843
  489    H    SER  70           HN       SER  70  76.854   4.921   8.335
  490    HA   SER  70           HA       SER  70  78.405   4.154  10.694
  491   1HB   SER  70           HB2      SER  70  76.144   3.419  11.548
  492   2HB   SER  70           HB1      SER  70  76.221   5.111  11.066
  493    HG   SER  70           HG       SER  70  74.420   3.638  10.268
  494    H    GLY  71           HN       GLY  71  77.818   2.659   7.776
  495   1HA   GLY  71           HA2      GLY  71  78.205   0.447   7.079
  496   2HA   GLY  71           HA1      GLY  71  78.794   0.109   8.709
  497    H    THR  72           HN       THR  72  75.626   1.480   8.303
  498    HA   THR  72           HA       THR  72  74.327  -1.173   8.505
  499    HB   THR  72           HB       THR  72  72.988  -0.268  10.502
  500    HG1  THR  72           HG1      THR  72  74.292   1.277  11.711
  501   1HG2  THR  72          HG21      THR  72  75.114  -1.884  10.405
  502   2HG2  THR  72          HG23      THR  72  75.842  -0.560  11.315
  503   3HG2  THR  72          HG22      THR  72  74.408  -1.375  11.937
  504    H    ILE  73           HN       ILE  73  72.220  -1.135   7.692
  505    HA   ILE  73           HA       ILE  73  71.320   1.500   6.605
  506    HB   ILE  73           HB       ILE  73  70.646  -1.308   5.688
  507   1HG1  ILE  73          HG12      ILE  73  73.016  -0.322   5.290
  508   2HG1  ILE  73          HG11      ILE  73  72.152  -0.977   3.901
  509   1HG2  ILE  73          HG23      ILE  73  69.828   1.432   4.703
  510   2HG2  ILE  73          HG22      ILE  73  69.702  -0.014   3.702
  511   3HG2  ILE  73          HG21      ILE  73  68.780   0.103   5.201
  512   1HD1  ILE  73          HD13      ILE  73  71.493   1.826   4.338
  513   2HD1  ILE  73          HD12      ILE  73  73.227   1.595   4.118
  514   3HD1  ILE  73          HD11      ILE  73  72.101   1.034   2.883
  515    H    ASP  74           HN       ASP  74  69.262   2.218   7.108
  516    HA   ASP  74           HA       ASP  74  67.666   0.474   8.946
  517   1HB   ASP  74           HB2      ASP  74  67.745   3.507   8.888
  518   2HB   ASP  74           HB1      ASP  74  66.892   2.498  10.058
  519    H    PHE  75           HN       PHE  75  65.246   1.245   8.906
  520    HA   PHE  75           HA       PHE  75  64.165   0.769   6.355
  521   1HB   PHE  75           HB2      PHE  75  63.004   0.816   8.684
  522   2HB   PHE  75           HB1      PHE  75  62.744   2.528   8.346
  523    HD1  PHE  75           HD2      PHE  75  62.755  -0.422   6.049
  524    HD2  PHE  75           HD1      PHE  75  60.469   2.761   7.805
  525    HE1  PHE  75           HE2      PHE  75  60.829  -1.000   4.594
  526    HE2  PHE  75           HE1      PHE  75  58.545   2.185   6.351
  527    HZ   PHE  75           HZ       PHE  75  58.725   0.302   4.745
  528    H    GLU  76           HN       GLU  76  65.101   3.834   7.853
  529    HA   GLU  76           HA       GLU  76  63.908   5.536   5.869
  530   1HB   GLU  76           HB2      GLU  76  66.443   6.282   7.301
  531   2HB   GLU  76           HB1      GLU  76  65.048   7.289   6.911
  532   1HG   GLU  76           HG2      GLU  76  64.285   6.918   8.996
  533   2HG   GLU  76           HG1      GLU  76  64.048   5.230   8.549
  534    H    GLU  77           HN       GLU  77  67.266   4.354   6.244
  535    HA   GLU  77           HA       GLU  77  68.148   5.481   3.737
  536   1HB   GLU  77           HB2      GLU  77  69.294   3.252   5.446
  537   2HB   GLU  77           HB1      GLU  77  70.118   3.967   4.059
  538   1HG   GLU  77           HG2      GLU  77  70.136   6.148   5.122
  539   2HG   GLU  77           HG1      GLU  77  69.159   5.546   6.461
  540    H    PHE  78           HN       PHE  78  66.247   2.754   4.509
  541    HA   PHE  78           HA       PHE  78  67.011   1.003   2.354
  542   1HB   PHE  78           HB2      PHE  78  65.226   0.898   4.500
  543   2HB   PHE  78           HB1      PHE  78  64.188   0.863   3.075
  544    HD1  PHE  78           HD1      PHE  78  67.022  -0.812   4.781
  545    HD2  PHE  78           HD2      PHE  78  64.160  -1.022   1.586
  546    HE1  PHE  78           HE1      PHE  78  67.622  -3.188   4.400
  547    HE2  PHE  78           HE2      PHE  78  64.760  -3.398   1.205
  548    HZ   PHE  78           HZ       PHE  78  66.492  -4.481   2.611
  549    H    LEU  79           HN       LEU  79  64.067   3.012   2.672
  550    HA   LEU  79           HA       LEU  79  63.102   2.847   0.082
  551   1HB   LEU  79           HB2      LEU  79  63.253   5.386   1.738
  552   2HB   LEU  79           HB1      LEU  79  62.129   5.079   0.414
  553    HG   LEU  79           HG       LEU  79  62.293   3.472   2.983
  554   1HD1  LEU  79          HD11      LEU  79  60.310   5.537   1.992
  555   2HD1  LEU  79          HD13      LEU  79  60.025   4.482   3.375
  556   3HD1  LEU  79          HD12      LEU  79  61.340   5.657   3.417
  557   1HD2  LEU  79          HD22      LEU  79  61.267   2.814   0.422
  558   2HD2  LEU  79          HD21      LEU  79  61.042   1.924   1.927
  559   3HD2  LEU  79          HD23      LEU  79  59.874   3.155   1.448
  560    H    VAL  80           HN       VAL  80  65.947   4.570   1.188
  561    HA   VAL  80           HA       VAL  80  66.325   6.220  -1.128
  562    HB   VAL  80           HB       VAL  80  68.364   5.066   0.799
  563   1HG1  VAL  80          HG13      VAL  80  68.525   7.025  -1.464
  564   2HG1  VAL  80          HG12      VAL  80  69.538   7.283  -0.043
  565   3HG1  VAL  80          HG11      VAL  80  69.685   5.790  -0.972
  566   1HG2  VAL  80          HG23      VAL  80  66.559   6.503   1.795
  567   2HG2  VAL  80          HG22      VAL  80  68.170   7.200   1.945
  568   3HG2  VAL  80          HG21      VAL  80  67.060   7.804   0.715
  569    H    MET  81           HN       MET  81  67.842   3.093  -0.245
  570    HA   MET  81           HA       MET  81  69.245   2.692  -2.661
  571   1HB   MET  81           HB2      MET  81  69.120   1.287  -0.406
  572   2HB   MET  81           HB1      MET  81  67.950   0.346  -1.331
  573   1HG   MET  81           HG2      MET  81  69.566  -0.079  -3.075
  574   2HG   MET  81           HG1      MET  81  70.721   1.033  -2.341
  575   1HE   MET  81           HE2      MET  81  71.081   0.988   0.076
  576   2HE   MET  81           HE1      MET  81  70.108  -0.118   1.042
  577   3HE   MET  81           HE3      MET  81  71.839  -0.415   0.826
  578    H    MET  82           HN       MET  82  65.868   1.987  -1.845
  579    HA   MET  82           HA       MET  82  65.198   0.518  -4.186
  580   1HB   MET  82           HB2      MET  82  63.406   2.444  -2.676
  581   2HB   MET  82           HB1      MET  82  62.890   1.092  -3.685
  582   1HG   MET  82           HG2      MET  82  64.777   0.509  -1.444
  583   2HG   MET  82           HG1      MET  82  63.095   0.845  -1.035
  584   1HE   MET  82           HE1      MET  82  65.609  -0.837  -2.888
  585   2HE   MET  82           HE3      MET  82  65.217  -2.556  -2.726
  586   3HE   MET  82           HE2      MET  82  64.740  -1.672  -4.174
  587    H    VAL  83           HN       VAL  83  64.740   4.016  -3.541
  588    HA   VAL  83           HA       VAL  83  64.059   4.584  -6.296
  589    HB   VAL  83           HB       VAL  83  65.081   6.553  -4.237
  590   1HG1  VAL  83          HG13      VAL  83  64.814   7.301  -6.617
  591   2HG1  VAL  83          HG12      VAL  83  63.109   6.861  -6.521
  592   3HG1  VAL  83          HG11      VAL  83  63.749   8.148  -5.497
  593   1HG2  VAL  83          HG23      VAL  83  63.258   5.143  -3.293
  594   2HG2  VAL  83          HG22      VAL  83  62.744   6.813  -3.529
  595   3HG2  VAL  83          HG21      VAL  83  62.242   5.567  -4.670
  596    H    ARG  84           HN       ARG  84  66.961   3.743  -4.891
  597    HA   ARG  84           HA       ARG  84  68.776   5.563  -6.177
  598   1HB   ARG  84           HB2      ARG  84  68.985   3.392  -4.412
  599   2HB   ARG  84           HB1      ARG  84  69.873   2.895  -5.853
  600   1HG   ARG  84           HG2      ARG  84  71.588   4.179  -5.165
  601   2HG   ARG  84           HG1      ARG  84  70.567   5.593  -5.428
  602   1HD   ARG  84           HD2      ARG  84  69.633   5.278  -3.122
  603   2HD   ARG  84           HD1      ARG  84  70.804   3.984  -2.870
  604    HE   ARG  84           HE       ARG  84  72.357   5.680  -2.399
  605   1HH1  ARG  84          HH11      ARG  84  73.160   6.795  -4.774
  606   2HH1  ARG  84          HH12      ARG  84  72.438   8.367  -4.871
  607   1HH2  ARG  84          HH21      ARG  84  70.043   7.706  -2.453
  608   2HH2  ARG  84          HH22      ARG  84  70.674   8.882  -3.556
  609    H    GLN  85           HN       GLN  85  67.042   2.730  -7.301
  610    HA   GLN  85           HA       GLN  85  68.139   3.236 -10.006
  611   1HB   GLN  85           HB2      GLN  85  68.516   0.720  -8.415
  612   2HB   GLN  85           HB1      GLN  85  68.326   0.611 -10.166
  613   1HG   GLN  85           HG2      GLN  85  70.135   2.483 -10.248
  614   2HG   GLN  85           HG1      GLN  85  70.489   1.993  -8.591
  615   1HE2  GLN  85          HE22      GLN  85  71.362  -0.573 -11.674
  616   2HE2  GLN  85          HE21      GLN  85  70.299   0.724 -11.939
  617    H    MET  86           HN       MET  86  65.458   3.268  -8.412
  618    HA   MET  86           HA       MET  86  63.941   1.396 -10.160
  619   1HB   MET  86           HB2      MET  86  62.219   1.430  -8.590
  620   2HB   MET  86           HB1      MET  86  63.627   1.637  -7.553
  621   1HG   MET  86           HG2      MET  86  63.238   4.183  -7.904
  622   2HG   MET  86           HG1      MET  86  61.631   3.710  -8.451
  623   1HE   MET  86           HE3      MET  86  60.261   2.230  -7.497
  624   2HE   MET  86           HE2      MET  86  60.147   1.683  -5.826
  625   3HE   MET  86           HE1      MET  86  59.544   3.278  -6.266
  626    H    LYS  87           HN       LYS  87  64.400   4.807  -9.447
  627    HA   LYS  87           HA       LYS  87  62.294   5.556 -11.395
  628   1HB   LYS  87           HB2      LYS  87  63.285   6.745  -9.049
  629   2HB   LYS  87           HB1      LYS  87  63.865   7.768 -10.362
  630   1HG   LYS  87           HG2      LYS  87  61.306   7.319 -11.176
  631   2HG   LYS  87           HG1      LYS  87  61.099   7.289  -9.424
  632   1HD   LYS  87           HD2      LYS  87  62.781   9.451  -9.798
  633   2HD   LYS  87           HD1      LYS  87  61.705   9.552 -11.190
  634   1HE   LYS  87           HE2      LYS  87  60.060   8.908  -8.987
  635   2HE   LYS  87           HE1      LYS  87  61.146  10.180  -8.428
  636   1HZ   LYS  87           HZ2      LYS  87  60.564  11.402 -10.507
  637   2HZ   LYS  87           HZ1      LYS  87  59.354  10.244 -10.788
  638   3HZ   LYS  87           HZ3      LYS  87  59.282  11.227  -9.408
  639    H    GLU  88           HN       GLU  88  65.666   5.006 -11.265
  640    HA   GLU  88           HA       GLU  88  65.981   6.405 -13.892
  641   1HB   GLU  88           HB2      GLU  88  67.460   6.758 -11.456
  642   2HB   GLU  88           HB1      GLU  88  68.528   6.053 -12.671
  643   1HG   GLU  88           HG2      GLU  88  68.751   8.140 -13.506
  644   2HG   GLU  88           HG1      GLU  88  67.093   7.977 -14.086
  645    H    ASP  89           HN       ASP  89  66.859   5.163 -15.529
  646    HA   ASP  89           HA       ASP  89  67.730   3.271 -16.614
  647   1HB   ASP  89           HB2      ASP  89  68.641   2.244 -13.928
  648   2HB   ASP  89           HB1      ASP  89  69.381   1.996 -15.509
  649    H    ALA  90           HN       ALA  90  65.012   3.329 -15.578
  650    HA   ALA  90           HA       ALA  90  64.558   0.548 -14.649
  651   1HB   ALA  90           HB2      ALA  90  63.072   3.083 -14.542
  652   2HB   ALA  90           HB1      ALA  90  62.068   1.695 -14.962
  653   3HB   ALA  90           HB3      ALA  90  62.997   1.691 -13.462
   
  No H/Q in entry =         653
  Start of MODEL    7
    1   1H    ALA   1           HT3      ALA   1  67.492  12.652  12.813
    2   2H    ALA   1           HT2      ALA   1  68.643  11.403  12.880
    3   3H    ALA   1           HT1      ALA   1  68.203  12.232  14.295
    4    HA   ALA   1           HA       ALA   1  69.555  13.956  13.893
    5   1HB   ALA   1           HB2      ALA   1  70.569  11.625  12.315
    6   2HB   ALA   1           HB1      ALA   1  71.405  13.170  12.149
    7   3HB   ALA   1           HB3      ALA   1  71.268  12.407  13.733
    8    H    SER   2           HN       SER   2  68.257  15.566  12.914
    9    HA   SER   2           HA       SER   2  67.422  16.908  11.166
   10   1HB   SER   2           HB2      SER   2  70.095  16.083   9.995
   11   2HB   SER   2           HB1      SER   2  69.122  17.447   9.452
   12    HG   SER   2           HG       SER   2  69.453  18.444  11.389
   13    H    MET   3           HN       MET   3  67.754  16.717   8.382
   14    HA   MET   3           HA       MET   3  66.734  13.991   7.729
   15   1HB   MET   3           HB2      MET   3  65.228  16.458   7.732
   16   2HB   MET   3           HB1      MET   3  65.335  15.821   6.090
   17   1HG   MET   3           HG2      MET   3  64.241  13.839   6.640
   18   2HG   MET   3           HG1      MET   3  64.686  13.949   8.343
   19   1HE   MET   3           HE2      MET   3  64.172  15.950   9.683
   20   2HE   MET   3           HE1      MET   3  62.540  16.593   9.851
   21   3HE   MET   3           HE3      MET   3  62.864  14.887  10.196
   22    H    THR   4           HN       THR   4  67.921  13.184   6.078
   23    HA   THR   4           HA       THR   4  69.748  14.867   4.573
   24    HB   THR   4           HB       THR   4  70.405  12.819   3.456
   25    HG1  THR   4           HG1      THR   4  67.920  11.944   4.442
   26   1HG2  THR   4          HG22      THR   4  70.402  13.173   6.230
   27   2HG2  THR   4          HG21      THR   4  69.876  11.506   5.995
   28   3HG2  THR   4          HG23      THR   4  71.412  12.050   5.318
   29    H    ASP   5           HN       ASP   5  69.634  15.346   2.317
   30    HA   ASP   5           HA       ASP   5  66.986  15.906   1.328
   31   1HB   ASP   5           HB2      ASP   5  69.393  15.783  -0.468
   32   2HB   ASP   5           HB1      ASP   5  68.053  16.929  -0.483
   33    H    GLN   6           HN       GLN   6  69.352  13.347   0.669
   34    HA   GLN   6           HA       GLN   6  68.110  12.165  -1.578
   35   1HB   GLN   6           HB2      GLN   6  69.236  10.082  -0.890
   36   2HB   GLN   6           HB1      GLN   6  70.320  11.462  -0.713
   37   1HG   GLN   6           HG2      GLN   6  69.659  11.593   1.705
   38   2HG   GLN   6           HG1      GLN   6  68.739  10.103   1.488
   39   1HE2  GLN   6          HE22      GLN   6  71.596   8.018   1.554
   40   2HE2  GLN   6          HE21      GLN   6  69.912   8.110   1.354
   41    H    GLN   7           HN       GLN   7  67.460  11.693   1.891
   42    HA   GLN   7           HA       GLN   7  65.371   9.723   1.395
   43   1HB   GLN   7           HB2      GLN   7  66.113  11.330   3.857
   44   2HB   GLN   7           HB1      GLN   7  64.871  10.077   3.835
   45   1HG   GLN   7           HG2      GLN   7  66.749   8.576   2.816
   46   2HG   GLN   7           HG1      GLN   7  67.845   9.791   3.475
   47   1HE2  GLN   7          HE22      GLN   7  67.459   7.344   6.198
   48   2HE2  GLN   7          HE21      GLN   7  68.225   7.435   4.685
   49    H    ALA   8           HN       ALA   8  65.554  13.176   1.452
   50    HA   ALA   8           HA       ALA   8  62.783  13.695   2.095
   51   1HB   ALA   8           HB3      ALA   8  64.995  15.264   1.869
   52   2HB   ALA   8           HB2      ALA   8  64.193  15.616   0.338
   53   3HB   ALA   8           HB1      ALA   8  63.348  15.893   1.862
   54    H    GLU   9           HN       GLU   9  64.554  13.093  -0.909
   55    HA   GLU   9           HA       GLU   9  62.170  13.643  -2.544
   56   1HB   GLU   9           HB2      GLU   9  64.917  12.563  -3.238
   57   2HB   GLU   9           HB1      GLU   9  63.647  12.864  -4.424
   58   1HG   GLU   9           HG2      GLU   9  63.587  15.230  -3.811
   59   2HG   GLU   9           HG1      GLU   9  64.785  14.956  -2.547
   60    H    ALA  10           HN       ALA  10  63.949  10.838  -1.324
   61    HA   ALA  10           HA       ALA  10  62.581   8.857  -2.877
   62   1HB   ALA  10           HB2      ALA  10  63.831   8.647  -0.121
   63   2HB   ALA  10           HB1      ALA  10  63.341   7.276  -1.114
   64   3HB   ALA  10           HB3      ALA  10  64.642   8.336  -1.656
   65    H    ARG  11           HN       ARG  11  61.894  10.267   0.321
   66    HA   ARG  11           HA       ARG  11  59.586   8.614   0.826
   67   1HB   ARG  11           HB2      ARG  11  60.997  10.111   2.458
   68   2HB   ARG  11           HB1      ARG  11  59.880  11.381   1.961
   69   1HG   ARG  11           HG2      ARG  11  58.247  10.543   3.263
   70   2HG   ARG  11           HG1      ARG  11  58.435   8.943   2.544
   71   1HD   ARG  11           HD2      ARG  11  59.383   8.225   4.451
   72   2HD   ARG  11           HD1      ARG  11  60.700   9.370   4.203
   73    HE   ARG  11           HE       ARG  11  58.639   9.635   6.173
   74   1HH1  ARG  11          HH21      ARG  11  61.372  11.114   5.179
   75   2HH1  ARG  11          HH22      ARG  11  60.838  12.745   5.406
   76   1HH2  ARG  11          HH11      ARG  11  57.516  11.873   5.881
   77   2HH2  ARG  11          HH12      ARG  11  58.656  13.176   5.803
   78    H    ALA  12           HN       ALA  12  60.108  11.545  -0.998
   79    HA   ALA  12           HA       ALA  12  57.322  12.348  -1.085
   80   1HB   ALA  12           HB1      ALA  12  59.859  13.180  -2.364
   81   2HB   ALA  12           HB3      ALA  12  58.404  13.474  -3.316
   82   3HB   ALA  12           HB2      ALA  12  58.558  14.167  -1.702
   83    H    PHE  13           HN       PHE  13  59.376  10.245  -3.036
   84    HA   PHE  13           HA       PHE  13  57.285   9.931  -5.085
   85   1HB   PHE  13           HB2      PHE  13  59.626   9.912  -5.794
   86   2HB   PHE  13           HB1      PHE  13  59.964   8.558  -4.714
   87    HD1  PHE  13           HD1      PHE  13  57.313   9.401  -7.240
   88    HD2  PHE  13           HD2      PHE  13  60.147   6.515  -5.797
   89    HE1  PHE  13           HE1      PHE  13  56.592   7.812  -9.005
   90    HE2  PHE  13           HE2      PHE  13  59.428   4.924  -7.560
   91    HZ   PHE  13           HZ       PHE  13  57.650   5.574  -9.165
   92    H    LEU  14           HN       LEU  14  58.411   8.300  -2.209
   93    HA   LEU  14           HA       LEU  14  56.838   5.876  -2.865
   94   1HB   LEU  14           HB2      LEU  14  58.466   6.499  -0.382
   95   2HB   LEU  14           HB1      LEU  14  57.822   4.925  -0.849
   96    HG   LEU  14           HG       LEU  14  59.799   6.519  -2.504
   97   1HD1  LEU  14          HD12      LEU  14  60.356   5.287  -0.126
   98   2HD1  LEU  14          HD11      LEU  14  60.618   3.966  -1.262
   99   3HD1  LEU  14          HD13      LEU  14  61.519   5.472  -1.439
  100   1HD2  LEU  14          HD21      LEU  14  58.067   4.455  -3.217
  101   2HD2  LEU  14          HD23      LEU  14  59.523   4.928  -4.093
  102   3HD2  LEU  14          HD22      LEU  14  59.594   3.628  -2.903
  103    H    SER  15           HN       SER  15  54.797   5.579  -2.091
  104    HA   SER  15           HA       SER  15  53.717   7.626  -0.232
  105   1HB   SER  15           HB2      SER  15  51.520   6.785  -0.895
  106   2HB   SER  15           HB1      SER  15  52.481   7.107  -2.335
  107    HG   SER  15           HG       SER  15  53.098   4.722  -1.904
  108    H    GLU  16           HN       GLU  16  52.057   6.668   1.408
  109    HA   GLU  16           HA       GLU  16  53.448   4.984   3.230
  110   1HB   GLU  16           HB2      GLU  16  50.521   5.717   2.995
  111   2HB   GLU  16           HB1      GLU  16  51.161   4.755   4.328
  112   1HG   GLU  16           HG2      GLU  16  52.642   6.545   4.996
  113   2HG   GLU  16           HG1      GLU  16  52.229   7.485   3.562
  114    H    GLU  17           HN       GLU  17  51.155   4.227   0.657
  115    HA   GLU  17           HA       GLU  17  50.679   1.502   1.460
  116   1HB   GLU  17           HB2      GLU  17  49.680   1.217  -0.706
  117   2HB   GLU  17           HB1      GLU  17  49.286   2.852  -0.177
  118   1HG   GLU  17           HG2      GLU  17  50.183   3.588  -2.110
  119   2HG   GLU  17           HG1      GLU  17  51.755   3.111  -1.467
  120    H    MET  18           HN       MET  18  53.270   3.078  -0.272
  121    HA   MET  18           HA       MET  18  54.331   0.535  -1.310
  122   1HB   MET  18           HB2      MET  18  55.045   3.426  -1.543
  123   2HB   MET  18           HB1      MET  18  56.336   2.245  -1.777
  124   1HG   MET  18           HG2      MET  18  55.456   1.478  -3.736
  125   2HG   MET  18           HG1      MET  18  53.795   1.620  -3.160
  126   1HE   MET  18           HE1      MET  18  56.923   3.204  -4.084
  127   2HE   MET  18           HE3      MET  18  56.324   3.408  -5.736
  128   3HE   MET  18           HE2      MET  18  56.594   4.816  -4.713
  129    H    ILE  19           HN       ILE  19  55.629   3.082   0.860
  130    HA   ILE  19           HA       ILE  19  57.848   1.686   1.828
  131    HB   ILE  19           HB       ILE  19  56.003   3.621   3.251
  132   1HG1  ILE  19          HG12      ILE  19  58.716   4.480   2.693
  133   2HG1  ILE  19          HG11      ILE  19  57.926   3.926   1.217
  134   1HG2  ILE  19          HG21      ILE  19  57.221   2.182   4.876
  135   2HG2  ILE  19          HG23      ILE  19  58.743   2.636   4.106
  136   3HG2  ILE  19          HG22      ILE  19  57.771   3.856   4.930
  137   1HD1  ILE  19          HD11      ILE  19  56.793   5.957   3.163
  138   2HD1  ILE  19          HD13      ILE  19  57.502   6.328   1.591
  139   3HD1  ILE  19          HD12      ILE  19  56.006   5.401   1.686
  140    H    ALA  20           HN       ALA  20  54.469   1.180   2.564
  141    HA   ALA  20           HA       ALA  20  54.818  -0.317   4.990
  142   1HB   ALA  20           HB2      ALA  20  52.654   0.208   3.070
  143   2HB   ALA  20           HB1      ALA  20  52.560  -1.385   3.818
  144   3HB   ALA  20           HB3      ALA  20  52.587   0.061   4.826
  145    H    GLU  21           HN       GLU  21  54.633  -1.308   1.571
  146    HA   GLU  21           HA       GLU  21  54.783  -4.121   2.046
  147   1HB   GLU  21           HB2      GLU  21  55.734  -2.490  -0.329
  148   2HB   GLU  21           HB1      GLU  21  55.571  -4.246  -0.316
  149   1HG   GLU  21           HG2      GLU  21  53.304  -2.316   0.253
  150   2HG   GLU  21           HG1      GLU  21  53.583  -3.095  -1.305
  151    H    PHE  22           HN       PHE  22  57.382  -1.814   1.180
  152    HA   PHE  22           HA       PHE  22  59.536  -3.634   1.327
  153   1HB   PHE  22           HB2      PHE  22  59.787  -0.786   2.283
  154   2HB   PHE  22           HB1      PHE  22  60.953  -1.752   1.378
  155    HD1  PHE  22           HD1      PHE  22  59.225  -2.935  -0.720
  156    HD2  PHE  22           HD2      PHE  22  59.342   1.055   0.866
  157    HE1  PHE  22           HE1      PHE  22  58.301  -2.062  -2.850
  158    HE2  PHE  22           HE2      PHE  22  58.418   1.928  -1.264
  159    HZ   PHE  22           HZ       PHE  22  57.897   0.369  -3.120
  160    H    LYS  23           HN       LYS  23  57.874  -1.874   3.907
  161    HA   LYS  23           HA       LYS  23  59.690  -2.314   6.021
  162   1HB   LYS  23           HB2      LYS  23  57.183  -1.221   5.813
  163   2HB   LYS  23           HB1      LYS  23  56.854  -2.687   6.738
  164   1HG   LYS  23           HG2      LYS  23  59.141  -0.863   7.475
  165   2HG   LYS  23           HG1      LYS  23  57.505  -0.555   8.058
  166   1HD   LYS  23           HD2      LYS  23  57.443  -2.895   8.958
  167   2HD   LYS  23           HD1      LYS  23  59.138  -3.070   8.499
  168   1HE   LYS  23           HE2      LYS  23  59.705  -2.145  10.470
  169   2HE   LYS  23           HE1      LYS  23  58.975  -0.637   9.918
  170   1HZ   LYS  23           HZ1      LYS  23  56.803  -1.590  10.692
  171   2HZ   LYS  23           HZ3      LYS  23  57.689  -2.823  11.450
  172   3HZ   LYS  23           HZ2      LYS  23  57.909  -1.206  11.924
  173    H    ALA  24           HN       ALA  24  57.147  -4.466   4.762
  174    HA   ALA  24           HA       ALA  24  57.363  -6.520   6.689
  175   1HB   ALA  24           HB2      ALA  24  56.147  -6.173   4.126
  176   2HB   ALA  24           HB1      ALA  24  56.994  -7.719   4.123
  177   3HB   ALA  24           HB3      ALA  24  55.774  -7.383   5.353
  178    H    ALA  25           HN       ALA  25  59.166  -6.152   3.617
  179    HA   ALA  25           HA       ALA  25  60.793  -8.495   4.070
  180   1HB   ALA  25           HB3      ALA  25  60.488  -6.487   2.029
  181   2HB   ALA  25           HB2      ALA  25  62.201  -6.686   2.402
  182   3HB   ALA  25           HB1      ALA  25  61.238  -8.078   1.904
  183    H    PHE  26           HN       PHE  26  60.956  -5.213   5.189
  184    HA   PHE  26           HA       PHE  26  63.743  -4.975   5.686
  185   1HB   PHE  26           HB2      PHE  26  61.893  -3.202   5.951
  186   2HB   PHE  26           HB1      PHE  26  61.619  -3.902   7.545
  187    HD1  PHE  26           HD1      PHE  26  64.716  -3.199   5.531
  188    HD2  PHE  26           HD2      PHE  26  62.569  -2.573   9.200
  189    HE1  PHE  26           HE1      PHE  26  66.631  -1.909   6.432
  190    HE2  PHE  26           HE2      PHE  26  64.486  -1.284  10.100
  191    HZ   PHE  26           HZ       PHE  26  66.515  -0.950   8.716
  192    H    ASP  27           HN       ASP  27  61.344  -5.608   8.266
  193    HA   ASP  27           HA       ASP  27  63.170  -6.634  10.143
  194   1HB   ASP  27           HB2      ASP  27  60.230  -7.089   9.686
  195   2HB   ASP  27           HB1      ASP  27  61.077  -7.975  10.953
  196    H    MET  28           HN       MET  28  61.989  -8.093   7.243
  197    HA   MET  28           HA       MET  28  62.218 -10.847   7.874
  198   1HB   MET  28           HB2      MET  28  61.721  -9.350   5.580
  199   2HB   MET  28           HB1      MET  28  63.226 -10.193   5.211
  200   1HG   MET  28           HG2      MET  28  61.689 -12.145   6.452
  201   2HG   MET  28           HG1      MET  28  60.517 -11.264   5.473
  202   1HE   MET  28           HE2      MET  28  63.913 -12.622   5.753
  203   2HE   MET  28           HE1      MET  28  64.309 -13.429   4.236
  204   3HE   MET  28           HE3      MET  28  64.485 -11.674   4.381
  205    H    PHE  29           HN       PHE  29  64.701  -8.680   6.460
  206    HA   PHE  29           HA       PHE  29  66.773 -10.714   6.901
  207   1HB   PHE  29           HB2      PHE  29  67.260  -7.840   6.120
  208   2HB   PHE  29           HB1      PHE  29  68.232  -9.260   5.733
  209    HD1  PHE  29           HD2      PHE  29  65.174  -7.373   4.926
  210    HD2  PHE  29           HD1      PHE  29  67.561 -10.815   3.976
  211    HE1  PHE  29           HE2      PHE  29  63.895  -7.679   2.823
  212    HE2  PHE  29           HE1      PHE  29  66.282 -11.121   1.872
  213    HZ   PHE  29           HZ       PHE  29  64.450  -9.553   1.296
  214    H    ASP  30           HN       ASP  30  65.205  -8.887   9.030
  215    HA   ASP  30           HA       ASP  30  67.673  -8.205  10.580
  216   1HB   ASP  30           HB2      ASP  30  65.750  -6.451   9.886
  217   2HB   ASP  30           HB1      ASP  30  65.038  -7.068  11.378
  218    H    ALA  31           HN       ALA  31  67.766 -10.420  11.377
  219    HA   ALA  31           HA       ALA  31  65.517 -11.514  12.881
  220   1HB   ALA  31           HB1      ALA  31  68.394 -12.344  12.486
  221   2HB   ALA  31           HB3      ALA  31  67.338 -13.186  13.621
  222   3HB   ALA  31           HB2      ALA  31  66.935 -13.145  11.906
  223    H    ASP  32           HN       ASP  32  68.417  -9.665  13.602
  224    HA   ASP  32           HA       ASP  32  68.349 -10.084  16.461
  225   1HB   ASP  32           HB2      ASP  32  69.981  -8.324  16.582
  226   2HB   ASP  32           HB1      ASP  32  70.332  -9.235  15.113
  227    H    GLY  33           HN       GLY  33  66.733  -7.887  14.260
  228   1HA   GLY  33           HA2      GLY  33  64.879  -6.492  14.677
  229   2HA   GLY  33           HA1      GLY  33  64.851  -7.105  16.331
  230    H    GLY  34           HN       GLY  34  67.442  -5.413  14.552
  231   1HA   GLY  34           HA2      GLY  34  67.643  -3.529  16.842
  232   2HA   GLY  34           HA1      GLY  34  68.875  -3.769  15.603
  233    H    GLY  35           HN       GLY  35  66.099  -3.677  13.891
  234   1HA   GLY  35           HA2      GLY  35  64.791  -1.885  12.976
  235   2HA   GLY  35           HA1      GLY  35  65.804  -0.734  13.849
  236    H    ASP  36           HN       ASP  36  67.722  -3.059  12.348
  237    HA   ASP  36           HA       ASP  36  67.827  -1.842   9.698
  238   1HB   ASP  36           HB2      ASP  36  70.356  -1.251  10.156
  239   2HB   ASP  36           HB1      ASP  36  69.093  -0.100  10.588
  240    H    ILE  37           HN       ILE  37  68.819  -3.243   8.266
  241    HA   ILE  37           HA       ILE  37  70.003  -5.700   9.473
  242    HB   ILE  37           HB       ILE  37  68.484  -6.709   8.138
  243   1HG1  ILE  37          HG12      ILE  37  70.713  -6.834   6.785
  244   2HG1  ILE  37          HG11      ILE  37  69.215  -7.305   5.988
  245   1HG2  ILE  37          HG23      ILE  37  67.298  -4.541   7.858
  246   2HG2  ILE  37          HG22      ILE  37  68.295  -4.204   6.442
  247   3HG2  ILE  37          HG21      ILE  37  67.174  -5.565   6.428
  248   1HD1  ILE  37          HD12      ILE  37  70.370  -4.510   5.816
  249   2HD1  ILE  37          HD11      ILE  37  70.696  -5.767   4.623
  250   3HD1  ILE  37          HD13      ILE  37  69.048  -5.183   4.865
  251    H    SER  38           HN       SER  38  71.921  -6.589   8.439
  252    HA   SER  38           HA       SER  38  73.869  -4.555   7.804
  253   1HB   SER  38           HB2      SER  38  75.188  -6.741   7.086
  254   2HB   SER  38           HB1      SER  38  74.875  -6.400   8.785
  255    HG   SER  38           HG       SER  38  74.279  -8.568   7.760
  256    H    THR  39           HN       THR  39  74.682  -3.938   5.801
  257    HA   THR  39           HA       THR  39  73.032  -4.177   3.502
  258    HB   THR  39           HB       THR  39  74.821  -3.119   2.292
  259    HG1  THR  39           HG1      THR  39  76.393  -4.236   4.348
  260   1HG2  THR  39          HG21      THR  39  74.153  -2.296   5.012
  261   2HG2  THR  39          HG23      THR  39  75.718  -1.672   4.490
  262   3HG2  THR  39          HG22      THR  39  74.270  -1.325   3.544
  263    H    LYS  40           HN       LYS  40  75.465  -6.300   4.794
  264    HA   LYS  40           HA       LYS  40  76.235  -7.725   2.474
  265   1HB   LYS  40           HB2      LYS  40  75.698  -9.056   5.134
  266   2HB   LYS  40           HB1      LYS  40  76.928  -9.465   3.936
  267   1HG   LYS  40           HG2      LYS  40  77.320  -6.738   4.640
  268   2HG   LYS  40           HG1      LYS  40  77.130  -7.641   6.144
  269   1HD   LYS  40           HD2      LYS  40  79.204  -8.478   5.923
  270   2HD   LYS  40           HD1      LYS  40  78.769  -9.176   4.362
  271   1HE   LYS  40           HE2      LYS  40  79.787  -7.514   3.197
  272   2HE   LYS  40           HE1      LYS  40  79.203  -6.263   4.296
  273   1HZ   LYS  40           HZ3      LYS  40  81.223  -8.108   5.314
  274   2HZ   LYS  40           HZ2      LYS  40  81.733  -6.957   4.175
  275   3HZ   LYS  40           HZ1      LYS  40  81.008  -6.454   5.626
  276    H    ALA  41           HN       ALA  41  73.373  -8.110   4.552
  277    HA   ALA  41           HA       ALA  41  72.363 -10.359   2.986
  278   1HB   ALA  41           HB3      ALA  41  71.845  -9.386   5.514
  279   2HB   ALA  41           HB2      ALA  41  70.417  -8.871   4.615
  280   3HB   ALA  41           HB1      ALA  41  70.856 -10.578   4.671
  281    H    LEU  42           HN       LEU  42  72.237  -6.916   2.784
  282    HA   LEU  42           HA       LEU  42  69.775  -6.502   1.456
  283   1HB   LEU  42           HB2      LEU  42  72.124  -4.997   1.989
  284   2HB   LEU  42           HB1      LEU  42  71.825  -4.874   0.255
  285    HG   LEU  42           HG       LEU  42  69.645  -3.977   0.588
  286   1HD1  LEU  42          HD12      LEU  42  69.770  -5.496   3.027
  287   2HD1  LEU  42          HD11      LEU  42  69.353  -3.827   3.414
  288   3HD1  LEU  42          HD13      LEU  42  68.365  -4.743   2.276
  289   1HD2  LEU  42          HD21      LEU  42  71.609  -2.466   1.135
  290   2HD2  LEU  42          HD23      LEU  42  70.078  -1.986   1.865
  291   3HD2  LEU  42          HD22      LEU  42  71.297  -2.804   2.838
  292    H    GLY  43           HN       GLY  43  72.881  -7.658   0.204
  293   1HA   GLY  43           HA2      GLY  43  72.423  -7.510  -2.553
  294   2HA   GLY  43           HA1      GLY  43  73.313  -8.833  -1.793
  295    H    THR  44           HN       THR  44  71.333 -10.024  -0.276
  296    HA   THR  44           HA       THR  44  69.853 -11.475  -2.316
  297    HB   THR  44           HB       THR  44  69.888 -11.601   0.708
  298    HG1  THR  44           HG1      THR  44  71.680 -12.484  -0.240
  299   1HG2  THR  44          HG23      THR  44  68.199 -13.078  -1.305
  300   2HG2  THR  44          HG22      THR  44  68.610 -13.802   0.251
  301   3HG2  THR  44          HG21      THR  44  67.692 -12.297   0.193
  302    H    VAL  45           HN       VAL  45  69.184  -8.819  -0.142
  303    HA   VAL  45           HA       VAL  45  66.331  -8.999  -0.102
  304    HB   VAL  45           HB       VAL  45  68.072  -6.516   0.003
  305   1HG1  VAL  45          HG11      VAL  45  65.318  -6.701  -0.227
  306   2HG1  VAL  45          HG13      VAL  45  65.562  -6.586   1.516
  307   3HG1  VAL  45          HG12      VAL  45  66.196  -5.330   0.452
  308   1HG2  VAL  45          HG22      VAL  45  68.504  -8.419   1.689
  309   2HG2  VAL  45          HG21      VAL  45  68.167  -6.822   2.358
  310   3HG2  VAL  45          HG23      VAL  45  66.904  -8.050   2.330
  311    H    MET  46           HN       MET  46  68.580  -7.524  -2.411
  312    HA   MET  46           HA       MET  46  66.673  -6.131  -3.994
  313   1HB   MET  46           HB2      MET  46  69.391  -7.293  -4.500
  314   2HB   MET  46           HB1      MET  46  68.441  -6.723  -5.872
  315   1HG   MET  46           HG2      MET  46  68.381  -4.838  -3.644
  316   2HG   MET  46           HG1      MET  46  70.023  -5.142  -4.210
  317   1HE   MET  46           HE1      MET  46  67.560  -3.023  -4.111
  318   2HE   MET  46           HE3      MET  46  68.858  -2.030  -4.787
  319   3HE   MET  46           HE2      MET  46  67.322  -2.177  -5.638
  320    H    ARG  47           HN       ARG  47  68.082  -9.375  -4.609
  321    HA   ARG  47           HA       ARG  47  66.304 -10.024  -6.742
  322   1HB   ARG  47           HB2      ARG  47  68.499 -11.205  -5.839
  323   2HB   ARG  47           HB1      ARG  47  67.338 -12.171  -4.928
  324   1HG   ARG  47           HG2      ARG  47  66.246 -12.912  -6.921
  325   2HG   ARG  47           HG1      ARG  47  67.092 -11.721  -7.908
  326   1HD   ARG  47           HD2      ARG  47  68.011 -14.083  -8.060
  327   2HD   ARG  47           HD1      ARG  47  69.192 -12.849  -7.624
  328    HE   ARG  47           HE       ARG  47  68.831 -13.610  -5.221
  329   1HH1  ARG  47          HH11      ARG  47  67.033 -15.485  -4.710
  330   2HH1  ARG  47          HH12      ARG  47  67.637 -17.019  -5.242
  331   1HH2  ARG  47          HH21      ARG  47  70.070 -15.647  -7.297
  332   2HH2  ARG  47          HH22      ARG  47  69.357 -17.110  -6.706
  333    H    MET  48           HN       MET  48  65.812  -9.926  -3.322
  334    HA   MET  48           HA       MET  48  63.637 -11.835  -3.216
  335   1HB   MET  48           HB2      MET  48  65.072 -10.202  -1.367
  336   2HB   MET  48           HB1      MET  48  63.353  -9.846  -1.179
  337   1HG   MET  48           HG2      MET  48  64.284 -12.700  -1.382
  338   2HG   MET  48           HG1      MET  48  64.380 -11.847   0.159
  339   1HE   MET  48           HE2      MET  48  62.910 -10.828   1.284
  340   2HE   MET  48           HE1      MET  48  61.310 -10.316   0.756
  341   3HE   MET  48           HE3      MET  48  61.495 -11.764   1.754
  342    H    LEU  49           HN       LEU  49  63.784  -8.275  -3.463
  343    HA   LEU  49           HA       LEU  49  60.923  -7.934  -3.531
  344   1HB   LEU  49           HB2      LEU  49  62.884  -6.047  -4.830
  345   2HB   LEU  49           HB1      LEU  49  61.360  -5.667  -4.028
  346    HG   LEU  49           HG       LEU  49  63.959  -6.546  -2.752
  347   1HD1  LEU  49          HD13      LEU  49  63.192  -4.066  -3.337
  348   2HD1  LEU  49          HD12      LEU  49  62.250  -4.256  -1.858
  349   3HD1  LEU  49          HD11      LEU  49  64.004  -4.428  -1.813
  350   1HD2  LEU  49          HD22      LEU  49  61.202  -6.326  -1.495
  351   2HD2  LEU  49          HD21      LEU  49  62.111  -7.820  -1.734
  352   3HD2  LEU  49          HD23      LEU  49  62.705  -6.594  -0.612
  353    H    GLY  50           HN       GLY  50  63.392  -8.350  -6.049
  354   1HA   GLY  50           HA2      GLY  50  62.126  -9.732  -7.951
  355   2HA   GLY  50           HA1      GLY  50  61.303  -8.185  -8.142
  356    H    GLN  51           HN       GLN  51  63.864  -6.776  -7.333
  357    HA   GLN  51           HA       GLN  51  65.153  -6.962 -10.017
  358   1HB   GLN  51           HB2      GLN  51  65.940  -4.689  -9.625
  359   2HB   GLN  51           HB1      GLN  51  64.204  -4.751  -9.320
  360   1HG   GLN  51           HG2      GLN  51  65.183  -5.381  -6.849
  361   2HG   GLN  51           HG1      GLN  51  66.430  -4.278  -7.435
  362   1HE2  GLN  51          HE22      GLN  51  62.997  -2.726  -6.134
  363   2HE2  GLN  51          HE21      GLN  51  63.515  -4.306  -5.793
  364    H    ASN  52           HN       ASN  52  67.189  -7.778 -10.131
  365    HA   ASN  52           HA       ASN  52  68.879  -7.714  -7.674
  366   1HB   ASN  52           HB2      ASN  52  67.937  -9.953  -7.762
  367   2HB   ASN  52           HB1      ASN  52  68.376 -10.110  -9.464
  368   1HD2  ASN  52          HD22      ASN  52  71.662  -9.814  -7.030
  369   2HD2  ASN  52          HD21      ASN  52  70.436  -8.643  -6.939
  370    HA   PRO  53           HA       PRO  53  71.308  -6.164 -11.192
  371   1HB   PRO  53           HB2      PRO  53  72.666  -4.318  -9.673
  372   2HB   PRO  53           HB1      PRO  53  71.085  -4.007 -10.410
  373   1HG   PRO  53           HG2      PRO  53  71.750  -4.548  -7.553
  374   2HG   PRO  53           HG1      PRO  53  70.390  -3.642  -8.236
  375   1HD   PRO  53           HD2      PRO  53  70.281  -6.288  -7.241
  376   2HD   PRO  53           HD1      PRO  53  69.036  -5.492  -8.228
  377    H    THR  54           HN       THR  54  73.888  -5.690 -11.065
  378    HA   THR  54           HA       THR  54  75.064  -8.185 -10.093
  379    HB   THR  54           HB       THR  54  75.916  -7.402 -12.180
  380    HG1  THR  54           HG1      THR  54  78.042  -7.313 -11.705
  381   1HG2  THR  54          HG22      THR  54  75.739  -4.791 -10.822
  382   2HG2  THR  54          HG21      THR  54  77.159  -4.988 -11.850
  383   3HG2  THR  54          HG23      THR  54  75.543  -5.190 -12.528
  384    H    LYS  55           HN       LYS  55  76.819  -8.287  -8.554
  385    HA   LYS  55           HA       LYS  55  76.443  -6.834  -6.170
  386   1HB   LYS  55           HB2      LYS  55  79.039  -8.070  -7.137
  387   2HB   LYS  55           HB1      LYS  55  78.610  -7.717  -5.464
  388   1HG   LYS  55           HG2      LYS  55  77.092  -9.621  -7.273
  389   2HG   LYS  55           HG1      LYS  55  78.254 -10.113  -6.039
  390   1HD   LYS  55           HD2      LYS  55  76.757  -8.644  -4.450
  391   2HD   LYS  55           HD1      LYS  55  75.531  -8.895  -5.695
  392   1HE   LYS  55           HE2      LYS  55  77.095 -11.160  -4.434
  393   2HE   LYS  55           HE1      LYS  55  75.526 -10.622  -3.838
  394   1HZ   LYS  55           HZ1      LYS  55  75.365 -10.941  -6.615
  395   2HZ   LYS  55           HZ3      LYS  55  76.063 -12.345  -5.971
  396   3HZ   LYS  55           HZ2      LYS  55  74.551 -11.814  -5.406
  397    H    GLU  56           HN       GLU  56  78.387  -6.063  -8.999
  398    HA   GLU  56           HA       GLU  56  80.053  -4.051  -7.924
  399   1HB   GLU  56           HB2      GLU  56  79.743  -5.057 -10.393
  400   2HB   GLU  56           HB1      GLU  56  78.826  -3.564 -10.599
  401   1HG   GLU  56           HG2      GLU  56  80.725  -2.232  -9.889
  402   2HG   GLU  56           HG1      GLU  56  81.643  -3.684  -9.486
  403    H    GLU  57           HN       GLU  57  76.806  -3.669  -9.393
  404    HA   GLU  57           HA       GLU  57  76.603  -0.873  -8.773
  405   1HB   GLU  57           HB2      GLU  57  74.941  -2.918  -9.953
  406   2HB   GLU  57           HB1      GLU  57  73.997  -1.964  -8.809
  407   1HG   GLU  57           HG2      GLU  57  74.566   0.088  -9.918
  408   2HG   GLU  57           HG1      GLU  57  75.775  -0.719 -10.917
  409    H    LEU  58           HN       LEU  58  76.133  -3.751  -6.879
  410    HA   LEU  58           HA       LEU  58  74.414  -2.614  -4.867
  411   1HB   LEU  58           HB2      LEU  58  74.857  -5.081  -5.223
  412   2HB   LEU  58           HB1      LEU  58  76.439  -4.834  -4.484
  413    HG   LEU  58           HG       LEU  58  74.027  -3.822  -3.031
  414   1HD1  LEU  58          HD13      LEU  58  73.816  -6.325  -3.916
  415   2HD1  LEU  58          HD12      LEU  58  74.898  -6.646  -2.561
  416   3HD1  LEU  58          HD11      LEU  58  73.328  -5.895  -2.277
  417   1HD2  LEU  58          HD21      LEU  58  76.838  -4.600  -2.490
  418   2HD2  LEU  58          HD23      LEU  58  75.854  -3.345  -1.737
  419   3HD2  LEU  58          HD22      LEU  58  75.680  -5.026  -1.232
  420    H    ASP  59           HN       ASP  59  77.942  -3.262  -4.799
  421    HA   ASP  59           HA       ASP  59  78.573  -2.054  -2.375
  422   1HB   ASP  59           HB2      ASP  59  80.072  -3.136  -4.307
  423   2HB   ASP  59           HB1      ASP  59  80.366  -1.438  -4.682
  424    H    ALA  60           HN       ALA  60  78.435  -0.398  -5.550
  425    HA   ALA  60           HA       ALA  60  78.961   2.213  -4.566
  426   1HB   ALA  60           HB1      ALA  60  77.364   1.260  -6.954
  427   2HB   ALA  60           HB3      ALA  60  77.703   2.962  -6.643
  428   3HB   ALA  60           HB2      ALA  60  79.029   1.839  -6.937
  429    H    ILE  61           HN       ILE  61  75.949   0.374  -4.782
  430    HA   ILE  61           HA       ILE  61  74.168   2.509  -4.130
  431    HB   ILE  61           HB       ILE  61  74.047  -0.491  -3.873
  432   1HG1  ILE  61          HG12      ILE  61  72.488   1.592  -5.436
  433   2HG1  ILE  61          HG11      ILE  61  73.719   0.508  -6.083
  434   1HG2  ILE  61          HG22      ILE  61  72.836   0.413  -1.917
  435   2HG2  ILE  61          HG21      ILE  61  71.901   1.462  -2.983
  436   3HG2  ILE  61          HG23      ILE  61  71.720  -0.289  -3.087
  437   1HD1  ILE  61          HD11      ILE  61  71.908  -1.173  -4.755
  438   2HD1  ILE  61          HD13      ILE  61  70.901  -0.002  -5.609
  439   3HD1  ILE  61          HD12      ILE  61  72.074  -0.974  -6.501
  440    H    ILE  62           HN       ILE  62  76.094   0.323  -2.112
  441    HA   ILE  62           HA       ILE  62  74.935   1.044   0.400
  442    HB   ILE  62           HB       ILE  62  77.742   0.114  -0.277
  443   1HG1  ILE  62          HG12      ILE  62  75.274  -1.343   0.726
  444   2HG1  ILE  62          HG11      ILE  62  75.974  -1.482  -0.887
  445   1HG2  ILE  62          HG22      ILE  62  76.447   0.907   2.256
  446   2HG2  ILE  62          HG21      ILE  62  77.243  -0.667   2.300
  447   3HG2  ILE  62          HG23      ILE  62  78.161   0.774   1.862
  448   1HD1  ILE  62          HD13      ILE  62  78.157  -2.144   0.376
  449   2HD1  ILE  62          HD12      ILE  62  77.083  -2.454   1.739
  450   3HD1  ILE  62          HD11      ILE  62  76.873  -3.344   0.230
  451    H    GLU  63           HN       GLU  63  77.608   2.453  -1.470
  452    HA   GLU  63           HA       GLU  63  78.389   4.361   0.533
  453   1HB   GLU  63           HB2      GLU  63  79.299   3.607  -1.998
  454   2HB   GLU  63           HB1      GLU  63  78.789   5.284  -2.202
  455   1HG   GLU  63           HG2      GLU  63  80.695   4.242  -0.085
  456   2HG   GLU  63           HG1      GLU  63  81.135   5.209  -1.493
  457    H    GLU  64           HN       GLU  64  75.990   4.428  -2.067
  458    HA   GLU  64           HA       GLU  64  75.388   7.263  -1.612
  459   1HB   GLU  64           HB2      GLU  64  74.244   5.103  -3.373
  460   2HB   GLU  64           HB1      GLU  64  73.402   6.640  -3.172
  461   1HG   GLU  64           HG2      GLU  64  75.795   7.650  -3.684
  462   2HG   GLU  64           HG1      GLU  64  76.051   6.086  -4.459
  463    H    VAL  65           HN       VAL  65  74.466   4.282  -0.209
  464    HA   VAL  65           HA       VAL  65  71.885   5.374   0.768
  465    HB   VAL  65           HB       VAL  65  73.146   2.654   1.234
  466   1HG1  VAL  65          HG12      VAL  65  70.836   4.012   2.340
  467   2HG1  VAL  65          HG11      VAL  65  70.340   2.574   1.449
  468   3HG1  VAL  65          HG13      VAL  65  71.507   2.438   2.766
  469   1HG2  VAL  65          HG21      VAL  65  72.240   3.613  -1.159
  470   2HG2  VAL  65          HG23      VAL  65  72.168   1.915  -0.692
  471   3HG2  VAL  65          HG22      VAL  65  70.754   2.949  -0.483
  472    H    ASP  66           HN       ASP  66  75.161   4.945   1.761
  473    HA   ASP  66           HA       ASP  66  74.519   5.092   4.634
  474   1HB   ASP  66           HB2      ASP  66  76.906   4.549   2.991
  475   2HB   ASP  66           HB1      ASP  66  77.229   5.499   4.443
  476    H    GLU  67           HN       GLU  67  73.339   7.239   4.017
  477    HA   GLU  67           HA       GLU  67  74.857   9.572   3.362
  478   1HB   GLU  67           HB2      GLU  67  72.930  10.833   4.112
  479   2HB   GLU  67           HB1      GLU  67  72.348   9.389   3.283
  480   1HG   GLU  67           HG2      GLU  67  72.630   8.507   5.884
  481   2HG   GLU  67           HG1      GLU  67  72.067  10.165   6.101
  482    H    ASP  68           HN       ASP  68  74.325   7.866   6.381
  483    HA   ASP  68           HA       ASP  68  75.723  10.042   7.857
  484   1HB   ASP  68           HB2      ASP  68  75.066   8.512   9.862
  485   2HB   ASP  68           HB1      ASP  68  73.795   9.439   9.065
  486    H    GLY  69           HN       GLY  69  76.499   7.300   6.186
  487   1HA   GLY  69           HA2      GLY  69  78.351   5.859   6.217
  488   2HA   GLY  69           HA1      GLY  69  79.175   7.171   7.062
  489    H    SER  70           HN       SER  70  76.327   5.414   8.230
  490    HA   SER  70           HA       SER  70  77.642   4.915  10.780
  491   1HB   SER  70           HB2      SER  70  75.539   3.846  11.411
  492   2HB   SER  70           HB1      SER  70  75.197   5.360  10.579
  493    HG   SER  70           HG       SER  70  74.110   3.212   9.950
  494    H    GLY  71           HN       GLY  71  77.190   3.152   7.812
  495   1HA   GLY  71           HA2      GLY  71  78.539   1.230   7.245
  496   2HA   GLY  71           HA1      GLY  71  78.771   0.920   8.966
  497    H    THR  72           HN       THR  72  75.559   1.669   8.508
  498    HA   THR  72           HA       THR  72  74.782  -1.132   7.871
  499    HB   THR  72           HB       THR  72  73.081  -0.895   9.806
  500    HG1  THR  72           HG1      THR  72  73.363   1.225  10.327
  501   1HG2  THR  72          HG21      THR  72  75.490  -2.115   9.634
  502   2HG2  THR  72          HG23      THR  72  75.799  -1.025  10.985
  503   3HG2  THR  72          HG22      THR  72  74.474  -2.187  11.074
  504    H    ILE  73           HN       ILE  73  72.223  -1.164   7.766
  505    HA   ILE  73           HA       ILE  73  71.337   1.383   6.468
  506    HB   ILE  73           HB       ILE  73  70.452  -1.396   5.662
  507   1HG1  ILE  73          HG12      ILE  73  72.954  -0.889   5.330
  508   2HG1  ILE  73          HG11      ILE  73  72.048  -1.365   3.894
  509   1HG2  ILE  73          HG22      ILE  73  70.049   1.399   4.621
  510   2HG2  ILE  73          HG21      ILE  73  69.938   0.019   3.528
  511   3HG2  ILE  73          HG23      ILE  73  68.848   0.139   4.910
  512   1HD1  ILE  73          HD13      ILE  73  72.027   1.535   4.443
  513   2HD1  ILE  73          HD12      ILE  73  73.616   0.877   4.054
  514   3HD1  ILE  73          HD11      ILE  73  72.279   0.679   2.920
  515    H    ASP  74           HN       ASP  74  69.449   2.194   7.248
  516    HA   ASP  74           HA       ASP  74  67.863   0.453   9.092
  517   1HB   ASP  74           HB2      ASP  74  68.302   3.449   9.027
  518   2HB   ASP  74           HB1      ASP  74  67.024   2.700   9.984
  519    H    PHE  75           HN       PHE  75  65.475   0.853   9.020
  520    HA   PHE  75           HA       PHE  75  64.335   0.567   6.514
  521   1HB   PHE  75           HB2      PHE  75  63.204   0.451   8.833
  522   2HB   PHE  75           HB1      PHE  75  62.936   2.185   8.644
  523    HD1  PHE  75           HD2      PHE  75  62.822  -0.710   6.263
  524    HD2  PHE  75           HD1      PHE  75  60.727   2.601   8.018
  525    HE1  PHE  75           HE2      PHE  75  60.873  -1.168   4.799
  526    HE2  PHE  75           HE1      PHE  75  58.777   2.145   6.555
  527    HZ   PHE  75           HZ       PHE  75  58.850   0.258   4.946
  528    H    GLU  76           HN       GLU  76  65.197   3.595   8.130
  529    HA   GLU  76           HA       GLU  76  63.924   5.368   6.285
  530   1HB   GLU  76           HB2      GLU  76  66.510   5.867   7.788
  531   2HB   GLU  76           HB1      GLU  76  65.375   7.079   7.192
  532   1HG   GLU  76           HG2      GLU  76  64.144   6.910   9.066
  533   2HG   GLU  76           HG1      GLU  76  63.968   5.171   8.832
  534    H    GLU  77           HN       GLU  77  67.244   4.047   6.354
  535    HA   GLU  77           HA       GLU  77  67.977   5.324   3.850
  536   1HB   GLU  77           HB2      GLU  77  69.243   3.047   5.404
  537   2HB   GLU  77           HB1      GLU  77  69.965   3.801   3.982
  538   1HG   GLU  77           HG2      GLU  77  69.970   5.981   5.124
  539   2HG   GLU  77           HG1      GLU  77  69.223   5.247   6.543
  540    H    PHE  78           HN       PHE  78  66.138   2.558   4.648
  541    HA   PHE  78           HA       PHE  78  66.766   0.864   2.420
  542   1HB   PHE  78           HB2      PHE  78  65.120   0.680   4.626
  543   2HB   PHE  78           HB1      PHE  78  63.962   0.829   3.306
  544    HD1  PHE  78           HD1      PHE  78  66.875  -1.119   4.541
  545    HD2  PHE  78           HD2      PHE  78  63.619  -0.945   1.746
  546    HE1  PHE  78           HE1      PHE  78  67.283  -3.485   3.919
  547    HE2  PHE  78           HE2      PHE  78  64.026  -3.311   1.123
  548    HZ   PHE  78           HZ       PHE  78  65.858  -4.582   2.211
  549    H    LEU  79           HN       LEU  79  63.973   3.051   2.898
  550    HA   LEU  79           HA       LEU  79  62.833   2.926   0.371
  551   1HB   LEU  79           HB2      LEU  79  63.253   5.477   1.960
  552   2HB   LEU  79           HB1      LEU  79  62.012   5.200   0.739
  553    HG   LEU  79           HG       LEU  79  62.288   3.653   3.335
  554   1HD1  LEU  79          HD11      LEU  79  61.518   6.031   3.569
  555   2HD1  LEU  79          HD13      LEU  79  60.177   5.655   2.487
  556   3HD1  LEU  79          HD12      LEU  79  60.302   4.847   4.049
  557   1HD2  LEU  79          HD22      LEU  79  61.339   2.392   1.375
  558   2HD2  LEU  79          HD21      LEU  79  60.191   2.608   2.697
  559   3HD2  LEU  79          HD23      LEU  79  60.079   3.620   1.256
  560    H    VAL  80           HN       VAL  80  65.825   4.504   1.311
  561    HA   VAL  80           HA       VAL  80  66.166   6.026  -1.121
  562    HB   VAL  80           HB       VAL  80  68.205   5.019   0.890
  563   1HG1  VAL  80          HG13      VAL  80  68.396   6.901  -1.464
  564   2HG1  VAL  80          HG12      VAL  80  69.524   6.995  -0.112
  565   3HG1  VAL  80          HG11      VAL  80  69.428   5.523  -1.076
  566   1HG2  VAL  80          HG21      VAL  80  66.186   6.952   1.130
  567   2HG2  VAL  80          HG23      VAL  80  67.592   6.767   2.180
  568   3HG2  VAL  80          HG22      VAL  80  67.654   7.876   0.809
  569    H    MET  81           HN       MET  81  67.573   2.925  -0.009
  570    HA   MET  81           HA       MET  81  69.033   2.336  -2.352
  571   1HB   MET  81           HB2      MET  81  69.011   1.082  -0.107
  572   2HB   MET  81           HB1      MET  81  67.597   0.231  -0.733
  573   1HG   MET  81           HG2      MET  81  68.827  -0.668  -2.569
  574   2HG   MET  81           HG1      MET  81  70.185   0.417  -2.276
  575   1HE   MET  81           HE1      MET  81  70.919   0.740   0.053
  576   2HE   MET  81           HE3      MET  81  70.181  -0.193   1.361
  577   3HE   MET  81           HE2      MET  81  71.811  -0.574   0.812
  578    H    MET  82           HN       MET  82  65.588   2.043  -1.696
  579    HA   MET  82           HA       MET  82  65.012   0.362  -3.965
  580   1HB   MET  82           HB2      MET  82  63.346   0.276  -2.344
  581   2HB   MET  82           HB1      MET  82  63.454   1.999  -1.995
  582   1HG   MET  82           HG2      MET  82  61.901   2.510  -3.531
  583   2HG   MET  82           HG1      MET  82  62.628   1.460  -4.743
  584   1HE   MET  82           HE3      MET  82  62.995  -0.883  -4.038
  585   2HE   MET  82           HE2      MET  82  62.141  -1.690  -2.725
  586   3HE   MET  82           HE1      MET  82  61.550  -1.843  -4.377
  587    H    VAL  83           HN       VAL  83  64.691   3.880  -3.357
  588    HA   VAL  83           HA       VAL  83  63.869   4.463  -6.066
  589    HB   VAL  83           HB       VAL  83  65.189   6.357  -4.104
  590   1HG1  VAL  83          HG12      VAL  83  64.024   6.603  -6.744
  591   2HG1  VAL  83          HG11      VAL  83  63.129   7.581  -5.582
  592   3HG1  VAL  83          HG13      VAL  83  64.864   7.822  -5.785
  593   1HG2  VAL  83          HG22      VAL  83  62.579   5.007  -4.047
  594   2HG2  VAL  83          HG21      VAL  83  63.420   5.877  -2.764
  595   3HG2  VAL  83          HG23      VAL  83  62.461   6.763  -3.949
  596    H    ARG  84           HN       ARG  84  66.871   3.656  -4.672
  597    HA   ARG  84           HA       ARG  84  68.676   5.197  -6.247
  598   1HB   ARG  84           HB2      ARG  84  68.872   3.122  -4.365
  599   2HB   ARG  84           HB1      ARG  84  69.622   2.483  -5.827
  600   1HG   ARG  84           HG2      ARG  84  71.435   3.591  -4.910
  601   2HG   ARG  84           HG1      ARG  84  70.748   4.891  -5.885
  602   1HD   ARG  84           HD2      ARG  84  69.906   4.464  -3.018
  603   2HD   ARG  84           HD1      ARG  84  71.319   5.436  -3.427
  604    HE   ARG  84           HE       ARG  84  68.514   6.162  -3.945
  605   1HH1  ARG  84          HH11      ARG  84  71.398   7.472  -3.157
  606   2HH1  ARG  84          HH12      ARG  84  71.401   8.731  -4.347
  607   1HH2  ARG  84          HH21      ARG  84  68.705   7.441  -6.105
  608   2HH2  ARG  84          HH22      ARG  84  69.876   8.714  -6.017
  609    H    GLN  85           HN       GLN  85  67.029   2.116  -6.911
  610    HA   GLN  85           HA       GLN  85  68.239   2.064  -9.621
  611   1HB   GLN  85           HB2      GLN  85  66.747   0.086  -7.922
  612   2HB   GLN  85           HB1      GLN  85  66.780  -0.132  -9.673
  613   1HG   GLN  85           HG2      GLN  85  69.195   0.117  -7.855
  614   2HG   GLN  85           HG1      GLN  85  68.642  -1.353  -8.659
  615   1HE2  GLN  85          HE22      GLN  85  69.368   0.583 -11.903
  616   2HE2  GLN  85          HE21      GLN  85  67.889   0.274 -11.129
  617    H    MET  86           HN       MET  86  64.986   1.918  -8.127
  618    HA   MET  86           HA       MET  86  63.389   2.019 -10.394
  619   1HB   MET  86           HB2      MET  86  63.134   3.093  -7.633
  620   2HB   MET  86           HB1      MET  86  62.024   3.754  -8.834
  621   1HG   MET  86           HG2      MET  86  62.027   1.007  -9.343
  622   2HG   MET  86           HG1      MET  86  62.032   1.121  -7.583
  623   1HE   MET  86           HE2      MET  86  60.698   1.791  -6.234
  624   2HE   MET  86           HE1      MET  86  59.589   3.147  -6.422
  625   3HE   MET  86           HE3      MET  86  58.978   1.488  -6.467
  626    H    LYS  87           HN       LYS  87  65.165   4.709  -8.905
  627    HA   LYS  87           HA       LYS  87  64.145   6.883 -10.322
  628   1HB   LYS  87           HB2      LYS  87  66.752   6.204  -9.112
  629   2HB   LYS  87           HB1      LYS  87  66.827   7.434 -10.374
  630   1HG   LYS  87           HG2      LYS  87  64.749   7.587  -8.196
  631   2HG   LYS  87           HG1      LYS  87  66.376   8.219  -7.941
  632   1HD   LYS  87           HD2      LYS  87  65.110   9.018 -10.492
  633   2HD   LYS  87           HD1      LYS  87  64.346   9.669  -9.042
  634   1HE   LYS  87           HE2      LYS  87  65.965  11.276  -9.290
  635   2HE   LYS  87           HE1      LYS  87  66.930  10.098  -8.400
  636   1HZ   LYS  87           HZ3      LYS  87  67.207   9.218 -10.904
  637   2HZ   LYS  87           HZ2      LYS  87  67.072  10.889 -11.184
  638   3HZ   LYS  87           HZ1      LYS  87  68.288  10.290 -10.157
  639    H    GLU  88           HN       GLU  88  66.998   4.986 -11.395
  640    HA   GLU  88           HA       GLU  88  66.007   5.162 -14.177
  641   1HB   GLU  88           HB2      GLU  88  68.452   6.544 -13.125
  642   2HB   GLU  88           HB1      GLU  88  68.493   5.872 -14.755
  643   1HG   GLU  88           HG2      GLU  88  66.181   7.099 -15.014
  644   2HG   GLU  88           HG1      GLU  88  66.762   8.067 -13.658
  645    H    ASP  89           HN       ASP  89  66.322   3.193 -15.093
  646    HA   ASP  89           HA       ASP  89  68.356   1.393 -13.861
  647   1HB   ASP  89           HB2      ASP  89  65.729   0.963 -15.218
  648   2HB   ASP  89           HB1      ASP  89  66.960  -0.286 -15.405
  649    H    ALA  90           HN       ALA  90  69.626   3.138 -15.416
  650    HA   ALA  90           HA       ALA  90  71.001   3.340 -17.306
  651   1HB   ALA  90           HB1      ALA  90  70.532   0.393 -17.038
  652   2HB   ALA  90           HB3      ALA  90  71.326   0.990 -18.495
  653   3HB   ALA  90           HB2      ALA  90  72.038   1.301 -16.911
   
  No H/Q in entry =         653
  Start of MODEL    8
    1   1H    ALA   1           HT1      ALA   1  70.097  12.468  14.185
    2   2H    ALA   1           HT3      ALA   1  71.140  13.602  14.893
    3   3H    ALA   1           HT2      ALA   1  70.295  12.501  15.873
    4    HA   ALA   1           HA       ALA   1  68.213  13.517  15.368
    5   1HB   ALA   1           HB2      ALA   1  70.229  14.691  16.848
    6   2HB   ALA   1           HB1      ALA   1  69.729  16.001  15.779
    7   3HB   ALA   1           HB3      ALA   1  68.546  15.220  16.828
    8    H    SER   2           HN       SER   2  68.403  13.110  12.861
    9    HA   SER   2           HA       SER   2  67.571  15.457  11.512
   10   1HB   SER   2           HB2      SER   2  69.587  15.732   9.989
   11   2HB   SER   2           HB1      SER   2  69.818  16.294  11.643
   12    HG   SER   2           HG       SER   2  71.150  14.670  12.019
   13    H    MET   3           HN       MET   3  67.611  15.050   9.022
   14    HA   MET   3           HA       MET   3  67.706  12.151   8.383
   15   1HB   MET   3           HB2      MET   3  65.416  12.907   7.065
   16   2HB   MET   3           HB1      MET   3  65.446  12.036   8.596
   17   1HG   MET   3           HG2      MET   3  63.980  13.977   8.802
   18   2HG   MET   3           HG1      MET   3  65.413  14.225   9.799
   19   1HE   MET   3           HE1      MET   3  63.887  14.367   6.559
   20   2HE   MET   3           HE3      MET   3  63.512  16.094   6.487
   21   3HE   MET   3           HE2      MET   3  64.859  15.443   5.556
   22    H    THR   4           HN       THR   4  69.351  12.397   6.880
   23    HA   THR   4           HA       THR   4  69.839  14.509   5.133
   24    HB   THR   4           HB       THR   4  70.946  12.873   3.659
   25    HG1  THR   4           HG1      THR   4  70.721  10.614   4.566
   26   1HG2  THR   4          HG21      THR   4  71.582  13.435   6.258
   27   2HG2  THR   4          HG23      THR   4  71.544  11.672   6.285
   28   3HG2  THR   4          HG22      THR   4  72.611  12.513   5.161
   29    H    ASP   5           HN       ASP   5  69.264  14.854   2.873
   30    HA   ASP   5           HA       ASP   5  66.448  14.526   2.364
   31   1HB   ASP   5           HB2      ASP   5  68.693  15.310   0.479
   32   2HB   ASP   5           HB1      ASP   5  66.970  15.503   0.149
   33    H    GLN   6           HN       GLN   6  69.038  12.385   2.027
   34    HA   GLN   6           HA       GLN   6  68.388  11.013  -0.385
   35   1HB   GLN   6           HB2      GLN   6  69.576   9.946   2.195
   36   2HB   GLN   6           HB1      GLN   6  69.560   9.077   0.659
   37   1HG   GLN   6           HG2      GLN   6  70.701  11.858   0.802
   38   2HG   GLN   6           HG1      GLN   6  71.680  10.474   1.296
   39   1HE2  GLN   6          HE22      GLN   6  71.371   9.019  -2.110
   40   2HE2  GLN   6          HE21      GLN   6  71.016   8.511  -0.529
   41    H    GLN   7           HN       GLN   7  67.354  10.349   2.977
   42    HA   GLN   7           HA       GLN   7  65.476   8.293   2.099
   43   1HB   GLN   7           HB2      GLN   7  64.792   8.232   4.460
   44   2HB   GLN   7           HB1      GLN   7  66.551   8.212   4.333
   45   1HG   GLN   7           HG2      GLN   7  66.128  10.885   4.428
   46   2HG   GLN   7           HG1      GLN   7  64.757  10.328   5.387
   47   1HE2  GLN   7          HE22      GLN   7  68.534   9.417   6.762
   48   2HE2  GLN   7          HE21      GLN   7  68.277   9.541   5.089
   49    H    ALA   8           HN       ALA   8  65.401  11.730   2.541
   50    HA   ALA   8           HA       ALA   8  62.545  11.990   2.920
   51   1HB   ALA   8           HB3      ALA   8  64.741  13.716   2.952
   52   2HB   ALA   8           HB2      ALA   8  63.794  14.248   1.562
   53   3HB   ALA   8           HB1      ALA   8  63.051  14.178   3.160
   54    H    GLU   9           HN       GLU   9  64.404  13.093   0.072
   55    HA   GLU   9           HA       GLU   9  62.295  13.226  -1.736
   56   1HB   GLU   9           HB2      GLU   9  65.179  12.424  -2.168
   57   2HB   GLU   9           HB1      GLU   9  64.049  12.647  -3.504
   58   1HG   GLU   9           HG2      GLU   9  63.568  14.939  -2.205
   59   2HG   GLU   9           HG1      GLU   9  65.225  14.673  -1.656
   60    H    ALA  10           HN       ALA  10  64.290  10.352  -1.007
   61    HA   ALA  10           HA       ALA  10  63.107   8.554  -2.822
   62   1HB   ALA  10           HB2      ALA  10  64.984   8.343  -0.835
   63   2HB   ALA  10           HB1      ALA  10  63.644   7.427  -0.147
   64   3HB   ALA  10           HB3      ALA  10  64.311   6.970  -1.714
   65    H    ARG  11           HN       ARG  11  62.061   9.386   0.488
   66    HA   ARG  11           HA       ARG  11  59.782   7.619   0.460
   67   1HB   ARG  11           HB2      ARG  11  61.019   9.404   2.301
   68   2HB   ARG  11           HB1      ARG  11  59.325   9.883   2.164
   69   1HG   ARG  11           HG2      ARG  11  58.632   7.549   2.589
   70   2HG   ARG  11           HG1      ARG  11  60.326   7.077   2.742
   71   1HD   ARG  11           HD2      ARG  11  59.308   7.455   4.961
   72   2HD   ARG  11           HD1      ARG  11  60.593   8.621   4.643
   73    HE   ARG  11           HE       ARG  11  58.367   9.964   3.780
   74   1HH1  ARG  11          HH11      ARG  11  59.953   9.832   6.594
   75   2HH1  ARG  11          HH12      ARG  11  58.594  10.053   7.644
   76   1HH2  ARG  11          HH21      ARG  11  56.245   9.548   5.143
   77   2HH2  ARG  11          HH22      ARG  11  56.494   9.892   6.822
   78    H    ALA  12           HN       ALA  12  60.367  10.808  -0.806
   79    HA   ALA  12           HA       ALA  12  57.615  11.656  -0.961
   80   1HB   ALA  12           HB1      ALA  12  59.899  12.980  -1.295
   81   2HB   ALA  12           HB3      ALA  12  59.623  12.562  -2.986
   82   3HB   ALA  12           HB2      ALA  12  58.421  13.503  -2.102
   83    H    PHE  13           HN       PHE  13  59.744   9.828  -3.121
   84    HA   PHE  13           HA       PHE  13  57.749   9.759  -5.263
   85   1HB   PHE  13           HB2      PHE  13  60.110   9.673  -5.859
   86   2HB   PHE  13           HB1      PHE  13  60.340   8.236  -4.860
   87    HD1  PHE  13           HD1      PHE  13  58.202   9.480  -7.683
   88    HD2  PHE  13           HD2      PHE  13  60.174   6.131  -5.853
   89    HE1  PHE  13           HE1      PHE  13  57.530   8.042  -9.588
   90    HE2  PHE  13           HE2      PHE  13  59.501   4.692  -7.757
   91    HZ   PHE  13           HZ       PHE  13  58.179   5.649  -9.626
   92    H    LEU  14           HN       LEU  14  58.722   7.728  -2.566
   93    HA   LEU  14           HA       LEU  14  57.050   5.488  -3.507
   94   1HB   LEU  14           HB2      LEU  14  58.495   5.819  -0.862
   95   2HB   LEU  14           HB1      LEU  14  57.852   4.319  -1.533
   96    HG   LEU  14           HG       LEU  14  59.986   5.991  -2.888
   97   1HD1  LEU  14          HD12      LEU  14  60.139   4.062  -0.694
   98   2HD1  LEU  14          HD11      LEU  14  61.114   3.580  -2.082
   99   3HD1  LEU  14          HD13      LEU  14  61.380   5.148  -1.318
  100   1HD2  LEU  14          HD23      LEU  14  58.593   4.528  -4.348
  101   2HD2  LEU  14          HD22      LEU  14  60.271   3.987  -4.275
  102   3HD2  LEU  14          HD21      LEU  14  59.031   3.145  -3.344
  103    H    SER  15           HN       SER  15  54.915   5.366  -3.025
  104    HA   SER  15           HA       SER  15  53.713   7.304  -1.191
  105   1HB   SER  15           HB2      SER  15  52.462   4.966  -2.664
  106   2HB   SER  15           HB1      SER  15  51.586   6.256  -1.848
  107    HG   SER  15           HG       SER  15  51.707   7.022  -3.849
  108    H    GLU  16           HN       GLU  16  52.331   6.603   0.640
  109    HA   GLU  16           HA       GLU  16  53.685   4.848   2.424
  110   1HB   GLU  16           HB2      GLU  16  50.912   6.029   2.381
  111   2HB   GLU  16           HB1      GLU  16  51.387   4.897   3.646
  112   1HG   GLU  16           HG2      GLU  16  51.962   6.954   4.599
  113   2HG   GLU  16           HG1      GLU  16  53.489   6.448   3.874
  114    H    GLU  17           HN       GLU  17  51.427   4.202  -0.117
  115    HA   GLU  17           HA       GLU  17  50.414   1.690   0.871
  116   1HB   GLU  17           HB2      GLU  17  50.035   3.314  -1.417
  117   2HB   GLU  17           HB1      GLU  17  50.562   1.739  -2.007
  118   1HG   GLU  17           HG2      GLU  17  48.126   1.754  -1.787
  119   2HG   GLU  17           HG1      GLU  17  48.821   0.659  -0.591
  120    H    MET  18           HN       MET  18  53.106   2.515  -1.327
  121    HA   MET  18           HA       MET  18  53.897  -0.279  -1.608
  122   1HB   MET  18           HB2      MET  18  55.134   2.354  -2.416
  123   2HB   MET  18           HB1      MET  18  55.999   0.832  -2.620
  124   1HG   MET  18           HG2      MET  18  53.304   0.527  -3.583
  125   2HG   MET  18           HG1      MET  18  54.036   1.943  -4.338
  126   1HE   MET  18           HE2      MET  18  56.512   1.931  -5.138
  127   2HE   MET  18           HE1      MET  18  56.826   0.801  -6.452
  128   3HE   MET  18           HE3      MET  18  55.345   1.767  -6.449
  129    H    ILE  19           HN       ILE  19  54.803   2.425   0.460
  130    HA   ILE  19           HA       ILE  19  57.215   1.229   1.493
  131    HB   ILE  19           HB       ILE  19  55.366   3.382   2.542
  132   1HG1  ILE  19          HG12      ILE  19  58.183   3.970   1.962
  133   2HG1  ILE  19          HG11      ILE  19  57.296   3.384   0.554
  134   1HG2  ILE  19          HG23      ILE  19  57.834   2.148   3.763
  135   2HG2  ILE  19          HG22      ILE  19  57.389   3.821   4.102
  136   3HG2  ILE  19          HG21      ILE  19  56.290   2.511   4.535
  137   1HD1  ILE  19          HD11      ILE  19  55.458   5.088   1.396
  138   2HD1  ILE  19          HD13      ILE  19  56.835   5.852   2.189
  139   3HD1  ILE  19          HD12      ILE  19  56.825   5.654   0.438
  140    H    ALA  20           HN       ALA  20  53.807   0.950   2.308
  141    HA   ALA  20           HA       ALA  20  54.076  -0.211   4.895
  142   1HB   ALA  20           HB1      ALA  20  51.988  -0.305   2.744
  143   2HB   ALA  20           HB3      ALA  20  51.858  -1.420   4.105
  144   3HB   ALA  20           HB2      ALA  20  51.870   0.321   4.389
  145    H    GLU  21           HN       GLU  21  54.210  -1.647   1.651
  146    HA   GLU  21           HA       GLU  21  54.447  -4.367   2.685
  147   1HB   GLU  21           HB2      GLU  21  54.435  -3.052   0.026
  148   2HB   GLU  21           HB1      GLU  21  55.367  -4.546   0.135
  149   1HG   GLU  21           HG2      GLU  21  53.486  -5.780   0.169
  150   2HG   GLU  21           HG1      GLU  21  52.851  -4.847   1.525
  151    H    PHE  22           HN       PHE  22  56.658  -1.825   1.621
  152    HA   PHE  22           HA       PHE  22  59.028  -3.432   1.511
  153   1HB   PHE  22           HB2      PHE  22  58.642  -0.481   2.096
  154   2HB   PHE  22           HB1      PHE  22  60.215  -1.234   1.843
  155    HD1  PHE  22           HD1      PHE  22  57.865  -2.995  -0.100
  156    HD2  PHE  22           HD2      PHE  22  60.061   0.698  -0.018
  157    HE1  PHE  22           HE1      PHE  22  57.578  -2.768  -2.552
  158    HE2  PHE  22           HE2      PHE  22  59.774   0.921  -2.469
  159    HZ   PHE  22           HZ       PHE  22  58.532  -0.811  -3.737
  160    H    LYS  23           HN       LYS  23  57.314  -1.887   4.168
  161    HA   LYS  23           HA       LYS  23  59.392  -2.083   6.130
  162   1HB   LYS  23           HB2      LYS  23  56.943  -0.963   6.140
  163   2HB   LYS  23           HB1      LYS  23  56.569  -2.461   6.992
  164   1HG   LYS  23           HG2      LYS  23  59.063  -1.238   7.912
  165   2HG   LYS  23           HG1      LYS  23  57.665  -0.185   8.140
  166   1HD   LYS  23           HD2      LYS  23  56.525  -1.804   9.456
  167   2HD   LYS  23           HD1      LYS  23  57.622  -3.093   8.958
  168   1HE   LYS  23           HE2      LYS  23  59.282  -1.122  10.070
  169   2HE   LYS  23           HE1      LYS  23  57.891  -1.213  11.151
  170   1HZ   LYS  23           HZ1      LYS  23  58.184  -3.607  11.271
  171   2HZ   LYS  23           HZ3      LYS  23  59.526  -3.516  10.237
  172   3HZ   LYS  23           HZ2      LYS  23  59.592  -2.803  11.778
  173    H    ALA  24           HN       ALA  24  57.368  -4.469   4.664
  174    HA   ALA  24           HA       ALA  24  57.568  -6.404   6.837
  175   1HB   ALA  24           HB1      ALA  24  56.613  -6.486   3.986
  176   2HB   ALA  24           HB3      ALA  24  56.865  -7.989   4.872
  177   3HB   ALA  24           HB2      ALA  24  55.709  -6.798   5.468
  178    H    ALA  25           HN       ALA  25  59.430  -5.580   3.978
  179    HA   ALA  25           HA       ALA  25  61.050  -8.006   4.056
  180   1HB   ALA  25           HB2      ALA  25  60.688  -5.802   2.279
  181   2HB   ALA  25           HB1      ALA  25  62.399  -5.876   2.702
  182   3HB   ALA  25           HB3      ALA  25  61.602  -7.284   1.998
  183    H    PHE  26           HN       PHE  26  61.299  -4.716   5.316
  184    HA   PHE  26           HA       PHE  26  64.033  -4.733   6.068
  185   1HB   PHE  26           HB2      PHE  26  62.278  -2.820   6.202
  186   2HB   PHE  26           HB1      PHE  26  61.896  -3.484   7.790
  187    HD1  PHE  26           HD1      PHE  26  64.886  -2.525   5.728
  188    HD2  PHE  26           HD2      PHE  26  63.096  -2.706   9.630
  189    HE1  PHE  26           HE1      PHE  26  66.859  -1.367   6.687
  190    HE2  PHE  26           HE2      PHE  26  65.069  -1.549  10.588
  191    HZ   PHE  26           HZ       PHE  26  66.950  -0.879   9.117
  192    H    ASP  27           HN       ASP  27  61.222  -5.473   8.175
  193    HA   ASP  27           HA       ASP  27  62.719  -6.457  10.363
  194   1HB   ASP  27           HB2      ASP  27  60.626  -7.744  10.928
  195   2HB   ASP  27           HB1      ASP  27  60.348  -6.033  10.603
  196    H    MET  28           HN       MET  28  62.205  -7.838   7.253
  197    HA   MET  28           HA       MET  28  62.608 -10.610   8.042
  198   1HB   MET  28           HB2      MET  28  61.863  -9.237   5.686
  199   2HB   MET  28           HB1      MET  28  63.361 -10.085   5.302
  200   1HG   MET  28           HG2      MET  28  62.025 -12.002   6.722
  201   2HG   MET  28           HG1      MET  28  60.688 -11.176   5.920
  202   1HE   MET  28           HE1      MET  28  64.208 -11.744   5.491
  203   2HE   MET  28           HE3      MET  28  64.272 -13.300   4.653
  204   3HE   MET  28           HE2      MET  28  64.445 -11.799   3.747
  205    H    PHE  29           HN       PHE  29  64.678  -8.074   6.618
  206    HA   PHE  29           HA       PHE  29  67.038  -9.800   6.703
  207   1HB   PHE  29           HB2      PHE  29  67.167  -6.810   6.428
  208   2HB   PHE  29           HB1      PHE  29  68.169  -8.041   5.657
  209    HD1  PHE  29           HD1      PHE  29  66.448  -9.891   4.404
  210    HD2  PHE  29           HD2      PHE  29  65.874  -5.662   4.872
  211    HE1  PHE  29           HE1      PHE  29  64.951  -9.876   2.427
  212    HE2  PHE  29           HE2      PHE  29  64.378  -5.644   2.893
  213    HZ   PHE  29           HZ       PHE  29  63.917  -7.753   1.669
  214    H    ASP  30           HN       ASP  30  65.322  -8.292   9.081
  215    HA   ASP  30           HA       ASP  30  67.631  -7.309  10.629
  216   1HB   ASP  30           HB2      ASP  30  64.666  -7.489  11.225
  217   2HB   ASP  30           HB1      ASP  30  65.850  -6.894  12.388
  218    H    ALA  31           HN       ALA  31  68.777  -9.349  10.821
  219    HA   ALA  31           HA       ALA  31  67.584 -11.701  11.962
  220   1HB   ALA  31           HB1      ALA  31  70.011 -11.109  10.812
  221   2HB   ALA  31           HB3      ALA  31  70.449 -11.294  12.510
  222   3HB   ALA  31           HB2      ALA  31  69.644 -12.612  11.658
  223    H    ASP  32           HN       ASP  32  69.479  -9.035  13.394
  224    HA   ASP  32           HA       ASP  32  69.115 -10.136  16.092
  225   1HB   ASP  32           HB2      ASP  32  70.618  -7.901  14.851
  226   2HB   ASP  32           HB1      ASP  32  70.069  -7.625  16.504
  227    H    GLY  33           HN       GLY  33  66.962  -8.818  14.113
  228   1HA   GLY  33           HA2      GLY  33  65.072  -7.427  14.364
  229   2HA   GLY  33           HA1      GLY  33  64.983  -8.207  15.943
  230    H    GLY  34           HN       GLY  34  67.635  -6.120  14.915
  231   1HA   GLY  34           HA2      GLY  34  67.152  -4.410  17.261
  232   2HA   GLY  34           HA1      GLY  34  68.534  -4.304  16.171
  233    H    GLY  35           HN       GLY  35  66.583  -4.347  13.833
  234   1HA   GLY  35           HA2      GLY  35  64.890  -2.776  12.977
  235   2HA   GLY  35           HA1      GLY  35  65.486  -1.585  14.134
  236    H    ASP  36           HN       ASP  36  67.869  -3.479  12.516
  237    HA   ASP  36           HA       ASP  36  68.217  -1.628  10.276
  238   1HB   ASP  36           HB2      ASP  36  69.967  -1.517  12.724
  239   2HB   ASP  36           HB1      ASP  36  70.632  -1.122  11.140
  240    H    ILE  37           HN       ILE  37  68.995  -2.874   8.645
  241    HA   ILE  37           HA       ILE  37  70.479  -5.347   9.398
  242    HB   ILE  37           HB       ILE  37  68.861  -6.252   8.105
  243   1HG1  ILE  37          HG12      ILE  37  71.050  -6.176   6.659
  244   2HG1  ILE  37          HG11      ILE  37  69.544  -6.709   5.923
  245   1HG2  ILE  37          HG23      ILE  37  68.534  -3.508   6.881
  246   2HG2  ILE  37          HG22      ILE  37  67.614  -4.910   6.335
  247   3HG2  ILE  37          HG21      ILE  37  67.444  -4.338   7.993
  248   1HD1  ILE  37          HD12      ILE  37  69.171  -4.406   5.065
  249   2HD1  ILE  37          HD11      ILE  37  70.723  -3.918   5.745
  250   3HD1  ILE  37          HD13      ILE  37  70.664  -5.111   4.449
  251    H    SER  38           HN       SER  38  72.346  -5.920   8.130
  252    HA   SER  38           HA       SER  38  74.019  -3.609   7.525
  253   1HB   SER  38           HB2      SER  38  75.794  -5.170   7.285
  254   2HB   SER  38           HB1      SER  38  74.771  -5.847   8.549
  255    HG   SER  38           HG       SER  38  73.711  -6.853   6.519
  256    H    THR  39           HN       THR  39  75.043  -3.228   5.432
  257    HA   THR  39           HA       THR  39  73.193  -3.432   3.233
  258    HB   THR  39           HB       THR  39  74.799  -2.256   1.959
  259    HG1  THR  39           HG1      THR  39  76.698  -3.297   3.789
  260   1HG2  THR  39          HG23      THR  39  74.456  -1.565   4.753
  261   2HG2  THR  39          HG22      THR  39  76.009  -0.986   4.150
  262   3HG2  THR  39          HG21      THR  39  74.515  -0.507   3.345
  263    H    LYS  40           HN       LYS  40  75.537  -5.581   4.512
  264    HA   LYS  40           HA       LYS  40  76.315  -6.965   2.133
  265   1HB   LYS  40           HB2      LYS  40  76.043  -7.867   5.012
  266   2HB   LYS  40           HB1      LYS  40  76.676  -8.911   3.739
  267   1HG   LYS  40           HG2      LYS  40  77.916  -6.270   3.700
  268   2HG   LYS  40           HG1      LYS  40  78.154  -7.090   5.243
  269   1HD   LYS  40           HD2      LYS  40  79.676  -8.466   4.322
  270   2HD   LYS  40           HD1      LYS  40  78.513  -8.975   3.095
  271   1HE   LYS  40           HE2      LYS  40  79.096  -7.091   1.681
  272   2HE   LYS  40           HE1      LYS  40  80.134  -6.417   2.938
  273   1HZ   LYS  40           HZ3      LYS  40  81.529  -8.387   2.786
  274   2HZ   LYS  40           HZ2      LYS  40  80.533  -9.023   1.567
  275   3HZ   LYS  40           HZ1      LYS  40  81.425  -7.604   1.286
  276    H    ALA  41           HN       ALA  41  73.418  -7.061   4.104
  277    HA   ALA  41           HA       ALA  41  72.395  -9.443   2.691
  278   1HB   ALA  41           HB2      ALA  41  71.897  -8.244   5.204
  279   2HB   ALA  41           HB1      ALA  41  70.408  -8.069   4.277
  280   3HB   ALA  41           HB3      ALA  41  71.107  -9.668   4.527
  281    H    LEU  42           HN       LEU  42  72.317  -6.011   2.399
  282    HA   LEU  42           HA       LEU  42  69.849  -5.433   1.260
  283   1HB   LEU  42           HB2      LEU  42  72.573  -4.369   0.987
  284   2HB   LEU  42           HB1      LEU  42  71.576  -4.104  -0.442
  285    HG   LEU  42           HG       LEU  42  71.292  -2.227   1.087
  286   1HD1  LEU  42          HD11      LEU  42  69.227  -3.814   0.063
  287   2HD1  LEU  42          HD13      LEU  42  68.739  -3.472   1.723
  288   3HD1  LEU  42          HD12      LEU  42  69.088  -2.145   0.614
  289   1HD2  LEU  42          HD21      LEU  42  71.526  -4.249   3.055
  290   2HD2  LEU  42          HD23      LEU  42  71.326  -2.518   3.320
  291   3HD2  LEU  42          HD22      LEU  42  69.910  -3.567   3.237
  292    H    GLY  43           HN       GLY  43  72.576  -7.133  -0.229
  293   1HA   GLY  43           HA2      GLY  43  71.686  -7.238  -2.896
  294   2HA   GLY  43           HA1      GLY  43  72.624  -8.519  -2.126
  295    H    THR  44           HN       THR  44  70.902  -9.486  -0.223
  296    HA   THR  44           HA       THR  44  69.087 -11.081  -1.792
  297    HB   THR  44           HB       THR  44  69.382 -10.672   1.195
  298    HG1  THR  44           HG1      THR  44  69.913 -12.955  -0.377
  299   1HG2  THR  44          HG22      THR  44  67.290 -12.024  -0.371
  300   2HG2  THR  44          HG21      THR  44  68.043 -13.049   0.851
  301   3HG2  THR  44          HG23      THR  44  67.286 -11.528   1.322
  302    H    VAL  45           HN       VAL  45  68.707  -8.205   0.224
  303    HA   VAL  45           HA       VAL  45  65.876  -8.122   0.351
  304    HB   VAL  45           HB       VAL  45  67.825  -5.804   0.125
  305   1HG1  VAL  45          HG13      VAL  45  64.915  -6.031   0.862
  306   2HG1  VAL  45          HG12      VAL  45  65.910  -4.749   1.554
  307   3HG1  VAL  45          HG11      VAL  45  65.703  -4.859  -0.194
  308   1HG2  VAL  45          HG23      VAL  45  66.972  -7.618   2.348
  309   2HG2  VAL  45          HG22      VAL  45  68.545  -6.883   2.043
  310   3HG2  VAL  45          HG21      VAL  45  67.239  -5.917   2.726
  311    H    MET  46           HN       MET  46  68.112  -7.153  -2.211
  312    HA   MET  46           HA       MET  46  66.165  -5.810  -3.849
  313   1HB   MET  46           HB2      MET  46  68.911  -6.913  -4.229
  314   2HB   MET  46           HB1      MET  46  67.946  -6.639  -5.679
  315   1HG   MET  46           HG2      MET  46  67.682  -4.396  -3.875
  316   2HG   MET  46           HG1      MET  46  69.385  -4.710  -4.209
  317   1HE   MET  46           HE3      MET  46  69.491  -2.334  -5.265
  318   2HE   MET  46           HE2      MET  46  68.464  -1.766  -6.577
  319   3HE   MET  46           HE1      MET  46  67.759  -2.092  -4.996
  320    H    ARG  47           HN       ARG  47  67.684  -9.011  -4.396
  321    HA   ARG  47           HA       ARG  47  65.817  -9.879  -6.342
  322   1HB   ARG  47           HB2      ARG  47  67.987 -11.026  -4.837
  323   2HB   ARG  47           HB1      ARG  47  66.634 -12.157  -4.864
  324   1HG   ARG  47           HG2      ARG  47  66.583 -11.387  -7.441
  325   2HG   ARG  47           HG1      ARG  47  68.299 -11.142  -7.114
  326   1HD   ARG  47           HD2      ARG  47  66.911 -13.699  -6.320
  327   2HD   ARG  47           HD1      ARG  47  67.564 -13.481  -7.943
  328    HE   ARG  47           HE       ARG  47  69.572 -12.793  -6.022
  329   1HH1  ARG  47          HH11      ARG  47  69.161 -14.888  -8.443
  330   2HH1  ARG  47          HH12      ARG  47  69.829 -16.284  -7.666
  331   1HH2  ARG  47          HH21      ARG  47  69.857 -14.843  -4.511
  332   2HH2  ARG  47          HH22      ARG  47  70.220 -16.260  -5.439
  333    H    MET  48           HN       MET  48  65.440  -9.466  -2.960
  334    HA   MET  48           HA       MET  48  63.388 -11.459  -2.530
  335   1HB   MET  48           HB2      MET  48  64.395  -9.057  -1.043
  336   2HB   MET  48           HB1      MET  48  62.844  -9.755  -0.574
  337   1HG   MET  48           HG2      MET  48  65.271 -11.504  -0.934
  338   2HG   MET  48           HG1      MET  48  64.987 -10.656   0.587
  339   1HE   MET  48           HE2      MET  48  63.039 -10.859   2.056
  340   2HE   MET  48           HE1      MET  48  61.843 -10.558   0.797
  341   3HE   MET  48           HE3      MET  48  61.667 -11.950   1.875
  342    H    LEU  49           HN       LEU  49  63.379  -8.038  -3.466
  343    HA   LEU  49           HA       LEU  49  60.435  -7.972  -3.523
  344   1HB   LEU  49           HB2      LEU  49  62.028  -5.807  -4.804
  345   2HB   LEU  49           HB1      LEU  49  60.633  -5.691  -3.733
  346    HG   LEU  49           HG       LEU  49  63.512  -6.223  -2.975
  347   1HD1  LEU  49          HD11      LEU  49  61.670  -3.957  -2.888
  348   2HD1  LEU  49          HD13      LEU  49  62.357  -4.316  -1.303
  349   3HD1  LEU  49          HD12      LEU  49  63.421  -3.986  -2.672
  350   1HD2  LEU  49          HD21      LEU  49  61.020  -7.072  -1.671
  351   2HD2  LEU  49          HD23      LEU  49  62.677  -7.590  -1.367
  352   3HD2  LEU  49          HD22      LEU  49  62.063  -6.114  -0.621
  353    H    GLY  50           HN       GLY  50  63.082  -7.621  -5.910
  354   1HA   GLY  50           HA2      GLY  50  62.077  -9.300  -7.884
  355   2HA   GLY  50           HA1      GLY  50  61.264  -7.760  -8.167
  356    H    GLN  51           HN       GLN  51  63.608  -6.230  -7.146
  357    HA   GLN  51           HA       GLN  51  64.945  -5.777  -9.616
  358   1HB   GLN  51           HB2      GLN  51  65.967  -5.180  -6.822
  359   2HB   GLN  51           HB1      GLN  51  66.509  -4.416  -8.317
  360   1HG   GLN  51           HG2      GLN  51  63.763  -4.083  -8.420
  361   2HG   GLN  51           HG1      GLN  51  64.121  -3.869  -6.705
  362   1HE2  GLN  51          HE22      GLN  51  65.546  -0.689  -7.185
  363   2HE2  GLN  51          HE21      GLN  51  64.938  -1.846  -6.101
  364    H    ASN  52           HN       ASN  52  66.969  -6.481 -10.388
  365    HA   ASN  52           HA       ASN  52  68.533  -8.395  -8.775
  366   1HB   ASN  52           HB2      ASN  52  66.588  -9.472 -10.320
  367   2HB   ASN  52           HB1      ASN  52  67.889  -9.371 -11.507
  368   1HD2  ASN  52          HD22      ASN  52  68.376 -12.627  -9.839
  369   2HD2  ASN  52          HD21      ASN  52  67.265 -11.928 -10.917
  370    HA   PRO  53           HA       PRO  53  70.862  -5.699 -11.779
  371   1HB   PRO  53           HB2      PRO  53  72.139  -4.171  -9.886
  372   2HB   PRO  53           HB1      PRO  53  70.578  -3.737 -10.605
  373   1HG   PRO  53           HG2      PRO  53  71.155  -4.812  -7.884
  374   2HG   PRO  53           HG1      PRO  53  69.804  -3.805  -8.429
  375   1HD   PRO  53           HD2      PRO  53  69.713  -6.597  -7.966
  376   2HD   PRO  53           HD1      PRO  53  68.482  -5.638  -8.815
  377    H    THR  54           HN       THR  54  73.454  -5.129 -11.246
  378    HA   THR  54           HA       THR  54  74.614  -7.800 -10.703
  379    HB   THR  54           HB       THR  54  76.750  -6.369 -11.438
  380    HG1  THR  54           HG1      THR  54  75.986  -4.811 -12.985
  381   1HG2  THR  54          HG22      THR  54  75.556  -8.314 -12.600
  382   2HG2  THR  54          HG21      THR  54  74.658  -7.088 -13.495
  383   3HG2  THR  54          HG23      THR  54  76.412  -7.182 -13.648
  384    H    LYS  55           HN       LYS  55  76.157  -8.153  -9.072
  385    HA   LYS  55           HA       LYS  55  75.900  -6.756  -6.636
  386   1HB   LYS  55           HB2      LYS  55  77.180  -9.034  -7.404
  387   2HB   LYS  55           HB1      LYS  55  78.557  -7.959  -7.156
  388   1HG   LYS  55           HG2      LYS  55  78.085  -7.652  -4.892
  389   2HG   LYS  55           HG1      LYS  55  76.381  -8.067  -5.089
  390   1HD   LYS  55           HD2      LYS  55  77.852 -10.341  -5.913
  391   2HD   LYS  55           HD1      LYS  55  78.588  -9.793  -4.407
  392   1HE   LYS  55           HE2      LYS  55  76.540  -9.959  -3.218
  393   2HE   LYS  55           HE1      LYS  55  75.596 -10.065  -4.702
  394   1HZ   LYS  55           HZ3      LYS  55  77.412 -12.134  -4.815
  395   2HZ   LYS  55           HZ2      LYS  55  76.834 -12.140  -3.218
  396   3HZ   LYS  55           HZ1      LYS  55  75.746 -12.254  -4.518
  397    H    GLU  56           HN       GLU  56  77.807  -5.996  -9.445
  398    HA   GLU  56           HA       GLU  56  79.772  -4.315  -8.225
  399   1HB   GLU  56           HB2      GLU  56  78.603  -4.580 -10.969
  400   2HB   GLU  56           HB1      GLU  56  79.570  -3.151 -10.604
  401   1HG   GLU  56           HG2      GLU  56  81.211  -4.984  -9.565
  402   2HG   GLU  56           HG1      GLU  56  80.400  -6.017 -10.743
  403    H    GLU  57           HN       GLU  57  76.975  -3.148 -10.133
  404    HA   GLU  57           HA       GLU  57  77.017  -0.504  -9.201
  405   1HB   GLU  57           HB2      GLU  57  74.855  -2.293 -10.255
  406   2HB   GLU  57           HB1      GLU  57  74.406  -0.724  -9.587
  407   1HG   GLU  57           HG2      GLU  57  74.951   0.173 -11.581
  408   2HG   GLU  57           HG1      GLU  57  76.634  -0.191 -11.195
  409    H    LEU  58           HN       LEU  58  75.865  -3.386  -7.581
  410    HA   LEU  58           HA       LEU  58  74.282  -2.051  -5.575
  411   1HB   LEU  58           HB2      LEU  58  74.742  -4.677  -6.263
  412   2HB   LEU  58           HB1      LEU  58  75.610  -4.534  -4.734
  413    HG   LEU  58           HG       LEU  58  73.183  -3.156  -4.353
  414   1HD1  LEU  58          HD11      LEU  58  72.772  -4.862  -6.479
  415   2HD1  LEU  58          HD13      LEU  58  72.290  -5.856  -5.103
  416   3HD1  LEU  58          HD12      LEU  58  71.513  -4.297  -5.381
  417   1HD2  LEU  58          HD23      LEU  58  74.723  -5.253  -3.195
  418   2HD2  LEU  58          HD22      LEU  58  73.417  -4.333  -2.447
  419   3HD2  LEU  58          HD21      LEU  58  73.060  -5.830  -3.309
  420    H    ASP  59           HN       ASP  59  77.689  -3.054  -5.722
  421    HA   ASP  59           HA       ASP  59  78.379  -2.391  -3.041
  422   1HB   ASP  59           HB2      ASP  59  79.742  -3.169  -5.432
  423   2HB   ASP  59           HB1      ASP  59  80.574  -1.765  -4.759
  424    H    ALA  60           HN       ALA  60  78.544  -0.405  -6.012
  425    HA   ALA  60           HA       ALA  60  79.530   1.947  -4.702
  426   1HB   ALA  60           HB3      ALA  60  79.005   1.208  -7.320
  427   2HB   ALA  60           HB2      ALA  60  77.797   2.456  -7.010
  428   3HB   ALA  60           HB1      ALA  60  79.511   2.813  -6.794
  429    H    ILE  61           HN       ILE  61  76.297   0.637  -5.127
  430    HA   ILE  61           HA       ILE  61  74.886   3.051  -4.417
  431    HB   ILE  61           HB       ILE  61  74.152   0.125  -4.480
  432   1HG1  ILE  61          HG12      ILE  61  72.690   2.270  -5.941
  433   2HG1  ILE  61          HG11      ILE  61  74.341   1.941  -6.467
  434   1HG2  ILE  61          HG22      ILE  61  72.442   2.455  -3.559
  435   2HG2  ILE  61          HG21      ILE  61  71.806   0.867  -3.990
  436   3HG2  ILE  61          HG23      ILE  61  72.894   1.037  -2.610
  437   1HD1  ILE  61          HD13      ILE  61  73.595  -0.562  -6.404
  438   2HD1  ILE  61          HD12      ILE  61  71.962   0.097  -6.454
  439   3HD1  ILE  61          HD11      ILE  61  73.092   0.439  -7.764
  440    H    ILE  62           HN       ILE  62  76.015   0.241  -2.546
  441    HA   ILE  62           HA       ILE  62  74.854   0.818  -0.060
  442    HB   ILE  62           HB       ILE  62  77.577  -0.329  -0.716
  443   1HG1  ILE  62          HG12      ILE  62  74.904  -1.539   0.060
  444   2HG1  ILE  62          HG11      ILE  62  75.703  -1.672  -1.508
  445   1HG2  ILE  62          HG21      ILE  62  77.492   0.651   1.584
  446   2HG2  ILE  62          HG23      ILE  62  76.099  -0.375   1.931
  447   3HG2  ILE  62          HG22      ILE  62  77.669  -1.105   1.591
  448   1HD1  ILE  62          HD13      ILE  62  77.600  -2.513   0.412
  449   2HD1  ILE  62          HD12      ILE  62  76.080  -3.291   0.851
  450   3HD1  ILE  62          HD11      ILE  62  76.751  -3.517  -0.764
  451    H    GLU  63           HN       GLU  63  77.698   2.289  -1.572
  452    HA   GLU  63           HA       GLU  63  78.566   3.743   0.749
  453   1HB   GLU  63           HB2      GLU  63  79.065   3.934  -2.198
  454   2HB   GLU  63           HB1      GLU  63  79.557   5.277  -1.167
  455   1HG   GLU  63           HG2      GLU  63  80.944   3.832   0.179
  456   2HG   GLU  63           HG1      GLU  63  80.317   2.396  -0.630
  457    H    GLU  64           HN       GLU  64  76.363   4.582  -1.924
  458    HA   GLU  64           HA       GLU  64  75.965   7.294  -0.954
  459   1HB   GLU  64           HB2      GLU  64  74.046   7.271  -2.612
  460   2HB   GLU  64           HB1      GLU  64  75.629   6.908  -3.300
  461   1HG   GLU  64           HG2      GLU  64  75.169   4.567  -3.374
  462   2HG   GLU  64           HG1      GLU  64  73.740   4.745  -2.357
  463    H    VAL  65           HN       VAL  65  74.570   4.204  -0.196
  464    HA   VAL  65           HA       VAL  65  72.091   5.327   0.880
  465    HB   VAL  65           HB       VAL  65  73.097   2.632   1.705
  466   1HG1  VAL  65          HG13      VAL  65  70.720   3.995   1.963
  467   2HG1  VAL  65          HG12      VAL  65  70.419   2.995   0.541
  468   3HG1  VAL  65          HG11      VAL  65  70.890   2.244   2.066
  469   1HG2  VAL  65          HG21      VAL  65  72.837   3.558  -1.060
  470   2HG2  VAL  65          HG23      VAL  65  73.519   2.054  -0.442
  471   3HG2  VAL  65          HG22      VAL  65  71.781   2.190  -0.704
  472    H    ASP  66           HN       ASP  66  75.222   4.278   2.165
  473    HA   ASP  66           HA       ASP  66  74.354   4.957   4.913
  474   1HB   ASP  66           HB2      ASP  66  76.692   3.544   3.695
  475   2HB   ASP  66           HB1      ASP  66  76.921   4.320   5.263
  476    H    GLU  67           HN       GLU  67  74.129   7.268   3.813
  477    HA   GLU  67           HA       GLU  67  76.527   8.777   3.323
  478   1HB   GLU  67           HB2      GLU  67  73.693   9.565   4.021
  479   2HB   GLU  67           HB1      GLU  67  74.963  10.762   3.768
  480   1HG   GLU  67           HG2      GLU  67  74.877   8.716   1.668
  481   2HG   GLU  67           HG1      GLU  67  73.394   9.665   1.775
  482    H    ASP  68           HN       ASP  68  74.838   7.857   6.229
  483    HA   ASP  68           HA       ASP  68  76.169   9.875   7.888
  484   1HB   ASP  68           HB2      ASP  68  75.189   8.394   9.767
  485   2HB   ASP  68           HB1      ASP  68  74.045   9.224   8.713
  486    H    GLY  69           HN       GLY  69  77.027   6.879   6.545
  487   1HA   GLY  69           HA2      GLY  69  78.905   5.511   6.862
  488   2HA   GLY  69           HA1      GLY  69  79.623   6.875   7.719
  489    H    SER  70           HN       SER  70  76.624   5.263   8.666
  490    HA   SER  70           HA       SER  70  77.698   4.845  11.356
  491   1HB   SER  70           HB2      SER  70  75.206   3.464  10.880
  492   2HB   SER  70           HB1      SER  70  75.518   4.852  11.917
  493    HG   SER  70           HG       SER  70  74.241   4.788   9.603
  494    H    GLY  71           HN       GLY  71  77.234   2.940   8.464
  495   1HA   GLY  71           HA2      GLY  71  78.435   0.876   8.088
  496   2HA   GLY  71           HA1      GLY  71  78.554   0.662   9.835
  497    H    THR  72           HN       THR  72  75.458   1.669   8.895
  498    HA   THR  72           HA       THR  72  74.430  -1.053   8.419
  499    HB   THR  72           HB       THR  72  72.716  -0.235  10.415
  500    HG1  THR  72           HG1      THR  72  74.005   0.477  12.086
  501   1HG2  THR  72          HG21      THR  72  73.786  -2.488   9.986
  502   2HG2  THR  72          HG23      THR  72  75.202  -1.902  10.857
  503   3HG2  THR  72          HG22      THR  72  73.654  -2.046  11.688
  504    H    ILE  73           HN       ILE  73  72.162  -1.001   7.741
  505    HA   ILE  73           HA       ILE  73  71.401   1.686   6.686
  506    HB   ILE  73           HB       ILE  73  70.456  -1.052   5.791
  507   1HG1  ILE  73          HG12      ILE  73  72.929  -0.503   5.426
  508   2HG1  ILE  73          HG11      ILE  73  72.003  -0.878   3.973
  509   1HG2  ILE  73          HG21      ILE  73  68.895   0.836   5.354
  510   2HG2  ILE  73          HG23      ILE  73  70.187   1.682   4.505
  511   3HG2  ILE  73          HG22      ILE  73  69.557   0.164   3.866
  512   1HD1  ILE  73          HD13      ILE  73  71.646   1.596   3.652
  513   2HD1  ILE  73          HD12      ILE  73  72.761   1.875   4.990
  514   3HD1  ILE  73          HD11      ILE  73  73.332   1.093   3.516
  515    H    ASP  74           HN       ASP  74  69.449   2.573   7.280
  516    HA   ASP  74           HA       ASP  74  67.829   1.013   9.242
  517   1HB   ASP  74           HB2      ASP  74  68.882   3.395   9.705
  518   2HB   ASP  74           HB1      ASP  74  67.478   3.960   8.799
  519    H    PHE  75           HN       PHE  75  65.396   1.648   9.130
  520    HA   PHE  75           HA       PHE  75  64.299   0.805   6.686
  521   1HB   PHE  75           HB2      PHE  75  63.164   1.055   8.994
  522   2HB   PHE  75           HB1      PHE  75  62.856   2.725   8.512
  523    HD1  PHE  75           HD2      PHE  75  62.881  -0.446   6.533
  524    HD2  PHE  75           HD1      PHE  75  60.584   2.889   7.953
  525    HE1  PHE  75           HE2      PHE  75  60.950  -1.197   5.168
  526    HE2  PHE  75           HE1      PHE  75  58.650   2.141   6.591
  527    HZ   PHE  75           HZ       PHE  75  58.834   0.098   5.198
  528    H    GLU  76           HN       GLU  76  65.072   4.091   7.769
  529    HA   GLU  76           HA       GLU  76  63.788   5.396   5.529
  530   1HB   GLU  76           HB2      GLU  76  65.004   7.392   6.262
  531   2HB   GLU  76           HB1      GLU  76  64.317   6.562   7.659
  532   1HG   GLU  76           HG2      GLU  76  66.561   5.382   7.907
  533   2HG   GLU  76           HG1      GLU  76  67.190   6.517   6.713
  534    H    GLU  77           HN       GLU  77  66.973   4.005   6.065
  535    HA   GLU  77           HA       GLU  77  68.078   5.217   3.631
  536   1HB   GLU  77           HB2      GLU  77  69.145   3.089   5.508
  537   2HB   GLU  77           HB1      GLU  77  70.041   3.741   4.135
  538   1HG   GLU  77           HG2      GLU  77  69.949   5.984   5.083
  539   2HG   GLU  77           HG1      GLU  77  68.935   5.414   6.409
  540    H    PHE  78           HN       PHE  78  66.325   2.350   4.471
  541    HA   PHE  78           HA       PHE  78  67.232   0.687   2.303
  542   1HB   PHE  78           HB2      PHE  78  66.129  -0.611   3.854
  543   2HB   PHE  78           HB1      PHE  78  64.999   0.672   4.276
  544    HD1  PHE  78           HD2      PHE  78  63.157   1.257   2.638
  545    HD2  PHE  78           HD1      PHE  78  65.525  -2.306   2.307
  546    HE1  PHE  78           HE2      PHE  78  61.431   0.247   1.165
  547    HE2  PHE  78           HE1      PHE  78  63.804  -3.319   0.832
  548    HZ   PHE  78           HZ       PHE  78  61.757  -2.040   0.261
  549    H    LEU  79           HN       LEU  79  64.460   2.895   2.705
  550    HA   LEU  79           HA       LEU  79  63.274   2.501   0.165
  551   1HB   LEU  79           HB2      LEU  79  63.464   5.118   1.689
  552   2HB   LEU  79           HB1      LEU  79  62.257   4.697   0.476
  553    HG   LEU  79           HG       LEU  79  62.654   3.176   3.068
  554   1HD1  LEU  79          HD12      LEU  79  61.824   5.587   3.283
  555   2HD1  LEU  79          HD11      LEU  79  60.396   5.069   2.387
  556   3HD1  LEU  79          HD13      LEU  79  60.767   4.341   3.950
  557   1HD2  LEU  79          HD22      LEU  79  61.616   2.096   0.935
  558   2HD2  LEU  79          HD21      LEU  79  60.734   1.951   2.456
  559   3HD2  LEU  79          HD23      LEU  79  60.239   3.149   1.260
  560    H    VAL  80           HN       VAL  80  66.233   4.048   1.065
  561    HA   VAL  80           HA       VAL  80  66.541   5.778  -1.207
  562    HB   VAL  80           HB       VAL  80  68.718   4.386   0.381
  563   1HG1  VAL  80          HG11      VAL  80  68.612   6.631  -1.593
  564   2HG1  VAL  80          HG13      VAL  80  69.760   6.752  -0.259
  565   3HG1  VAL  80          HG12      VAL  80  69.844   5.388  -1.373
  566   1HG2  VAL  80          HG21      VAL  80  67.117   5.597   1.841
  567   2HG2  VAL  80          HG23      VAL  80  68.691   6.390   1.807
  568   3HG2  VAL  80          HG22      VAL  80  67.350   7.050   0.871
  569    H    MET  81           HN       MET  81  67.710   2.460  -0.565
  570    HA   MET  81           HA       MET  81  68.972   2.055  -3.077
  571   1HB   MET  81           HB2      MET  81  67.539   0.005  -1.358
  572   2HB   MET  81           HB1      MET  81  68.731  -0.346  -2.610
  573   1HG   MET  81           HG2      MET  81  70.055   1.500  -1.052
  574   2HG   MET  81           HG1      MET  81  69.135   0.592   0.147
  575   1HE   MET  81           HE3      MET  81  71.671   0.767   0.561
  576   2HE   MET  81           HE2      MET  81  72.517  -0.778   0.606
  577   3HE   MET  81           HE1      MET  81  72.814   0.343  -0.720
  578    H    MET  82           HN       MET  82  65.596   1.802  -2.092
  579    HA   MET  82           HA       MET  82  64.624   0.475  -4.442
  580   1HB   MET  82           HB2      MET  82  63.433   2.089  -2.232
  581   2HB   MET  82           HB1      MET  82  62.471   1.884  -3.696
  582   1HG   MET  82           HG2      MET  82  61.981   0.088  -2.096
  583   2HG   MET  82           HG1      MET  82  62.762  -0.565  -3.534
  584   1HE   MET  82           HE1      MET  82  64.483  -1.580  -3.816
  585   2HE   MET  82           HE3      MET  82  65.992  -0.862  -3.232
  586   3HE   MET  82           HE2      MET  82  65.461  -2.425  -2.618
  587    H    VAL  83           HN       VAL  83  63.878   3.852  -3.618
  588    HA   VAL  83           HA       VAL  83  63.272   4.686  -6.231
  589    HB   VAL  83           HB       VAL  83  64.447   6.286  -3.941
  590   1HG1  VAL  83          HG11      VAL  83  63.289   7.092  -6.610
  591   2HG1  VAL  83          HG13      VAL  83  63.246   8.183  -5.226
  592   3HG1  VAL  83          HG12      VAL  83  64.794   7.625  -5.862
  593   1HG2  VAL  83          HG21      VAL  83  62.025   4.991  -4.104
  594   2HG2  VAL  83          HG23      VAL  83  62.329   6.421  -3.118
  595   3HG2  VAL  83          HG22      VAL  83  61.620   6.593  -4.723
  596    H    ARG  84           HN       ARG  84  66.365   3.980  -4.871
  597    HA   ARG  84           HA       ARG  84  68.032   5.681  -6.422
  598   1HB   ARG  84           HB2      ARG  84  68.381   3.442  -4.696
  599   2HB   ARG  84           HB1      ARG  84  69.255   3.099  -6.187
  600   1HG   ARG  84           HG2      ARG  84  70.675   4.321  -4.565
  601   2HG   ARG  84           HG1      ARG  84  70.409   5.262  -6.032
  602   1HD   ARG  84           HD2      ARG  84  68.292   5.777  -4.135
  603   2HD   ARG  84           HD1      ARG  84  69.860   6.055  -3.378
  604    HE   ARG  84           HE       ARG  84  70.191   7.392  -5.708
  605   1HH1  ARG  84          HH21      ARG  84  67.548   7.858  -6.507
  606   2HH1  ARG  84          HH22      ARG  84  66.980   9.175  -5.535
  607   1HH2  ARG  84          HH11      ARG  84  69.470   8.831  -3.146
  608   2HH2  ARG  84          HH12      ARG  84  68.069   9.727  -3.633
  609    H    GLN  85           HN       GLN  85  67.296   2.237  -7.113
  610    HA   GLN  85           HA       GLN  85  68.051   2.656  -9.925
  611   1HB   GLN  85           HB2      GLN  85  66.837   0.166  -8.704
  612   2HB   GLN  85           HB1      GLN  85  67.816   0.285 -10.166
  613   1HG   GLN  85           HG2      GLN  85  68.718   0.699  -7.306
  614   2HG   GLN  85           HG1      GLN  85  69.262  -0.543  -8.436
  615   1HE2  GLN  85          HE22      GLN  85  71.102   1.948 -10.432
  616   2HE2  GLN  85          HE21      GLN  85  69.978   0.705 -10.702
  617    H    MET  86           HN       MET  86  65.251   3.039  -8.079
  618    HA   MET  86           HA       MET  86  63.396   2.294 -10.251
  619   1HB   MET  86           HB2      MET  86  63.198   2.862  -7.390
  620   2HB   MET  86           HB1      MET  86  61.942   3.678  -8.322
  621   1HG   MET  86           HG2      MET  86  62.033   1.154  -9.465
  622   2HG   MET  86           HG1      MET  86  62.272   0.826  -7.749
  623   1HE   MET  86           HE3      MET  86  61.309   2.601  -6.236
  624   2HE   MET  86           HE2      MET  86  59.684   3.274  -6.320
  625   3HE   MET  86           HE1      MET  86  59.913   1.610  -5.790
  626    H    LYS  87           HN       LYS  87  65.275   4.971  -9.411
  627    HA   LYS  87           HA       LYS  87  63.370   6.924 -10.571
  628   1HB   LYS  87           HB2      LYS  87  64.402   7.847  -8.668
  629   2HB   LYS  87           HB1      LYS  87  65.966   7.129  -9.052
  630   1HG   LYS  87           HG2      LYS  87  66.536   8.811 -10.490
  631   2HG   LYS  87           HG1      LYS  87  64.883   9.018 -11.067
  632   1HD   LYS  87           HD2      LYS  87  64.403  10.595  -9.497
  633   2HD   LYS  87           HD1      LYS  87  65.291   9.742  -8.233
  634   1HE   LYS  87           HE2      LYS  87  66.957  11.235  -8.471
  635   2HE   LYS  87           HE1      LYS  87  67.230  10.607 -10.096
  636   1HZ   LYS  87           HZ2      LYS  87  64.989  12.419  -9.840
  637   2HZ   LYS  87           HZ1      LYS  87  66.510  13.124  -9.561
  638   3HZ   LYS  87           HZ3      LYS  87  66.197  12.343 -11.033
  639    H    GLU  88           HN       GLU  88  66.891   6.396 -10.980
  640    HA   GLU  88           HA       GLU  88  66.619   7.196 -13.813
  641   1HB   GLU  88           HB2      GLU  88  68.876   6.892 -11.877
  642   2HB   GLU  88           HB1      GLU  88  69.235   6.713 -13.596
  643   1HG   GLU  88           HG2      GLU  88  67.603   8.944 -13.546
  644   2HG   GLU  88           HG1      GLU  88  68.563   9.129 -12.076
  645    H    ASP  89           HN       ASP  89  66.751   5.766 -15.498
  646    HA   ASP  89           HA       ASP  89  67.496   2.943 -14.847
  647   1HB   ASP  89           HB2      ASP  89  64.968   3.567 -15.319
  648   2HB   ASP  89           HB1      ASP  89  65.502   3.560 -17.001
  649    H    ALA  90           HN       ALA  90  69.085   5.185 -15.996
  650    HA   ALA  90           HA       ALA  90  69.510   4.165 -18.767
  651   1HB   ALA  90           HB3      ALA  90  69.131   6.608 -18.520
  652   2HB   ALA  90           HB2      ALA  90  70.540   6.704 -17.464
  653   3HB   ALA  90           HB1      ALA  90  70.736   6.254 -19.158
   
  No H/Q in entry =         653
  Start of MODEL    9
    1   1H    ALA   1           HT3      ALA   1  65.900  13.939  12.744
    2   2H    ALA   1           HT2      ALA   1  67.008  14.440  13.931
    3   3H    ALA   1           HT1      ALA   1  65.709  13.428  14.350
    4    HA   ALA   1           HA       ALA   1  64.176  15.096  14.305
    5   1HB   ALA   1           HB2      ALA   1  66.685  15.718  15.511
    6   2HB   ALA   1           HB1      ALA   1  66.049  17.205  14.808
    7   3HB   ALA   1           HB3      ALA   1  65.087  16.299  15.975
    8    H    SER   2           HN       SER   2  66.759  15.509  12.027
    9    HA   SER   2           HA       SER   2  65.384  17.838  10.788
   10   1HB   SER   2           HB2      SER   2  68.060  17.318  11.158
   11   2HB   SER   2           HB1      SER   2  67.818  16.800   9.493
   12    HG   SER   2           HG       SER   2  66.810  19.255  10.470
   13    H    MET   3           HN       MET   3  66.230  17.340   8.116
   14    HA   MET   3           HA       MET   3  64.931  14.754   7.423
   15   1HB   MET   3           HB2      MET   3  63.772  16.167   5.530
   16   2HB   MET   3           HB1      MET   3  63.055  16.114   7.140
   17   1HG   MET   3           HG2      MET   3  64.355  18.213   7.690
   18   2HG   MET   3           HG1      MET   3  64.808  18.301   5.988
   19   1HE   MET   3           HE2      MET   3  63.408  19.866   8.202
   20   2HE   MET   3           HE1      MET   3  62.565  20.989   7.138
   21   3HE   MET   3           HE3      MET   3  61.647  19.928   8.217
   22    H    THR   4           HN       THR   4  66.484  13.748   6.238
   23    HA   THR   4           HA       THR   4  68.535  15.213   4.799
   24    HB   THR   4           HB       THR   4  68.775  12.718   3.809
   25    HG1  THR   4           HG1      THR   4  67.790  12.131   6.342
   26   1HG2  THR   4          HG22      THR   4  69.987  14.254   5.786
   27   2HG2  THR   4          HG21      THR   4  69.597  12.744   6.610
   28   3HG2  THR   4          HG23      THR   4  70.588  12.723   5.152
   29    H    ASP   5           HN       ASP   5  68.727  15.481   2.544
   30    HA   ASP   5           HA       ASP   5  66.256  15.732   1.080
   31   1HB   ASP   5           HB2      ASP   5  69.126  15.781   0.097
   32   2HB   ASP   5           HB1      ASP   5  67.723  16.290  -0.840
   33    H    GLN   6           HN       GLN   6  68.934  13.380   0.955
   34    HA   GLN   6           HA       GLN   6  68.042  11.874  -1.265
   35   1HB   GLN   6           HB2      GLN   6  69.380  10.843   1.259
   36   2HB   GLN   6           HB1      GLN   6  69.309   9.998  -0.288
   37   1HG   GLN   6           HG2      GLN   6  70.805  11.450  -1.309
   38   2HG   GLN   6           HG1      GLN   6  70.412  12.783  -0.222
   39   1HE2  GLN   6          HE22      GLN   6  73.400  10.217   0.751
   40   2HE2  GLN   6          HE21      GLN   6  72.517  10.036  -0.688
   41    H    GLN   7           HN       GLN   7  67.097  11.672   2.158
   42    HA   GLN   7           HA       GLN   7  65.274   9.444   1.666
   43   1HB   GLN   7           HB2      GLN   7  65.427  11.309   4.055
   44   2HB   GLN   7           HB1      GLN   7  64.621   9.741   3.999
   45   1HG   GLN   7           HG2      GLN   7  66.771   8.630   3.569
   46   2HG   GLN   7           HG1      GLN   7  67.590  10.194   3.580
   47   1HE2  GLN   7          HE22      GLN   7  68.026   8.906   7.003
   48   2HE2  GLN   7          HE21      GLN   7  68.617   8.567   5.448
   49    H    ALA   8           HN       ALA   8  65.133  12.898   1.473
   50    HA   ALA   8           HA       ALA   8  62.272  13.174   1.806
   51   1HB   ALA   8           HB2      ALA   8  64.269  14.956   0.375
   52   2HB   ALA   8           HB1      ALA   8  62.614  15.409   0.779
   53   3HB   ALA   8           HB3      ALA   8  63.780  15.097   2.063
   54    H    GLU   9           HN       GLU   9  64.393  12.529  -0.944
   55    HA   GLU   9           HA       GLU   9  62.219  12.811  -2.886
   56   1HB   GLU   9           HB2      GLU   9  63.841  12.266  -4.536
   57   2HB   GLU   9           HB1      GLU   9  64.728  13.194  -3.327
   58   1HG   GLU   9           HG2      GLU   9  65.246  10.888  -2.254
   59   2HG   GLU   9           HG1      GLU   9  64.764  10.220  -3.812
   60    H    ALA  10           HN       ALA  10  63.729  10.221  -1.052
   61    HA   ALA  10           HA       ALA  10  62.621   8.045  -2.581
   62   1HB   ALA  10           HB1      ALA  10  64.417   8.262  -0.495
   63   2HB   ALA  10           HB3      ALA  10  63.013   7.532   0.283
   64   3HB   ALA  10           HB2      ALA  10  63.755   6.747  -1.110
   65    H    ARG  11           HN       ARG  11  61.668   9.275   0.653
   66    HA   ARG  11           HA       ARG  11  59.185   7.836   0.684
   67   1HB   ARG  11           HB2      ARG  11  60.608   9.634   2.412
   68   2HB   ARG  11           HB1      ARG  11  58.936  10.180   2.279
   69   1HG   ARG  11           HG2      ARG  11  58.075   8.138   3.086
   70   2HG   ARG  11           HG1      ARG  11  59.578   7.273   2.760
   71   1HD   ARG  11           HD2      ARG  11  60.284   7.704   4.850
   72   2HD   ARG  11           HD1      ARG  11  60.180   9.434   4.527
   73    HE   ARG  11           HE       ARG  11  57.558   8.664   5.060
   74   1HH1  ARG  11          HH11      ARG  11  59.912   7.057   6.706
   75   2HH1  ARG  11          HH12      ARG  11  59.574   7.733   8.265
   76   1HH2  ARG  11          HH21      ARG  11  57.413  10.154   7.042
   77   2HH2  ARG  11          HH22      ARG  11  58.161   9.487   8.455
   78    H    ALA  12           HN       ALA  12  60.068  11.076  -0.434
   79    HA   ALA  12           HA       ALA  12  57.409  12.065  -0.793
   80   1HB   ALA  12           HB3      ALA  12  60.005  12.727  -2.205
   81   2HB   ALA  12           HB2      ALA  12  58.503  13.611  -2.471
   82   3HB   ALA  12           HB1      ALA  12  59.256  13.611  -0.875
   83    H    PHE  13           HN       PHE  13  59.446   9.984  -2.774
   84    HA   PHE  13           HA       PHE  13  57.569  10.124  -5.042
   85   1HB   PHE  13           HB2      PHE  13  60.087   9.904  -5.300
   86   2HB   PHE  13           HB1      PHE  13  59.925   8.256  -4.693
   87    HD1  PHE  13           HD1      PHE  13  58.346  10.531  -7.226
   88    HD2  PHE  13           HD2      PHE  13  59.611   6.547  -6.240
   89    HE1  PHE  13           HE1      PHE  13  57.684   9.763  -9.490
   90    HE2  PHE  13           HE2      PHE  13  58.949   5.776  -8.505
   91    HZ   PHE  13           HZ       PHE  13  57.985   7.385 -10.129
   92    H    LEU  14           HN       LEU  14  58.249   8.053  -2.306
   93    HA   LEU  14           HA       LEU  14  56.530   5.905  -3.404
   94   1HB   LEU  14           HB2      LEU  14  57.916   6.011  -0.713
   95   2HB   LEU  14           HB1      LEU  14  57.266   4.586  -1.526
   96    HG   LEU  14           HG       LEU  14  59.413   6.291  -2.792
   97   1HD1  LEU  14          HD11      LEU  14  59.673   4.025  -0.811
   98   2HD1  LEU  14          HD13      LEU  14  60.955   4.408  -1.960
   99   3HD1  LEU  14          HD12      LEU  14  60.452   5.608  -0.769
  100   1HD2  LEU  14          HD23      LEU  14  57.973   4.566  -4.063
  101   2HD2  LEU  14          HD22      LEU  14  59.723   4.419  -4.220
  102   3HD2  LEU  14          HD21      LEU  14  58.842   3.345  -3.136
  103    H    SER  15           HN       SER  15  54.675   5.134  -2.163
  104    HA   SER  15           HA       SER  15  53.380   7.350  -0.636
  105   1HB   SER  15           HB2      SER  15  51.799   5.001  -1.554
  106   2HB   SER  15           HB1      SER  15  51.360   6.706  -1.520
  107    HG   SER  15           HG       SER  15  52.622   5.217  -3.474
  108    H    GLU  16           HN       GLU  16  51.997   6.648   1.215
  109    HA   GLU  16           HA       GLU  16  53.429   5.016   3.055
  110   1HB   GLU  16           HB2      GLU  16  50.849   6.421   2.985
  111   2HB   GLU  16           HB1      GLU  16  50.830   4.969   3.987
  112   1HG   GLU  16           HG2      GLU  16  52.754   5.752   5.251
  113   2HG   GLU  16           HG1      GLU  16  52.926   7.149   4.187
  114    H    GLU  17           HN       GLU  17  50.907   4.240   0.726
  115    HA   GLU  17           HA       GLU  17  50.228   1.660   1.786
  116   1HB   GLU  17           HB2      GLU  17  49.030   3.080  -0.041
  117   2HB   GLU  17           HB1      GLU  17  50.156   2.305  -1.156
  118   1HG   GLU  17           HG2      GLU  17  48.877   0.456  -1.171
  119   2HG   GLU  17           HG1      GLU  17  49.097   0.289   0.571
  120    H    MET  18           HN       MET  18  52.855   2.792  -0.253
  121    HA   MET  18           HA       MET  18  53.678   0.039  -0.917
  122   1HB   MET  18           HB2      MET  18  54.695   2.787  -1.607
  123   2HB   MET  18           HB1      MET  18  55.697   1.365  -1.899
  124   1HG   MET  18           HG2      MET  18  52.868   1.713  -2.927
  125   2HG   MET  18           HG1      MET  18  54.322   1.989  -3.885
  126   1HE   MET  18           HE2      MET  18  55.806   0.584  -4.693
  127   2HE   MET  18           HE1      MET  18  55.653  -1.151  -4.960
  128   3HE   MET  18           HE3      MET  18  54.532  -0.028  -5.746
  129    H    ILE  19           HN       ILE  19  55.325   2.817   0.651
  130    HA   ILE  19           HA       ILE  19  57.514   1.501   1.721
  131    HB   ILE  19           HB       ILE  19  55.795   3.656   2.973
  132   1HG1  ILE  19          HG12      ILE  19  58.498   4.346   2.166
  133   2HG1  ILE  19          HG11      ILE  19  57.602   3.645   0.817
  134   1HG2  ILE  19          HG22      ILE  19  58.241   2.249   3.958
  135   2HG2  ILE  19          HG21      ILE  19  58.138   3.991   4.207
  136   3HG2  ILE  19          HG23      ILE  19  56.895   2.932   4.872
  137   1HD1  ILE  19          HD11      ILE  19  56.351   5.762   2.558
  138   2HD1  ILE  19          HD13      ILE  19  57.405   6.206   1.218
  139   3HD1  ILE  19          HD12      ILE  19  55.926   5.296   0.912
  140    H    ALA  20           HN       ALA  20  54.175   1.163   2.671
  141    HA   ALA  20           HA       ALA  20  54.634  -0.019   5.254
  142   1HB   ALA  20           HB2      ALA  20  52.402   0.699   3.714
  143   2HB   ALA  20           HB1      ALA  20  52.270  -1.047   3.916
  144   3HB   ALA  20           HB3      ALA  20  52.381  -0.003   5.332
  145    H    GLU  21           HN       GLU  21  53.994  -1.481   2.047
  146    HA   GLU  21           HA       GLU  21  54.268  -4.185   2.947
  147   1HB   GLU  21           HB2      GLU  21  54.206  -4.797   0.669
  148   2HB   GLU  21           HB1      GLU  21  53.296  -3.288   0.713
  149   1HG   GLU  21           HG2      GLU  21  55.610  -2.169   0.231
  150   2HG   GLU  21           HG1      GLU  21  56.084  -3.779  -0.307
  151    H    PHE  22           HN       PHE  22  56.619  -1.790   1.867
  152    HA   PHE  22           HA       PHE  22  58.822  -3.608   1.545
  153   1HB   PHE  22           HB2      PHE  22  58.846  -0.663   2.270
  154   2HB   PHE  22           HB1      PHE  22  60.229  -1.587   1.688
  155    HD1  PHE  22           HD1      PHE  22  58.316  -3.307  -0.210
  156    HD2  PHE  22           HD2      PHE  22  59.046   0.891   0.342
  157    HE1  PHE  22           HE1      PHE  22  57.617  -2.878  -2.548
  158    HE2  PHE  22           HE2      PHE  22  58.345   1.319  -1.998
  159    HZ   PHE  22           HZ       PHE  22  57.631  -0.565  -3.443
  160    H    LYS  23           HN       LYS  23  57.573  -1.793   4.328
  161    HA   LYS  23           HA       LYS  23  59.662  -2.161   6.156
  162   1HB   LYS  23           HB2      LYS  23  57.009  -1.317   6.302
  163   2HB   LYS  23           HB1      LYS  23  57.068  -2.715   7.376
  164   1HG   LYS  23           HG2      LYS  23  59.204  -0.595   7.502
  165   2HG   LYS  23           HG1      LYS  23  57.679  -0.385   8.361
  166   1HD   LYS  23           HD2      LYS  23  58.096  -2.724   9.341
  167   2HD   LYS  23           HD1      LYS  23  59.745  -2.556   8.739
  168   1HE   LYS  23           HE2      LYS  23  58.360  -0.637  10.637
  169   2HE   LYS  23           HE1      LYS  23  59.593  -1.816  11.086
  170   1HZ   LYS  23           HZ1      LYS  23  60.609  -0.374   8.949
  171   2HZ   LYS  23           HZ3      LYS  23  59.926   0.770  10.000
  172   3HZ   LYS  23           HZ2      LYS  23  61.109  -0.307  10.573
  173    H    ALA  24           HN       ALA  24  57.527  -4.538   4.785
  174    HA   ALA  24           HA       ALA  24  57.937  -6.569   6.810
  175   1HB   ALA  24           HB2      ALA  24  57.062  -6.742   3.912
  176   2HB   ALA  24           HB1      ALA  24  57.086  -8.119   5.014
  177   3HB   ALA  24           HB3      ALA  24  56.022  -6.748   5.336
  178    H    ALA  25           HN       ALA  25  59.373  -5.999   3.584
  179    HA   ALA  25           HA       ALA  25  61.194  -8.190   3.668
  180   1HB   ALA  25           HB3      ALA  25  60.583  -6.154   1.866
  181   2HB   ALA  25           HB2      ALA  25  62.262  -5.840   2.305
  182   3HB   ALA  25           HB1      ALA  25  61.803  -7.407   1.638
  183    H    PHE  26           HN       PHE  26  61.523  -4.819   4.762
  184    HA   PHE  26           HA       PHE  26  64.244  -4.777   5.423
  185   1HB   PHE  26           HB2      PHE  26  62.493  -2.910   5.673
  186   2HB   PHE  26           HB1      PHE  26  62.129  -3.622   7.245
  187    HD1  PHE  26           HD1      PHE  26  65.313  -3.058   5.332
  188    HD2  PHE  26           HD2      PHE  26  63.111  -2.391   8.960
  189    HE1  PHE  26           HE1      PHE  26  67.277  -1.905   6.313
  190    HE2  PHE  26           HE2      PHE  26  65.075  -1.238   9.940
  191    HZ   PHE  26           HZ       PHE  26  67.158  -0.995   8.617
  192    H    ASP  27           HN       ASP  27  61.748  -5.331   7.928
  193    HA   ASP  27           HA       ASP  27  63.506  -6.492   9.810
  194   1HB   ASP  27           HB2      ASP  27  61.536  -7.292  10.951
  195   2HB   ASP  27           HB1      ASP  27  61.134  -5.731  10.237
  196    H    MET  28           HN       MET  28  62.263  -7.798   6.882
  197    HA   MET  28           HA       MET  28  62.208 -10.572   7.461
  198   1HB   MET  28           HB2      MET  28  61.908  -9.010   5.191
  199   2HB   MET  28           HB1      MET  28  63.368  -9.938   4.846
  200   1HG   MET  28           HG2      MET  28  61.614 -11.790   6.002
  201   2HG   MET  28           HG1      MET  28  60.601 -10.830   4.922
  202   1HE   MET  28           HE2      MET  28  60.694 -10.458   2.859
  203   2HE   MET  28           HE1      MET  28  62.229 -10.344   2.001
  204   3HE   MET  28           HE3      MET  28  61.118 -11.678   1.661
  205    H    PHE  29           HN       PHE  29  64.930  -8.461   6.566
  206    HA   PHE  29           HA       PHE  29  66.768 -10.759   7.070
  207   1HB   PHE  29           HB2      PHE  29  67.647  -8.134   5.897
  208   2HB   PHE  29           HB1      PHE  29  68.328  -9.743   5.652
  209    HD1  PHE  29           HD2      PHE  29  65.338  -7.629   4.940
  210    HD2  PHE  29           HD1      PHE  29  67.601 -11.118   3.868
  211    HE1  PHE  29           HE2      PHE  29  63.933  -7.919   2.916
  212    HE2  PHE  29           HE1      PHE  29  66.196 -11.408   1.844
  213    HZ   PHE  29           HZ       PHE  29  64.363  -9.808   1.369
  214    H    ASP  30           HN       ASP  30  65.496  -9.287   9.230
  215    HA   ASP  30           HA       ASP  30  67.597  -7.513  10.297
  216   1HB   ASP  30           HB2      ASP  30  66.063  -7.157  12.162
  217   2HB   ASP  30           HB1      ASP  30  65.172  -7.010  10.647
  218    H    ALA  31           HN       ALA  31  69.383  -8.711  10.897
  219    HA   ALA  31           HA       ALA  31  69.233 -11.353  12.037
  220   1HB   ALA  31           HB2      ALA  31  71.466  -9.302  12.175
  221   2HB   ALA  31           HB1      ALA  31  71.625 -11.013  12.568
  222   3HB   ALA  31           HB3      ALA  31  71.264 -10.520  10.915
  223    H    ASP  32           HN       ASP  32  69.817  -8.140  13.499
  224    HA   ASP  32           HA       ASP  32  69.751  -9.245  16.202
  225   1HB   ASP  32           HB2      ASP  32  69.969  -6.495  15.014
  226   2HB   ASP  32           HB1      ASP  32  69.572  -6.671  16.722
  227    H    GLY  33           HN       GLY  33  67.547  -7.316  14.168
  228   1HA   GLY  33           HA2      GLY  33  65.143  -7.619  14.244
  229   2HA   GLY  33           HA1      GLY  33  65.306  -8.267  15.877
  230    H    GLY  34           HN       GLY  34  67.246  -5.530  15.413
  231   1HA   GLY  34           HA2      GLY  34  65.466  -3.950  17.150
  232   2HA   GLY  34           HA1      GLY  34  67.111  -3.516  16.686
  233    H    GLY  35           HN       GLY  35  65.566  -4.452  13.907
  234   1HA   GLY  35           HA2      GLY  35  64.197  -3.235  12.344
  235   2HA   GLY  35           HA1      GLY  35  64.319  -1.815  13.383
  236    H    ASP  36           HN       ASP  36  66.897  -3.906  12.076
  237    HA   ASP  36           HA       ASP  36  67.758  -1.909  10.146
  238   1HB   ASP  36           HB2      ASP  36  70.037  -1.654  11.361
  239   2HB   ASP  36           HB1      ASP  36  68.678  -0.702  11.957
  240    H    ILE  37           HN       ILE  37  68.594  -3.133   8.531
  241    HA   ILE  37           HA       ILE  37  69.847  -5.737   9.280
  242    HB   ILE  37           HB       ILE  37  68.240  -6.424   7.827
  243   1HG1  ILE  37          HG12      ILE  37  70.587  -6.591   6.654
  244   2HG1  ILE  37          HG11      ILE  37  69.129  -6.969   5.749
  245   1HG2  ILE  37          HG22      ILE  37  67.280  -4.129   7.653
  246   2HG2  ILE  37          HG21      ILE  37  68.398  -3.795   6.330
  247   3HG2  ILE  37          HG23      ILE  37  67.159  -5.038   6.146
  248   1HD1  ILE  37          HD12      ILE  37  69.102  -4.667   4.835
  249   2HD1  ILE  37          HD11      ILE  37  70.588  -4.308   5.712
  250   3HD1  ILE  37          HD13      ILE  37  70.595  -5.511   4.426
  251    H    SER  38           HN       SER  38  71.759  -6.372   8.098
  252    HA   SER  38           HA       SER  38  73.581  -4.105   7.693
  253   1HB   SER  38           HB2      SER  38  73.993  -7.101   7.485
  254   2HB   SER  38           HB1      SER  38  75.276  -5.912   7.284
  255    HG   SER  38           HG       SER  38  74.515  -6.955   9.509
  256    H    THR  39           HN       THR  39  74.546  -3.542   5.699
  257    HA   THR  39           HA       THR  39  72.967  -3.812   3.363
  258    HB   THR  39           HB       THR  39  74.925  -2.934   2.150
  259    HG1  THR  39           HG1      THR  39  76.684  -3.829   2.943
  260   1HG2  THR  39          HG23      THR  39  74.079  -1.796   4.779
  261   2HG2  THR  39          HG22      THR  39  75.440  -1.037   3.952
  262   3HG2  THR  39          HG21      THR  39  73.870  -1.142   3.153
  263    H    LYS  40           HN       LYS  40  75.318  -5.954   4.759
  264    HA   LYS  40           HA       LYS  40  76.126  -7.423   2.474
  265   1HB   LYS  40           HB2      LYS  40  76.662  -9.222   4.000
  266   2HB   LYS  40           HB1      LYS  40  77.024  -7.700   4.817
  267   1HG   LYS  40           HG2      LYS  40  74.723  -7.814   5.858
  268   2HG   LYS  40           HG1      LYS  40  74.577  -9.443   5.195
  269   1HD   LYS  40           HD2      LYS  40  75.410  -9.864   7.341
  270   2HD   LYS  40           HD1      LYS  40  76.883  -9.846   6.370
  271   1HE   LYS  40           HE2      LYS  40  76.741  -7.227   6.944
  272   2HE   LYS  40           HE1      LYS  40  75.899  -7.858   8.359
  273   1HZ   LYS  40           HZ2      LYS  40  77.772  -9.322   8.779
  274   2HZ   LYS  40           HZ1      LYS  40  78.584  -8.710   7.417
  275   3HZ   LYS  40           HZ3      LYS  40  78.277  -7.700   8.745
  276    H    ALA  41           HN       ALA  41  73.290  -7.893   4.596
  277    HA   ALA  41           HA       ALA  41  72.263 -10.094   2.997
  278   1HB   ALA  41           HB3      ALA  41  71.764  -9.426   5.502
  279   2HB   ALA  41           HB2      ALA  41  70.512  -8.421   4.772
  280   3HB   ALA  41           HB1      ALA  41  70.500 -10.166   4.520
  281    H    LEU  42           HN       LEU  42  72.139  -6.646   2.806
  282    HA   LEU  42           HA       LEU  42  69.698  -6.214   1.455
  283   1HB   LEU  42           HB2      LEU  42  71.973  -4.698   2.056
  284   2HB   LEU  42           HB1      LEU  42  71.873  -4.661   0.297
  285    HG   LEU  42           HG       LEU  42  69.614  -3.819   0.366
  286   1HD1  LEU  42          HD12      LEU  42  69.586  -5.080   2.917
  287   2HD1  LEU  42          HD11      LEU  42  69.267  -3.367   3.184
  288   3HD1  LEU  42          HD13      LEU  42  68.243  -4.295   2.089
  289   1HD2  LEU  42          HD21      LEU  42  71.710  -2.338   1.027
  290   2HD2  LEU  42          HD23      LEU  42  70.079  -1.675   1.117
  291   3HD2  LEU  42          HD22      LEU  42  70.879  -2.250   2.581
  292    H    GLY  43           HN       GLY  43  72.778  -7.465   0.250
  293   1HA   GLY  43           HA2      GLY  43  72.323  -7.312  -2.521
  294   2HA   GLY  43           HA1      GLY  43  73.228  -8.617  -1.752
  295    H    THR  44           HN       THR  44  71.286  -9.848  -0.237
  296    HA   THR  44           HA       THR  44  69.802 -11.299  -2.274
  297    HB   THR  44           HB       THR  44  69.788 -11.454   0.752
  298    HG1  THR  44           HG1      THR  44  70.938 -13.382   0.282
  299   1HG2  THR  44          HG23      THR  44  68.034 -12.650  -1.269
  300   2HG2  THR  44          HG22      THR  44  68.803 -13.844  -0.223
  301   3HG2  THR  44          HG21      THR  44  67.829 -12.552   0.480
  302    H    VAL  45           HN       VAL  45  69.131  -8.637  -0.125
  303    HA   VAL  45           HA       VAL  45  66.268  -8.899  -0.059
  304    HB   VAL  45           HB       VAL  45  68.018  -6.430   0.176
  305   1HG1  VAL  45          HG12      VAL  45  65.489  -6.176  -0.388
  306   2HG1  VAL  45          HG11      VAL  45  65.222  -6.749   1.259
  307   3HG1  VAL  45          HG13      VAL  45  66.134  -5.266   0.978
  308   1HG2  VAL  45          HG22      VAL  45  67.011  -8.512   2.099
  309   2HG2  VAL  45          HG21      VAL  45  68.615  -7.791   1.984
  310   3HG2  VAL  45          HG23      VAL  45  67.279  -6.863   2.664
  311    H    MET  46           HN       MET  46  68.499  -7.311  -2.308
  312    HA   MET  46           HA       MET  46  66.485  -5.982  -3.863
  313   1HB   MET  46           HB2      MET  46  69.191  -6.988  -4.793
  314   2HB   MET  46           HB1      MET  46  68.225  -5.717  -5.544
  315   1HG   MET  46           HG2      MET  46  69.499  -5.650  -2.796
  316   2HG   MET  46           HG1      MET  46  69.931  -4.659  -4.190
  317   1HE   MET  46           HE2      MET  46  69.180  -2.705  -4.786
  318   2HE   MET  46           HE1      MET  46  67.626  -3.185  -5.459
  319   3HE   MET  46           HE3      MET  46  67.721  -1.828  -4.329
  320    H    ARG  47           HN       ARG  47  67.810  -9.247  -3.920
  321    HA   ARG  47           HA       ARG  47  66.599  -9.953  -6.467
  322   1HB   ARG  47           HB2      ARG  47  68.573 -11.080  -5.073
  323   2HB   ARG  47           HB1      ARG  47  67.241 -12.031  -4.415
  324   1HG   ARG  47           HG2      ARG  47  66.590 -12.782  -6.609
  325   2HG   ARG  47           HG1      ARG  47  67.708 -11.660  -7.384
  326   1HD   ARG  47           HD2      ARG  47  68.538 -13.929  -5.551
  327   2HD   ARG  47           HD1      ARG  47  68.601 -13.986  -7.312
  328    HE   ARG  47           HE       ARG  47  70.124 -11.840  -6.939
  329   1HH1  ARG  47          HH11      ARG  47  70.269 -15.036  -5.806
  330   2HH1  ARG  47          HH12      ARG  47  71.740 -14.822  -4.916
  331   1HH2  ARG  47          HH21      ARG  47  71.879 -11.400  -5.461
  332   2HH2  ARG  47          HH22      ARG  47  72.652 -12.763  -4.722
  333    H    MET  48           HN       MET  48  65.590  -9.997  -3.109
  334    HA   MET  48           HA       MET  48  63.321 -11.753  -3.502
  335   1HB   MET  48           HB2      MET  48  63.701  -9.656  -1.347
  336   2HB   MET  48           HB1      MET  48  62.649 -11.071  -1.277
  337   1HG   MET  48           HG2      MET  48  65.504 -11.611  -1.876
  338   2HG   MET  48           HG1      MET  48  65.153 -11.043  -0.245
  339   1HE   MET  48           HE2      MET  48  63.807 -11.742   1.220
  340   2HE   MET  48           HE1      MET  48  62.673 -13.090   1.220
  341   3HE   MET  48           HE3      MET  48  64.356 -13.343   1.703
  342    H    LEU  49           HN       LEU  49  63.463  -8.209  -2.936
  343    HA   LEU  49           HA       LEU  49  60.730  -7.740  -3.577
  344   1HB   LEU  49           HB2      LEU  49  62.834  -5.695  -4.223
  345   2HB   LEU  49           HB1      LEU  49  61.240  -5.462  -3.505
  346    HG   LEU  49           HG       LEU  49  63.749  -6.510  -2.197
  347   1HD1  LEU  49          HD11      LEU  49  62.520  -4.018  -2.291
  348   2HD1  LEU  49          HD13      LEU  49  61.991  -4.683  -0.745
  349   3HD1  LEU  49          HD12      LEU  49  63.713  -4.535  -1.099
  350   1HD2  LEU  49          HD21      LEU  49  60.875  -7.020  -1.494
  351   2HD2  LEU  49          HD23      LEU  49  62.265  -8.096  -1.351
  352   3HD2  LEU  49          HD22      LEU  49  62.044  -6.784  -0.194
  353    H    GLY  50           HN       GLY  50  63.621  -7.286  -5.650
  354   1HA   GLY  50           HA2      GLY  50  62.864  -8.491  -7.965
  355   2HA   GLY  50           HA1      GLY  50  61.898  -7.016  -8.019
  356    H    GLN  51           HN       GLN  51  65.165  -8.301  -8.114
  357    HA   GLN  51           HA       GLN  51  66.160  -6.294  -9.834
  358   1HB   GLN  51           HB2      GLN  51  65.764  -5.186  -7.355
  359   2HB   GLN  51           HB1      GLN  51  67.448  -5.703  -7.246
  360   1HG   GLN  51           HG2      GLN  51  67.929  -3.773  -8.330
  361   2HG   GLN  51           HG1      GLN  51  67.327  -4.594  -9.772
  362   1HE2  GLN  51          HE22      GLN  51  65.080  -1.662  -8.029
  363   2HE2  GLN  51          HE21      GLN  51  66.478  -2.240  -7.259
  364    H    ASN  52           HN       ASN  52  68.010  -7.137 -10.690
  365    HA   ASN  52           HA       ASN  52  69.722  -8.852  -8.963
  366   1HB   ASN  52           HB2      ASN  52  69.141  -9.733 -11.773
  367   2HB   ASN  52           HB1      ASN  52  69.648 -10.696 -10.385
  368   1HD2  ASN  52          HD22      ASN  52  66.343 -11.531  -9.539
  369   2HD2  ASN  52          HD21      ASN  52  67.997 -11.897  -9.437
  370    HA   PRO  53           HA       PRO  53  72.030  -5.916 -11.737
  371   1HB   PRO  53           HB2      PRO  53  73.146  -4.429  -9.712
  372   2HB   PRO  53           HB1      PRO  53  71.598  -4.033 -10.478
  373   1HG   PRO  53           HG2      PRO  53  72.112  -5.220  -7.790
  374   2HG   PRO  53           HG1      PRO  53  70.735  -4.254  -8.346
  375   1HD   PRO  53           HD2      PRO  53  70.768  -7.068  -8.028
  376   2HD   PRO  53           HD1      PRO  53  69.528  -6.127  -8.885
  377    H    THR  54           HN       THR  54  74.570  -5.274 -11.110
  378    HA   THR  54           HA       THR  54  75.846  -7.899 -10.724
  379    HB   THR  54           HB       THR  54  77.934  -6.233 -11.034
  380    HG1  THR  54           HG1      THR  54  75.913  -4.946 -12.507
  381   1HG2  THR  54          HG22      THR  54  76.847  -8.116 -12.535
  382   2HG2  THR  54          HG21      THR  54  76.257  -6.739 -13.466
  383   3HG2  THR  54          HG23      THR  54  77.989  -6.970 -13.237
  384    H    LYS  55           HN       LYS  55  77.221  -8.415  -8.996
  385    HA   LYS  55           HA       LYS  55  76.667  -7.401  -6.441
  386   1HB   LYS  55           HB2      LYS  55  78.042  -9.502  -7.190
  387   2HB   LYS  55           HB1      LYS  55  79.424  -8.408  -7.099
  388   1HG   LYS  55           HG2      LYS  55  78.982  -7.925  -4.777
  389   2HG   LYS  55           HG1      LYS  55  77.448  -8.793  -4.836
  390   1HD   LYS  55           HD2      LYS  55  78.826 -10.856  -5.504
  391   2HD   LYS  55           HD1      LYS  55  80.239  -9.936  -4.985
  392   1HE   LYS  55           HE2      LYS  55  79.737 -10.187  -2.790
  393   2HE   LYS  55           HE1      LYS  55  78.023  -9.861  -3.057
  394   1HZ   LYS  55           HZ2      LYS  55  79.198 -12.404  -3.960
  395   2HZ   LYS  55           HZ1      LYS  55  78.766 -12.206  -2.328
  396   3HZ   LYS  55           HZ3      LYS  55  77.590 -12.053  -3.542
  397    H    GLU  56           HN       GLU  56  79.173  -6.373  -8.742
  398    HA   GLU  56           HA       GLU  56  80.485  -4.521  -6.998
  399   1HB   GLU  56           HB2      GLU  56  80.605  -5.269  -9.775
  400   2HB   GLU  56           HB1      GLU  56  80.597  -3.509  -9.648
  401   1HG   GLU  56           HG2      GLU  56  82.374  -5.156  -7.858
  402   2HG   GLU  56           HG1      GLU  56  82.883  -4.756  -9.500
  403    H    GLU  57           HN       GLU  57  77.679  -4.203  -9.140
  404    HA   GLU  57           HA       GLU  57  77.403  -1.364  -8.927
  405   1HB   GLU  57           HB2      GLU  57  75.713  -3.635  -9.785
  406   2HB   GLU  57           HB1      GLU  57  74.826  -2.220  -9.214
  407   1HG   GLU  57           HG2      GLU  57  76.959  -1.285 -10.856
  408   2HG   GLU  57           HG1      GLU  57  76.150  -2.588 -11.728
  409    H    LEU  58           HN       LEU  58  76.276  -4.028  -6.884
  410    HA   LEU  58           HA       LEU  58  74.579  -2.452  -5.194
  411   1HB   LEU  58           HB2      LEU  58  75.125  -5.117  -5.401
  412   2HB   LEU  58           HB1      LEU  58  76.012  -4.710  -3.931
  413    HG   LEU  58           HG       LEU  58  73.282  -3.568  -4.157
  414   1HD1  LEU  58          HD13      LEU  58  72.946  -5.848  -5.046
  415   2HD1  LEU  58          HD12      LEU  58  73.768  -6.517  -3.637
  416   3HD1  LEU  58          HD11      LEU  58  72.226  -5.681  -3.444
  417   1HD2  LEU  58          HD23      LEU  58  75.266  -4.217  -2.156
  418   2HD2  LEU  58          HD22      LEU  58  73.817  -3.226  -1.993
  419   3HD2  LEU  58          HD21      LEU  58  73.726  -4.968  -1.742
  420    H    ASP  59           HN       ASP  59  78.037  -3.268  -5.027
  421    HA   ASP  59           HA       ASP  59  78.625  -2.219  -2.477
  422   1HB   ASP  59           HB2      ASP  59  80.100  -2.995  -4.814
  423   2HB   ASP  59           HB1      ASP  59  80.741  -1.461  -4.225
  424    H    ALA  60           HN       ALA  60  78.657  -0.504  -5.619
  425    HA   ALA  60           HA       ALA  60  79.248   2.070  -4.543
  426   1HB   ALA  60           HB2      ALA  60  78.834   1.034  -7.074
  427   2HB   ALA  60           HB1      ALA  60  77.439   2.092  -6.857
  428   3HB   ALA  60           HB3      ALA  60  79.072   2.742  -6.703
  429    H    ILE  61           HN       ILE  61  76.230   0.286  -4.893
  430    HA   ILE  61           HA       ILE  61  74.413   2.420  -4.381
  431    HB   ILE  61           HB       ILE  61  74.303  -0.563  -3.920
  432   1HG1  ILE  61          HG12      ILE  61  72.800   1.346  -5.741
  433   2HG1  ILE  61          HG11      ILE  61  74.130   0.293  -6.228
  434   1HG2  ILE  61          HG21      ILE  61  72.272   1.538  -3.146
  435   2HG2  ILE  61          HG23      ILE  61  71.809  -0.130  -3.482
  436   3HG2  ILE  61          HG22      ILE  61  72.915   0.228  -2.156
  437   1HD1  ILE  61          HD12      ILE  61  72.376  -1.438  -4.945
  438   2HD1  ILE  61          HD11      ILE  61  71.305  -0.351  -5.827
  439   3HD1  ILE  61          HD13      ILE  61  72.549  -1.257  -6.690
  440    H    ILE  62           HN       ILE  62  76.090   0.195  -2.157
  441    HA   ILE  62           HA       ILE  62  74.922   1.212   0.245
  442    HB   ILE  62           HB       ILE  62  77.506  -0.236  -0.353
  443   1HG1  ILE  62          HG12      ILE  62  75.372  -1.275   1.442
  444   2HG1  ILE  62          HG11      ILE  62  74.969  -1.154  -0.270
  445   1HG2  ILE  62          HG21      ILE  62  76.843   1.302   2.009
  446   2HG2  ILE  62          HG23      ILE  62  76.964  -0.412   2.407
  447   3HG2  ILE  62          HG22      ILE  62  78.321   0.414   1.641
  448   1HD1  ILE  62          HD11      ILE  62  77.636  -2.262   0.144
  449   2HD1  ILE  62          HD13      ILE  62  76.389  -3.230   0.930
  450   3HD1  ILE  62          HD12      ILE  62  76.291  -2.905  -0.799
  451    H    GLU  63           HN       GLU  63  77.766   2.215  -1.623
  452    HA   GLU  63           HA       GLU  63  78.754   4.085   0.324
  453   1HB   GLU  63           HB2      GLU  63  79.169   3.652  -2.615
  454   2HB   GLU  63           HB1      GLU  63  79.770   5.135  -1.872
  455   1HG   GLU  63           HG2      GLU  63  80.354   2.576  -0.458
  456   2HG   GLU  63           HG1      GLU  63  81.241   2.892  -1.950
  457    H    GLU  64           HN       GLU  64  75.982   4.161  -1.655
  458    HA   GLU  64           HA       GLU  64  75.879   7.142  -1.540
  459   1HB   GLU  64           HB2      GLU  64  74.322   5.133  -3.189
  460   2HB   GLU  64           HB1      GLU  64  73.958   6.858  -3.153
  461   1HG   GLU  64           HG2      GLU  64  76.193   7.388  -3.977
  462   2HG   GLU  64           HG1      GLU  64  76.646   5.684  -3.920
  463    H    VAL  65           HN       VAL  65  74.334   4.226  -0.366
  464    HA   VAL  65           HA       VAL  65  71.982   5.659   0.643
  465    HB   VAL  65           HB       VAL  65  72.934   2.853   1.291
  466   1HG1  VAL  65          HG12      VAL  65  70.917   4.385   2.435
  467   2HG1  VAL  65          HG11      VAL  65  70.066   3.424   1.224
  468   3HG1  VAL  65          HG13      VAL  65  71.020   2.624   2.473
  469   1HG2  VAL  65          HG21      VAL  65  71.627   4.035  -1.088
  470   2HG2  VAL  65          HG23      VAL  65  72.557   2.544  -0.939
  471   3HG2  VAL  65          HG22      VAL  65  70.861   2.577  -0.459
  472    H    ASP  66           HN       ASP  66  74.992   4.329   1.972
  473    HA   ASP  66           HA       ASP  66  74.313   5.026   4.714
  474   1HB   ASP  66           HB2      ASP  66  76.426   3.621   3.350
  475   2HB   ASP  66           HB1      ASP  66  77.127   4.821   4.438
  476    H    GLU  67           HN       GLU  67  73.713   7.304   4.317
  477    HA   GLU  67           HA       GLU  67  75.604   9.226   3.324
  478   1HB   GLU  67           HB2      GLU  67  74.114  10.903   4.351
  479   2HB   GLU  67           HB1      GLU  67  73.181   9.692   3.472
  480   1HG   GLU  67           HG2      GLU  67  73.081   8.455   5.770
  481   2HG   GLU  67           HG1      GLU  67  73.505  10.029   6.445
  482    H    ASP  68           HN       ASP  68  74.764   8.168   6.624
  483    HA   ASP  68           HA       ASP  68  76.829   9.891   7.796
  484   1HB   ASP  68           HB2      ASP  68  76.191   8.547   9.903
  485   2HB   ASP  68           HB1      ASP  68  74.936   9.563   9.191
  486    H    GLY  69           HN       GLY  69  76.849   6.937   6.206
  487   1HA   GLY  69           HA2      GLY  69  78.459   5.239   6.032
  488   2HA   GLY  69           HA1      GLY  69  79.599   6.432   6.658
  489    H    SER  70           HN       SER  70  76.732   5.170   8.322
  490    HA   SER  70           HA       SER  70  78.320   4.597  10.696
  491   1HB   SER  70           HB2      SER  70  76.084   3.593  11.482
  492   2HB   SER  70           HB1      SER  70  76.094   5.316  11.115
  493    HG   SER  70           HG       SER  70  74.741   3.281   9.924
  494    H    GLY  71           HN       GLY  71  77.227   2.801   7.924
  495   1HA   GLY  71           HA2      GLY  71  78.203   0.682   7.297
  496   2HA   GLY  71           HA1      GLY  71  78.629   0.410   8.988
  497    H    THR  72           HN       THR  72  75.481   1.618   8.654
  498    HA   THR  72           HA       THR  72  74.281  -1.096   8.480
  499    HB   THR  72           HB       THR  72  72.791  -0.228  10.492
  500    HG1  THR  72           HG1      THR  72  74.515   0.821  11.912
  501   1HG2  THR  72          HG21      THR  72  75.320  -1.722  10.335
  502   2HG2  THR  72          HG23      THR  72  74.952  -1.100  11.944
  503   3HG2  THR  72          HG22      THR  72  73.803  -2.156  11.122
  504    H    ILE  73           HN       ILE  73  72.188  -1.066   7.613
  505    HA   ILE  73           HA       ILE  73  71.291   1.590   6.601
  506    HB   ILE  73           HB       ILE  73  70.443  -1.190   5.741
  507   1HG1  ILE  73          HG12      ILE  73  72.888  -0.460   5.326
  508   2HG1  ILE  73          HG11      ILE  73  71.961  -1.002   3.928
  509   1HG2  ILE  73          HG21      ILE  73  69.748   1.595   4.872
  510   2HG2  ILE  73          HG23      ILE  73  69.765   0.300   3.676
  511   3HG2  ILE  73          HG22      ILE  73  68.696   0.195   5.074
  512   1HD1  ILE  73          HD12      ILE  73  71.655   1.866   4.456
  513   2HD1  ILE  73          HD11      ILE  73  73.323   1.403   4.114
  514   3HD1  ILE  73          HD13      ILE  73  72.050   1.038   2.949
  515    H    ASP  74           HN       ASP  74  69.307   2.405   7.203
  516    HA   ASP  74           HA       ASP  74  67.713   0.745   9.113
  517   1HB   ASP  74           HB2      ASP  74  68.659   3.490   9.213
  518   2HB   ASP  74           HB1      ASP  74  66.902   3.424   9.352
  519    H    PHE  75           HN       PHE  75  65.367   0.927   8.922
  520    HA   PHE  75           HA       PHE  75  64.256   0.570   6.438
  521   1HB   PHE  75           HB2      PHE  75  63.099   0.425   8.708
  522   2HB   PHE  75           HB1      PHE  75  62.821   2.162   8.570
  523    HD1  PHE  75           HD2      PHE  75  62.757  -0.589   6.037
  524    HD2  PHE  75           HD1      PHE  75  60.569   2.515   8.037
  525    HE1  PHE  75           HE2      PHE  75  60.804  -1.019   4.565
  526    HE2  PHE  75           HE1      PHE  75  58.616   2.087   6.568
  527    HZ   PHE  75           HZ       PHE  75  58.733   0.320   4.831
  528    H    GLU  76           HN       GLU  76  64.916   3.705   7.968
  529    HA   GLU  76           HA       GLU  76  63.575   5.302   6.000
  530   1HB   GLU  76           HB2      GLU  76  65.902   5.930   7.837
  531   2HB   GLU  76           HB1      GLU  76  65.076   7.136   6.850
  532   1HG   GLU  76           HG2      GLU  76  63.049   5.678   8.186
  533   2HG   GLU  76           HG1      GLU  76  64.281   6.041   9.396
  534    H    GLU  77           HN       GLU  77  66.998   4.302   6.289
  535    HA   GLU  77           HA       GLU  77  67.728   5.585   3.784
  536   1HB   GLU  77           HB2      GLU  77  69.170   3.487   5.431
  537   2HB   GLU  77           HB1      GLU  77  69.874   4.373   4.079
  538   1HG   GLU  77           HG2      GLU  77  69.529   6.496   5.259
  539   2HG   GLU  77           HG1      GLU  77  68.761   5.643   6.598
  540    H    PHE  78           HN       PHE  78  66.131   2.674   4.551
  541    HA   PHE  78           HA       PHE  78  67.114   1.034   2.398
  542   1HB   PHE  78           HB2      PHE  78  66.005  -0.296   3.910
  543   2HB   PHE  78           HB1      PHE  78  64.857   0.967   4.339
  544    HD1  PHE  78           HD2      PHE  78  62.927   1.454   2.859
  545    HD2  PHE  78           HD1      PHE  78  65.528  -1.890   2.174
  546    HE1  PHE  78           HE2      PHE  78  61.224   0.438   1.364
  547    HE2  PHE  78           HE1      PHE  78  63.830  -2.909   0.678
  548    HZ   PHE  78           HZ       PHE  78  61.678  -1.745   0.274
  549    H    LEU  79           HN       LEU  79  64.233   3.122   2.747
  550    HA   LEU  79           HA       LEU  79  63.165   2.725   0.156
  551   1HB   LEU  79           HB2      LEU  79  63.155   5.303   1.756
  552   2HB   LEU  79           HB1      LEU  79  62.027   4.865   0.474
  553    HG   LEU  79           HG       LEU  79  62.383   3.251   3.012
  554   1HD1  LEU  79          HD11      LEU  79  60.644   5.595   2.347
  555   2HD1  LEU  79          HD13      LEU  79  59.964   4.303   3.337
  556   3HD1  LEU  79          HD12      LEU  79  61.403   5.164   3.879
  557   1HD2  LEU  79          HD23      LEU  79  61.436   2.277   0.776
  558   2HD2  LEU  79          HD22      LEU  79  60.543   1.992   2.270
  559   3HD2  LEU  79          HD21      LEU  79  60.014   3.249   1.152
  560    H    VAL  80           HN       VAL  80  65.880   4.653   1.250
  561    HA   VAL  80           HA       VAL  80  66.173   6.329  -1.042
  562    HB   VAL  80           HB       VAL  80  68.251   5.205   0.861
  563   1HG1  VAL  80          HG11      VAL  80  68.569   6.600  -1.626
  564   2HG1  VAL  80          HG13      VAL  80  69.050   7.673  -0.312
  565   3HG1  VAL  80          HG12      VAL  80  69.816   6.094  -0.487
  566   1HG2  VAL  80          HG21      VAL  80  66.325   7.426   0.932
  567   2HG2  VAL  80          HG23      VAL  80  67.199   6.654   2.255
  568   3HG2  VAL  80          HG22      VAL  80  67.979   7.914   1.299
  569    H    MET  81           HN       MET  81  67.616   3.149  -0.287
  570    HA   MET  81           HA       MET  81  69.125   2.846  -2.653
  571   1HB   MET  81           HB2      MET  81  68.904   1.320  -0.513
  572   2HB   MET  81           HB1      MET  81  67.682   0.491  -1.478
  573   1HG   MET  81           HG2      MET  81  69.242  -0.052  -3.185
  574   2HG   MET  81           HG1      MET  81  70.431   1.094  -2.569
  575   1HE   MET  81           HE1      MET  81  70.454   0.809   0.410
  576   2HE   MET  81           HE3      MET  81  71.691  -0.426   0.688
  577   3HE   MET  81           HE2      MET  81  71.920   0.788  -0.568
  578    H    MET  82           HN       MET  82  65.710   2.080  -2.026
  579    HA   MET  82           HA       MET  82  65.116   0.810  -4.488
  580   1HB   MET  82           HB2      MET  82  63.567   2.244  -2.395
  581   2HB   MET  82           HB1      MET  82  62.786   2.073  -3.967
  582   1HG   MET  82           HG2      MET  82  62.231   0.158  -2.545
  583   2HG   MET  82           HG1      MET  82  63.231  -0.367  -3.901
  584   1HE   MET  82           HE1      MET  82  65.098  -1.085  -4.045
  585   2HE   MET  82           HE3      MET  82  66.492  -0.940  -2.966
  586   3HE   MET  82           HE2      MET  82  65.444  -2.353  -2.872
  587    H    VAL  83           HN       VAL  83  63.982   4.106  -3.771
  588    HA   VAL  83           HA       VAL  83  63.679   4.857  -6.486
  589    HB   VAL  83           HB       VAL  83  64.284   6.711  -4.167
  590   1HG1  VAL  83          HG11      VAL  83  63.902   7.212  -6.893
  591   2HG1  VAL  83          HG13      VAL  83  62.335   7.557  -6.160
  592   3HG1  VAL  83          HG12      VAL  83  63.780   8.391  -5.588
  593   1HG2  VAL  83          HG22      VAL  83  61.674   5.480  -5.105
  594   2HG2  VAL  83          HG21      VAL  83  62.466   5.202  -3.554
  595   3HG2  VAL  83          HG23      VAL  83  61.794   6.789  -3.928
  596    H    ARG  84           HN       ARG  84  66.567   4.440  -4.708
  597    HA   ARG  84           HA       ARG  84  68.226   6.456  -5.823
  598   1HB   ARG  84           HB2      ARG  84  69.003   5.073  -3.978
  599   2HB   ARG  84           HB1      ARG  84  68.890   3.622  -4.976
  600   1HG   ARG  84           HG2      ARG  84  70.902   4.008  -5.908
  601   2HG   ARG  84           HG1      ARG  84  70.478   5.681  -6.271
  602   1HD   ARG  84           HD2      ARG  84  70.905   5.211  -3.411
  603   2HD   ARG  84           HD1      ARG  84  72.338   4.878  -4.384
  604    HE   ARG  84           HE       ARG  84  72.543   7.230  -4.355
  605   1HH1  ARG  84          HH21      ARG  84  71.061   7.674  -6.754
  606   2HH1  ARG  84          HH22      ARG  84  69.705   8.633  -6.267
  607   1HH2  ARG  84          HH11      ARG  84  70.024   7.853  -2.903
  608   2HH2  ARG  84          HH12      ARG  84  69.117   8.737  -4.086
  609    H    GLN  85           HN       GLN  85  67.565   3.137  -6.988
  610    HA   GLN  85           HA       GLN  85  68.812   3.914  -9.587
  611   1HB   GLN  85           HB2      GLN  85  68.772   1.425 -10.027
  612   2HB   GLN  85           HB1      GLN  85  69.787   1.904  -8.668
  613   1HG   GLN  85           HG2      GLN  85  67.071   1.466  -7.776
  614   2HG   GLN  85           HG1      GLN  85  67.673   0.043  -8.627
  615   1HE2  GLN  85          HE22      GLN  85  70.056   1.252  -5.504
  616   2HE2  GLN  85          HE21      GLN  85  69.497   2.405  -6.618
  617    H    MET  86           HN       MET  86  65.805   3.417  -8.075
  618    HA   MET  86           HA       MET  86  64.293   2.348 -10.267
  619   1HB   MET  86           HB2      MET  86  63.769   3.384  -7.634
  620   2HB   MET  86           HB1      MET  86  62.639   4.113  -8.778
  621   1HG   MET  86           HG2      MET  86  62.967   1.294  -9.345
  622   2HG   MET  86           HG1      MET  86  62.488   1.529  -7.664
  623   1HE   MET  86           HE1      MET  86  60.681   2.080  -6.798
  624   2HE   MET  86           HE3      MET  86  60.162   3.690  -7.318
  625   3HE   MET  86           HE2      MET  86  59.086   2.307  -7.512
  626    H    LYS  87           HN       LYS  87  65.336   5.607  -9.425
  627    HA   LYS  87           HA       LYS  87  63.781   6.732 -11.688
  628   1HB   LYS  87           HB2      LYS  87  64.646   7.734  -9.174
  629   2HB   LYS  87           HB1      LYS  87  65.498   8.656 -10.412
  630   1HG   LYS  87           HG2      LYS  87  63.508   9.429 -11.389
  631   2HG   LYS  87           HG1      LYS  87  62.544   8.139 -10.668
  632   1HD   LYS  87           HD2      LYS  87  62.665   9.131  -8.498
  633   2HD   LYS  87           HD1      LYS  87  63.932  10.247  -9.002
  634   1HE   LYS  87           HE2      LYS  87  62.344  11.340 -10.554
  635   2HE   LYS  87           HE1      LYS  87  61.075  10.238 -10.020
  636   1HZ   LYS  87           HZ2      LYS  87  61.623  11.088  -7.700
  637   2HZ   LYS  87           HZ1      LYS  87  62.441  12.358  -8.480
  638   3HZ   LYS  87           HZ3      LYS  87  60.779  12.139  -8.734
  639    H    GLU  88           HN       GLU  88  65.555   5.075 -12.781
  640    HA   GLU  88           HA       GLU  88  67.489   4.892 -14.111
  641   1HB   GLU  88           HB2      GLU  88  66.967   7.843 -14.571
  642   2HB   GLU  88           HB1      GLU  88  67.746   6.707 -15.675
  643   1HG   GLU  88           HG2      GLU  88  65.366   5.442 -15.230
  644   2HG   GLU  88           HG1      GLU  88  64.872   7.134 -15.131
  645    H    ASP  89           HN       ASP  89  69.269   7.223 -14.639
  646    HA   ASP  89           HA       ASP  89  70.388   7.905 -12.009
  647   1HB   ASP  89           HB2      ASP  89  71.261   5.558 -13.231
  648   2HB   ASP  89           HB1      ASP  89  72.490   6.744 -13.671
  649    H    ALA  90           HN       ALA  90  69.337   9.562 -14.005
  650    HA   ALA  90           HA       ALA  90  71.477  10.578 -15.706
  651   1HB   ALA  90           HB2      ALA  90  68.679  10.867 -15.577
  652   2HB   ALA  90           HB1      ALA  90  69.332  12.474 -15.255
  653   3HB   ALA  90           HB3      ALA  90  69.769  11.625 -16.738
   
  No H/Q in entry =         653
  Start of MODEL   10
    1   1H    ALA   1           HT3      ALA   1  62.135  16.053  11.693
    2   2H    ALA   1           HT2      ALA   1  60.764  16.435  12.622
    3   3H    ALA   1           HT1      ALA   1  60.590  15.960  11.000
    4    HA   ALA   1           HA       ALA   1  60.314  18.278  10.988
    5   1HB   ALA   1           HB1      ALA   1  62.634  18.166  12.903
    6   2HB   ALA   1           HB3      ALA   1  62.310  19.642  11.993
    7   3HB   ALA   1           HB2      ALA   1  61.087  18.991  13.084
    8    H    SER   2           HN       SER   2  63.842  18.056  11.163
    9    HA   SER   2           HA       SER   2  63.988  18.736   8.301
   10   1HB   SER   2           HB2      SER   2  66.453  18.134   9.860
   11   2HB   SER   2           HB1      SER   2  66.129  19.448   8.733
   12    HG   SER   2           HG       SER   2  64.755  20.343  10.371
   13    H    MET   3           HN       MET   3  65.452  17.467   6.859
   14    HA   MET   3           HA       MET   3  66.172  14.750   7.600
   15   1HB   MET   3           HB2      MET   3  64.613  13.564   6.178
   16   2HB   MET   3           HB1      MET   3  63.677  14.584   7.272
   17   1HG   MET   3           HG2      MET   3  63.618  16.338   5.463
   18   2HG   MET   3           HG1      MET   3  64.364  15.165   4.377
   19   1HE   MET   3           HE2      MET   3  61.618  15.607   7.014
   20   2HE   MET   3           HE1      MET   3  61.136  16.621   5.657
   21   3HE   MET   3           HE3      MET   3  60.147  15.230   6.121
   22    H    THR   4           HN       THR   4  67.737  14.007   6.192
   23    HA   THR   4           HA       THR   4  69.074  15.702   4.425
   24    HB   THR   4           HB       THR   4  69.965  13.596   3.360
   25    HG1  THR   4           HG1      THR   4  69.062  11.727   3.821
   26   1HG2  THR   4          HG23      THR   4  69.821  13.721   6.383
   27   2HG2  THR   4          HG22      THR   4  70.962  12.721   5.483
   28   3HG2  THR   4          HG21      THR   4  71.036  14.479   5.355
   29    H    ASP   5           HN       ASP   5  69.110  15.789   2.064
   30    HA   ASP   5           HA       ASP   5  66.469  15.954   0.916
   31   1HB   ASP   5           HB2      ASP   5  69.195  15.998  -0.420
   32   2HB   ASP   5           HB1      ASP   5  67.676  16.454  -1.195
   33    H    GLN   6           HN       GLN   6  69.034  13.532   0.830
   34    HA   GLN   6           HA       GLN   6  68.080  11.942  -1.315
   35   1HB   GLN   6           HB2      GLN   6  69.439  11.058   1.250
   36   2HB   GLN   6           HB1      GLN   6  69.277  10.073  -0.205
   37   1HG   GLN   6           HG2      GLN   6  70.674  11.525  -1.471
   38   2HG   GLN   6           HG1      GLN   6  70.581  12.800  -0.254
   39   1HE2  GLN   6          HE22      GLN   6  72.749   9.502   0.907
   40   2HE2  GLN   6          HE21      GLN   6  71.243   9.282   0.158
   41    H    GLN   7           HN       GLN   7  67.219  11.880   2.145
   42    HA   GLN   7           HA       GLN   7  65.310   9.709   1.790
   43   1HB   GLN   7           HB2      GLN   7  65.729  11.682   4.056
   44   2HB   GLN   7           HB1      GLN   7  64.620  10.313   4.121
   45   1HG   GLN   7           HG2      GLN   7  66.446   8.744   3.816
   46   2HG   GLN   7           HG1      GLN   7  67.587  10.064   3.558
   47   1HE2  GLN   7          HE22      GLN   7  67.757   8.958   7.157
   48   2HE2  GLN   7          HE21      GLN   7  67.941   8.147   5.676
   49    H    ALA   8           HN       ALA   8  65.262  13.081   1.212
   50    HA   ALA   8           HA       ALA   8  62.453  13.559   1.705
   51   1HB   ALA   8           HB1      ALA   8  64.585  14.987   0.118
   52   2HB   ALA   8           HB3      ALA   8  62.905  15.524   0.079
   53   3HB   ALA   8           HB2      ALA   8  63.789  15.505   1.605
   54    H    GLU   9           HN       GLU   9  64.193  13.378  -1.425
   55    HA   GLU   9           HA       GLU   9  61.812  13.007  -2.964
   56   1HB   GLU   9           HB2      GLU   9  64.740  12.672  -3.444
   57   2HB   GLU   9           HB1      GLU   9  63.632  11.916  -4.588
   58   1HG   GLU   9           HG2      GLU   9  63.850  14.032  -5.531
   59   2HG   GLU   9           HG1      GLU   9  62.435  14.272  -4.506
   60    H    ALA  10           HN       ALA  10  63.560  10.856  -0.946
   61    HA   ALA  10           HA       ALA  10  62.974   8.379  -2.284
   62   1HB   ALA  10           HB1      ALA  10  64.618   8.797  -0.341
   63   2HB   ALA  10           HB3      ALA  10  63.205   8.701   0.711
   64   3HB   ALA  10           HB2      ALA  10  63.665   7.314  -0.277
   65    H    ARG  11           HN       ARG  11  61.445   9.713   0.674
   66    HA   ARG  11           HA       ARG  11  59.151   7.979   0.447
   67   1HB   ARG  11           HB2      ARG  11  59.796  10.425   2.082
   68   2HB   ARG  11           HB1      ARG  11  58.174   9.733   2.107
   69   1HG   ARG  11           HG2      ARG  11  58.837   8.021   3.418
   70   2HG   ARG  11           HG1      ARG  11  60.220   7.678   2.380
   71   1HD   ARG  11           HD2      ARG  11  61.100   8.300   4.531
   72   2HD   ARG  11           HD1      ARG  11  61.384   9.660   3.447
   73    HE   ARG  11           HE       ARG  11  59.690  10.901   4.618
   74   1HH1  ARG  11          HH11      ARG  11  57.570   9.046   5.186
   75   2HH1  ARG  11          HH12      ARG  11  57.763   8.670   6.865
   76   1HH2  ARG  11          HH21      ARG  11  61.030   9.822   7.022
   77   2HH2  ARG  11          HH22      ARG  11  59.721   9.108   7.905
   78    H    ALA  12           HN       ALA  12  59.969  11.102  -0.873
   79    HA   ALA  12           HA       ALA  12  57.315  12.016  -1.460
   80   1HB   ALA  12           HB3      ALA  12  59.934  12.952  -1.870
   81   2HB   ALA  12           HB2      ALA  12  59.245  12.794  -3.484
   82   3HB   ALA  12           HB1      ALA  12  58.439  13.793  -2.275
   83    H    PHE  13           HN       PHE  13  59.538   9.847  -3.139
   84    HA   PHE  13           HA       PHE  13  57.744   9.640  -5.470
   85   1HB   PHE  13           HB2      PHE  13  60.277   9.540  -5.627
   86   2HB   PHE  13           HB1      PHE  13  60.189   7.966  -4.835
   87    HD1  PHE  13           HD1      PHE  13  58.013   9.586  -7.423
   88    HD2  PHE  13           HD2      PHE  13  60.609   6.312  -6.432
   89    HE1  PHE  13           HE1      PHE  13  57.496   8.517  -9.601
   90    HE2  PHE  13           HE2      PHE  13  60.094   5.243  -8.611
   91    HZ   PHE  13           HZ       PHE  13  58.538   6.346 -10.195
   92    H    LEU  14           HN       LEU  14  58.559   7.846  -2.559
   93    HA   LEU  14           HA       LEU  14  56.888   5.558  -3.421
   94   1HB   LEU  14           HB2      LEU  14  58.405   5.976  -0.828
   95   2HB   LEU  14           HB1      LEU  14  57.695   4.464  -1.396
   96    HG   LEU  14           HG       LEU  14  59.819   5.987  -2.925
   97   1HD1  LEU  14          HD13      LEU  14  60.324   4.879  -0.537
   98   2HD1  LEU  14          HD12      LEU  14  60.411   3.420  -1.525
   99   3HD1  LEU  14          HD11      LEU  14  61.475   4.782  -1.869
  100   1HD2  LEU  14          HD21      LEU  14  58.216   3.537  -3.341
  101   2HD2  LEU  14          HD23      LEU  14  59.009   4.577  -4.525
  102   3HD2  LEU  14          HD22      LEU  14  59.941   3.354  -3.659
  103    H    SER  15           HN       SER  15  54.882   5.109  -2.522
  104    HA   SER  15           HA       SER  15  53.729   7.253  -0.805
  105   1HB   SER  15           HB2      SER  15  52.392   5.074  -2.437
  106   2HB   SER  15           HB1      SER  15  51.539   6.280  -1.478
  107    HG   SER  15           HG       SER  15  52.734   7.858  -2.777
  108    H    GLU  16           HN       GLU  16  52.207   6.490   0.938
  109    HA   GLU  16           HA       GLU  16  53.492   4.665   2.706
  110   1HB   GLU  16           HB2      GLU  16  50.789   5.960   2.601
  111   2HB   GLU  16           HB1      GLU  16  51.058   4.655   3.757
  112   1HG   GLU  16           HG2      GLU  16  51.860   6.310   5.096
  113   2HG   GLU  16           HG1      GLU  16  53.319   6.151   4.117
  114    H    GLU  17           HN       GLU  17  51.325   4.123   0.060
  115    HA   GLU  17           HA       GLU  17  50.281   1.575   0.913
  116   1HB   GLU  17           HB2      GLU  17  49.589   3.204  -1.074
  117   2HB   GLU  17           HB1      GLU  17  50.694   2.176  -1.988
  118   1HG   GLU  17           HG2      GLU  17  49.422   0.184  -0.996
  119   2HG   GLU  17           HG1      GLU  17  48.202   1.354  -0.489
  120    H    MET  18           HN       MET  18  52.908   2.399  -1.382
  121    HA   MET  18           HA       MET  18  53.778  -0.363  -1.586
  122   1HB   MET  18           HB2      MET  18  54.156   1.380  -3.358
  123   2HB   MET  18           HB1      MET  18  55.325   2.151  -2.283
  124   1HG   MET  18           HG2      MET  18  56.917   0.686  -2.894
  125   2HG   MET  18           HG1      MET  18  55.883  -0.671  -2.442
  126   1HE   MET  18           HE1      MET  18  58.064  -0.145  -4.473
  127   2HE   MET  18           HE3      MET  18  57.482  -1.721  -5.026
  128   3HE   MET  18           HE2      MET  18  57.626  -0.383  -6.163
  129    H    ILE  19           HN       ILE  19  55.292   2.524  -0.090
  130    HA   ILE  19           HA       ILE  19  57.487   1.353   1.126
  131    HB   ILE  19           HB       ILE  19  55.606   3.402   2.339
  132   1HG1  ILE  19          HG12      ILE  19  58.114   3.607   0.646
  133   2HG1  ILE  19          HG11      ILE  19  56.495   4.167   0.225
  134   1HG2  ILE  19          HG22      ILE  19  57.693   2.012   3.578
  135   2HG2  ILE  19          HG21      ILE  19  58.414   3.547   3.099
  136   3HG2  ILE  19          HG23      ILE  19  56.980   3.529   4.125
  137   1HD1  ILE  19          HD11      ILE  19  58.179   5.228   2.514
  138   2HD1  ILE  19          HD13      ILE  19  57.918   6.046   0.973
  139   3HD1  ILE  19          HD12      ILE  19  56.567   5.791   2.077
  140    H    ALA  20           HN       ALA  20  54.120   0.900   1.939
  141    HA   ALA  20           HA       ALA  20  54.492  -0.186   4.571
  142   1HB   ALA  20           HB3      ALA  20  52.323  -0.268   2.510
  143   2HB   ALA  20           HB2      ALA  20  52.247  -1.411   3.851
  144   3HB   ALA  20           HB1      ALA  20  52.268   0.324   4.170
  145    H    GLU  21           HN       GLU  21  54.139  -1.780   1.384
  146    HA   GLU  21           HA       GLU  21  54.546  -4.430   2.404
  147   1HB   GLU  21           HB2      GLU  21  54.597  -5.127   0.153
  148   2HB   GLU  21           HB1      GLU  21  53.594  -3.677   0.106
  149   1HG   GLU  21           HG2      GLU  21  55.892  -2.456  -0.317
  150   2HG   GLU  21           HG1      GLU  21  56.419  -4.057  -0.838
  151    H    PHE  22           HN       PHE  22  56.740  -1.861   1.493
  152    HA   PHE  22           HA       PHE  22  59.093  -3.525   1.237
  153   1HB   PHE  22           HB2      PHE  22  58.606  -0.577   1.616
  154   2HB   PHE  22           HB1      PHE  22  60.241  -1.229   1.727
  155    HD1  PHE  22           HD1      PHE  22  57.916  -3.007  -0.425
  156    HD2  PHE  22           HD2      PHE  22  60.799   0.176  -0.297
  157    HE1  PHE  22           HE1      PHE  22  58.070  -3.048  -2.899
  158    HE2  PHE  22           HE2      PHE  22  60.952   0.134  -2.770
  159    HZ   PHE  22           HZ       PHE  22  59.588  -1.477  -4.072
  160    H    LYS  23           HN       LYS  23  57.443  -1.982   3.930
  161    HA   LYS  23           HA       LYS  23  59.582  -2.191   5.835
  162   1HB   LYS  23           HB2      LYS  23  57.031  -1.138   5.858
  163   2HB   LYS  23           HB1      LYS  23  56.878  -2.533   6.928
  164   1HG   LYS  23           HG2      LYS  23  59.325  -0.926   7.327
  165   2HG   LYS  23           HG1      LYS  23  57.821  -0.098   7.728
  166   1HD   LYS  23           HD2      LYS  23  57.164  -2.029   9.151
  167   2HD   LYS  23           HD1      LYS  23  58.712  -2.795   8.791
  168   1HE   LYS  23           HE2      LYS  23  58.526  -1.421  10.984
  169   2HE   LYS  23           HE1      LYS  23  59.936  -1.152   9.958
  170   1HZ   LYS  23           HZ1      LYS  23  57.467   0.470   9.752
  171   2HZ   LYS  23           HZ3      LYS  23  58.762   0.898  10.760
  172   3HZ   LYS  23           HZ2      LYS  23  58.992   0.801   9.079
  173    H    ALA  24           HN       ALA  24  57.481  -4.539   4.431
  174    HA   ALA  24           HA       ALA  24  57.627  -6.471   6.595
  175   1HB   ALA  24           HB2      ALA  24  56.159  -6.242   4.250
  176   2HB   ALA  24           HB1      ALA  24  57.247  -7.588   3.915
  177   3HB   ALA  24           HB3      ALA  24  56.177  -7.647   5.315
  178    H    ALA  25           HN       ALA  25  59.667  -5.607   3.894
  179    HA   ALA  25           HA       ALA  25  61.216  -8.078   3.943
  180   1HB   ALA  25           HB2      ALA  25  61.136  -5.641   2.368
  181   2HB   ALA  25           HB1      ALA  25  62.795  -6.051   2.802
  182   3HB   ALA  25           HB3      ALA  25  61.794  -7.219   1.939
  183    H    PHE  26           HN       PHE  26  62.296  -4.729   4.619
  184    HA   PHE  26           HA       PHE  26  64.601  -5.427   6.066
  185   1HB   PHE  26           HB2      PHE  26  64.382  -3.151   5.481
  186   2HB   PHE  26           HB1      PHE  26  62.761  -3.037   6.164
  187    HD1  PHE  26           HD2      PHE  26  62.440  -3.001   8.627
  188    HD2  PHE  26           HD1      PHE  26  66.342  -2.879   6.844
  189    HE1  PHE  26           HE2      PHE  26  63.394  -2.206  10.775
  190    HE2  PHE  26           HE1      PHE  26  67.300  -2.080   8.989
  191    HZ   PHE  26           HZ       PHE  26  65.825  -1.744  10.954
  192    H    ASP  27           HN       ASP  27  61.251  -5.539   7.021
  193    HA   ASP  27           HA       ASP  27  61.488  -5.490   9.840
  194   1HB   ASP  27           HB2      ASP  27  59.516  -6.349   7.888
  195   2HB   ASP  27           HB1      ASP  27  59.553  -7.436   9.277
  196    H    MET  28           HN       MET  28  61.775  -8.256   7.596
  197    HA   MET  28           HA       MET  28  62.397 -10.105   9.761
  198   1HB   MET  28           HB2      MET  28  62.789 -11.733   7.976
  199   2HB   MET  28           HB1      MET  28  61.296 -10.847   7.663
  200   1HG   MET  28           HG2      MET  28  62.285  -9.536   5.973
  201   2HG   MET  28           HG1      MET  28  63.920  -9.918   6.511
  202   1HE   MET  28           HE2      MET  28  61.174 -10.346   4.424
  203   2HE   MET  28           HE1      MET  28  62.519 -10.380   3.288
  204   3HE   MET  28           HE3      MET  28  61.420 -11.762   3.405
  205    H    PHE  29           HN       PHE  29  64.234  -7.960   7.727
  206    HA   PHE  29           HA       PHE  29  66.762  -9.369   8.341
  207   1HB   PHE  29           HB2      PHE  29  66.091  -6.948   6.657
  208   2HB   PHE  29           HB1      PHE  29  67.752  -7.435   6.990
  209    HD1  PHE  29           HD1      PHE  29  65.893 -10.384   7.049
  210    HD2  PHE  29           HD2      PHE  29  67.401  -7.467   4.267
  211    HE1  PHE  29           HE1      PHE  29  65.766 -12.054   5.227
  212    HE2  PHE  29           HE2      PHE  29  67.269  -9.149   2.450
  213    HZ   PHE  29           HZ       PHE  29  66.454 -11.438   2.928
  214    H    ASP  30           HN       ASP  30  64.804  -7.200   9.925
  215    HA   ASP  30           HA       ASP  30  67.161  -6.034  11.355
  216   1HB   ASP  30           HB2      ASP  30  65.948  -4.027  11.748
  217   2HB   ASP  30           HB1      ASP  30  65.651  -4.413  10.052
  218    H    ALA  31           HN       ALA  31  64.848  -8.330  11.605
  219    HA   ALA  31           HA       ALA  31  63.904  -7.803  14.319
  220   1HB   ALA  31           HB1      ALA  31  63.272  -9.624  12.196
  221   2HB   ALA  31           HB3      ALA  31  63.602 -10.553  13.658
  222   3HB   ALA  31           HB2      ALA  31  62.361  -9.299  13.672
  223    H    ASP  32           HN       ASP  32  66.930  -8.241  13.571
  224    HA   ASP  32           HA       ASP  32  67.651 -10.640  15.041
  225   1HB   ASP  32           HB2      ASP  32  68.990  -8.679  13.426
  226   2HB   ASP  32           HB1      ASP  32  69.849  -8.841  14.958
  227    H    GLY  33           HN       GLY  33  66.328  -7.842  16.127
  228   1HA   GLY  33           HA2      GLY  33  66.026  -7.454  18.509
  229   2HA   GLY  33           HA1      GLY  33  67.605  -8.187  18.792
  230    H    GLY  34           HN       GLY  34  68.455  -6.500  16.292
  231   1HA   GLY  34           HA2      GLY  34  69.254  -4.152  17.912
  232   2HA   GLY  34           HA1      GLY  34  69.949  -4.617  16.358
  233    H    GLY  35           HN       GLY  35  67.289  -4.999  15.119
  234   1HA   GLY  35           HA2      GLY  35  65.486  -3.701  14.255
  235   2HA   GLY  35           HA1      GLY  35  66.035  -2.338  15.232
  236    H    ASP  36           HN       ASP  36  68.071  -4.225  13.039
  237    HA   ASP  36           HA       ASP  36  67.946  -2.243  10.906
  238   1HB   ASP  36           HB2      ASP  36  70.325  -1.528  11.131
  239   2HB   ASP  36           HB1      ASP  36  69.336  -0.999  12.493
  240    H    ILE  37           HN       ILE  37  69.587  -2.807   9.168
  241    HA   ILE  37           HA       ILE  37  70.366  -5.687   9.336
  242    HB   ILE  37           HB       ILE  37  68.580  -5.855   7.872
  243   1HG1  ILE  37          HG12      ILE  37  70.885  -5.027   6.084
  244   2HG1  ILE  37          HG11      ILE  37  70.515  -6.661   6.634
  245   1HG2  ILE  37          HG21      ILE  37  68.019  -3.458   7.923
  246   2HG2  ILE  37          HG23      ILE  37  69.318  -3.126   6.777
  247   3HG2  ILE  37          HG22      ILE  37  67.925  -4.087   6.278
  248   1HD1  ILE  37          HD11      ILE  37  68.219  -6.324   5.509
  249   2HD1  ILE  37          HD13      ILE  37  68.960  -4.938   4.705
  250   3HD1  ILE  37          HD12      ILE  37  69.609  -6.559   4.448
  251    H    SER  38           HN       SER  38  72.047  -6.203   7.607
  252    HA   SER  38           HA       SER  38  74.072  -4.025   7.627
  253   1HB   SER  38           HB2      SER  38  74.380  -6.954   6.902
  254   2HB   SER  38           HB1      SER  38  75.687  -5.788   7.088
  255    HG   SER  38           HG       SER  38  75.526  -6.811   9.023
  256    H    THR  39           HN       THR  39  75.254  -3.547   5.619
  257    HA   THR  39           HA       THR  39  73.494  -3.373   3.339
  258    HB   THR  39           HB       THR  39  75.240  -2.228   2.239
  259    HG1  THR  39           HG1      THR  39  77.422  -2.438   3.357
  260   1HG2  THR  39          HG23      THR  39  74.927  -1.786   5.125
  261   2HG2  THR  39          HG22      THR  39  76.429  -1.134   4.472
  262   3HG2  THR  39          HG21      THR  39  74.881  -0.628   3.797
  263    H    LYS  40           HN       LYS  40  75.754  -5.745   4.447
  264    HA   LYS  40           HA       LYS  40  76.330  -6.987   1.915
  265   1HB   LYS  40           HB2      LYS  40  77.128  -8.860   3.210
  266   2HB   LYS  40           HB1      LYS  40  77.565  -7.398   4.096
  267   1HG   LYS  40           HG2      LYS  40  75.630  -7.659   5.560
  268   2HG   LYS  40           HG1      LYS  40  75.087  -9.059   4.635
  269   1HD   LYS  40           HD2      LYS  40  77.461 -10.018   5.179
  270   2HD   LYS  40           HD1      LYS  40  77.456  -8.816   6.471
  271   1HE   LYS  40           HE2      LYS  40  75.661  -9.812   7.577
  272   2HE   LYS  40           HE1      LYS  40  75.072 -10.606   6.117
  273   1HZ   LYS  40           HZ2      LYS  40  77.713 -11.442   6.770
  274   2HZ   LYS  40           HZ1      LYS  40  76.648 -11.721   8.065
  275   3HZ   LYS  40           HZ3      LYS  40  76.314 -12.378   6.536
  276    H    ALA  41           HN       ALA  41  73.627  -7.104   4.122
  277    HA   ALA  41           HA       ALA  41  72.436  -9.438   2.763
  278   1HB   ALA  41           HB3      ALA  41  72.244  -8.969   5.274
  279   2HB   ALA  41           HB2      ALA  41  71.129  -7.672   4.843
  280   3HB   ALA  41           HB1      ALA  41  70.737  -9.343   4.438
  281    H    LEU  42           HN       LEU  42  72.664  -6.167   2.139
  282    HA   LEU  42           HA       LEU  42  69.995  -5.501   1.356
  283   1HB   LEU  42           HB2      LEU  42  72.724  -4.450   0.777
  284   2HB   LEU  42           HB1      LEU  42  71.435  -3.991  -0.337
  285    HG   LEU  42           HG       LEU  42  71.727  -2.400   1.598
  286   1HD1  LEU  42          HD11      LEU  42  69.506  -3.028   0.319
  287   2HD1  LEU  42          HD13      LEU  42  69.050  -3.724   1.876
  288   3HD1  LEU  42          HD12      LEU  42  69.440  -2.006   1.755
  289   1HD2  LEU  42          HD22      LEU  42  71.959  -4.699   3.086
  290   2HD2  LEU  42          HD21      LEU  42  71.617  -3.106   3.757
  291   3HD2  LEU  42          HD23      LEU  42  70.294  -4.222   3.420
  292    H    GLY  43           HN       GLY  43  72.740  -6.771  -0.568
  293   1HA   GLY  43           HA2      GLY  43  71.402  -6.972  -3.047
  294   2HA   GLY  43           HA1      GLY  43  72.704  -8.052  -2.542
  295    H    THR  44           HN       THR  44  71.092  -8.850  -0.136
  296    HA   THR  44           HA       THR  44  69.731 -11.112  -1.352
  297    HB   THR  44           HB       THR  44  70.202 -10.118   1.444
  298    HG1  THR  44           HG1      THR  44  70.839 -12.472   1.456
  299   1HG2  THR  44          HG21      THR  44  67.966 -11.852   0.554
  300   2HG2  THR  44          HG23      THR  44  68.895 -12.439   1.934
  301   3HG2  THR  44          HG22      THR  44  68.114 -10.858   2.004
  302    H    VAL  45           HN       VAL  45  68.734  -8.081   0.196
  303    HA   VAL  45           HA       VAL  45  65.917  -8.659   0.219
  304    HB   VAL  45           HB       VAL  45  67.187  -5.917  -0.013
  305   1HG1  VAL  45          HG13      VAL  45  64.522  -6.791   0.136
  306   2HG1  VAL  45          HG12      VAL  45  64.915  -6.236   1.764
  307   3HG1  VAL  45          HG11      VAL  45  65.107  -5.147   0.390
  308   1HG2  VAL  45          HG22      VAL  45  68.058  -7.579   1.842
  309   2HG2  VAL  45          HG21      VAL  45  67.646  -5.922   2.277
  310   3HG2  VAL  45          HG23      VAL  45  66.506  -7.227   2.600
  311    H    MET  46           HN       MET  46  67.950  -6.802  -2.060
  312    HA   MET  46           HA       MET  46  65.936  -6.099  -3.904
  313   1HB   MET  46           HB2      MET  46  68.843  -6.810  -4.388
  314   2HB   MET  46           HB1      MET  46  67.795  -6.072  -5.599
  315   1HG   MET  46           HG2      MET  46  67.952  -4.786  -2.904
  316   2HG   MET  46           HG1      MET  46  69.313  -4.576  -4.006
  317   1HE   MET  46           HE1      MET  46  69.542  -2.673  -5.095
  318   2HE   MET  46           HE3      MET  46  68.319  -1.468  -5.518
  319   3HE   MET  46           HE2      MET  46  68.653  -1.836  -3.827
  320    H    ARG  47           HN       ARG  47  67.472  -9.187  -3.329
  321    HA   ARG  47           HA       ARG  47  66.614 -10.386  -5.837
  322   1HB   ARG  47           HB2      ARG  47  67.763 -11.415  -3.255
  323   2HB   ARG  47           HB1      ARG  47  67.078 -12.548  -4.421
  324   1HG   ARG  47           HG2      ARG  47  68.588 -11.772  -6.151
  325   2HG   ARG  47           HG1      ARG  47  69.185 -10.480  -5.109
  326   1HD   ARG  47           HD2      ARG  47  70.497 -11.896  -3.871
  327   2HD   ARG  47           HD1      ARG  47  69.364 -13.241  -4.019
  328    HE   ARG  47           HE       ARG  47  70.285 -13.670  -6.267
  329   1HH1  ARG  47          HH11      ARG  47  72.336 -12.661  -3.861
  330   2HH1  ARG  47          HH12      ARG  47  73.637 -12.187  -4.900
  331   1HH2  ARG  47          HH21      ARG  47  71.777 -12.497  -7.810
  332   2HH2  ARG  47          HH22      ARG  47  73.321 -12.094  -7.137
  333    H    MET  48           HN       MET  48  65.313 -10.185  -2.548
  334    HA   MET  48           HA       MET  48  63.138 -12.035  -3.032
  335   1HB   MET  48           HB2      MET  48  63.608  -9.906  -0.932
  336   2HB   MET  48           HB1      MET  48  62.175 -10.934  -0.947
  337   1HG   MET  48           HG2      MET  48  63.704 -12.937  -0.960
  338   2HG   MET  48           HG1      MET  48  65.059 -11.835  -0.722
  339   1HE   MET  48           HE1      MET  48  64.209  -9.638   0.971
  340   2HE   MET  48           HE3      MET  48  64.414 -10.175   2.644
  341   3HE   MET  48           HE2      MET  48  65.623 -10.583   1.430
  342    H    LEU  49           HN       LEU  49  63.178  -8.465  -2.697
  343    HA   LEU  49           HA       LEU  49  60.522  -7.960  -3.420
  344   1HB   LEU  49           HB2      LEU  49  62.737  -6.220  -4.490
  345   2HB   LEU  49           HB1      LEU  49  61.165  -5.739  -3.856
  346    HG   LEU  49           HG       LEU  49  63.586  -6.691  -2.320
  347   1HD1  LEU  49          HD12      LEU  49  62.046  -4.182  -2.664
  348   2HD1  LEU  49          HD11      LEU  49  62.536  -4.553  -1.010
  349   3HD1  LEU  49          HD13      LEU  49  63.752  -4.415  -2.279
  350   1HD2  LEU  49          HD23      LEU  49  60.678  -6.617  -1.487
  351   2HD2  LEU  49          HD22      LEU  49  61.825  -7.946  -1.319
  352   3HD2  LEU  49          HD21      LEU  49  61.988  -6.508  -0.309
  353    H    GLY  50           HN       GLY  50  63.326  -8.428  -5.573
  354   1HA   GLY  50           HA2      GLY  50  62.599  -9.843  -7.622
  355   2HA   GLY  50           HA1      GLY  50  61.425  -8.549  -7.872
  356    H    GLN  51           HN       GLN  51  63.126  -6.365  -7.126
  357    HA   GLN  51           HA       GLN  51  64.345  -5.732  -9.589
  358   1HB   GLN  51           HB2      GLN  51  64.673  -4.690  -6.788
  359   2HB   GLN  51           HB1      GLN  51  65.732  -4.101  -8.069
  360   1HG   GLN  51           HG2      GLN  51  64.081  -2.635  -8.559
  361   2HG   GLN  51           HG1      GLN  51  63.216  -4.015  -9.237
  362   1HE2  GLN  51          HE22      GLN  51  62.122  -2.587  -5.544
  363   2HE2  GLN  51          HE21      GLN  51  63.642  -2.180  -6.181
  364    H    ASN  52           HN       ASN  52  66.178  -6.493 -10.527
  365    HA   ASN  52           HA       ASN  52  68.297  -7.617  -8.742
  366   1HB   ASN  52           HB2      ASN  52  66.811  -8.888 -10.905
  367   2HB   ASN  52           HB1      ASN  52  68.551  -8.933 -11.190
  368   1HD2  ASN  52          HD22      ASN  52  67.487 -10.503  -7.550
  369   2HD2  ASN  52          HD21      ASN  52  66.921  -8.967  -8.001
  370    HA   PRO  53           HA       PRO  53  70.173  -4.370 -11.355
  371   1HB   PRO  53           HB2      PRO  53  71.691  -3.331  -9.311
  372   2HB   PRO  53           HB1      PRO  53  70.026  -2.829  -9.647
  373   1HG   PRO  53           HG2      PRO  53  71.054  -4.562  -7.450
  374   2HG   PRO  53           HG1      PRO  53  69.604  -3.546  -7.492
  375   1HD   PRO  53           HD2      PRO  53  69.670  -6.358  -7.825
  376   2HD   PRO  53           HD1      PRO  53  68.293  -5.294  -8.185
  377    H    THR  54           HN       THR  54  72.785  -3.789 -11.133
  378    HA   THR  54           HA       THR  54  74.094  -6.405 -11.545
  379    HB   THR  54           HB       THR  54  75.946  -5.090 -12.467
  380    HG1  THR  54           HG1      THR  54  74.530  -3.043 -11.209
  381   1HG2  THR  54          HG22      THR  54  73.627  -5.459 -13.676
  382   2HG2  THR  54          HG21      THR  54  73.511  -3.706 -13.525
  383   3HG2  THR  54          HG23      THR  54  74.858  -4.428 -14.406
  384    H    LYS  55           HN       LYS  55  75.859  -7.129 -10.308
  385    HA   LYS  55           HA       LYS  55  75.913  -6.533  -7.554
  386   1HB   LYS  55           HB2      LYS  55  78.105  -7.643  -9.333
  387   2HB   LYS  55           HB1      LYS  55  78.167  -7.642  -7.569
  388   1HG   LYS  55           HG2      LYS  55  76.178  -9.025  -7.440
  389   2HG   LYS  55           HG1      LYS  55  75.946  -8.920  -9.186
  390   1HD   LYS  55           HD2      LYS  55  78.230  -9.992  -9.448
  391   2HD   LYS  55           HD1      LYS  55  78.202 -10.295  -7.710
  392   1HE   LYS  55           HE2      LYS  55  77.292 -12.281  -8.502
  393   2HE   LYS  55           HE1      LYS  55  75.829 -11.332  -8.248
  394   1HZ   LYS  55           HZ2      LYS  55  76.329 -10.577 -10.684
  395   2HZ   LYS  55           HZ1      LYS  55  77.169 -12.052 -10.753
  396   3HZ   LYS  55           HZ3      LYS  55  75.513 -12.037 -10.379
  397    H    GLU  56           HN       GLU  56  77.685  -5.047 -10.225
  398    HA   GLU  56           HA       GLU  56  79.546  -3.551  -8.649
  399   1HB   GLU  56           HB2      GLU  56  79.785  -3.813 -11.089
  400   2HB   GLU  56           HB1      GLU  56  78.318  -2.863 -11.338
  401   1HG   GLU  56           HG2      GLU  56  80.220  -1.497  -9.595
  402   2HG   GLU  56           HG1      GLU  56  80.912  -1.855 -11.179
  403    H    GLU  57           HN       GLU  57  76.703  -2.194 -10.350
  404    HA   GLU  57           HA       GLU  57  76.551   0.240  -9.019
  405   1HB   GLU  57           HB2      GLU  57  74.929  -1.108 -10.788
  406   2HB   GLU  57           HB1      GLU  57  73.916  -1.036  -9.346
  407   1HG   GLU  57           HG2      GLU  57  74.380   1.423  -9.207
  408   2HG   GLU  57           HG1      GLU  57  75.239   1.306 -10.743
  409    H    LEU  58           HN       LEU  58  75.577  -2.930  -7.824
  410    HA   LEU  58           HA       LEU  58  74.072  -2.066  -5.561
  411   1HB   LEU  58           HB2      LEU  58  74.682  -4.495  -6.612
  412   2HB   LEU  58           HB1      LEU  58  75.766  -4.476  -5.222
  413    HG   LEU  58           HG       LEU  58  73.096  -3.477  -4.567
  414   1HD1  LEU  58          HD11      LEU  58  72.950  -5.453  -6.416
  415   2HD1  LEU  58          HD13      LEU  58  73.098  -6.422  -4.950
  416   3HD1  LEU  58          HD12      LEU  58  71.776  -5.266  -5.113
  417   1HD2  LEU  58          HD22      LEU  58  75.083  -5.488  -3.524
  418   2HD2  LEU  58          HD21      LEU  58  74.490  -4.015  -2.756
  419   3HD2  LEU  58          HD23      LEU  58  73.448  -5.434  -2.864
  420    H    ASP  59           HN       ASP  59  77.552  -2.825  -5.879
  421    HA   ASP  59           HA       ASP  59  78.254  -2.293  -3.173
  422   1HB   ASP  59           HB2      ASP  59  79.640  -3.228  -5.261
  423   2HB   ASP  59           HB1      ASP  59  80.164  -1.546  -5.345
  424    H    ALA  60           HN       ALA  60  78.384  -0.118  -6.018
  425    HA   ALA  60           HA       ALA  60  79.192   2.191  -4.529
  426   1HB   ALA  60           HB2      ALA  60  78.118   1.643  -7.240
  427   2HB   ALA  60           HB1      ALA  60  77.851   3.275  -6.626
  428   3HB   ALA  60           HB3      ALA  60  79.490   2.637  -6.752
  429    H    ILE  61           HN       ILE  61  76.143   0.592  -4.873
  430    HA   ILE  61           HA       ILE  61  74.524   2.906  -4.144
  431    HB   ILE  61           HB       ILE  61  73.980  -0.058  -4.379
  432   1HG1  ILE  61          HG12      ILE  61  72.624   2.226  -5.805
  433   2HG1  ILE  61          HG11      ILE  61  74.182   1.616  -6.364
  434   1HG2  ILE  61          HG21      ILE  61  72.443   2.020  -2.953
  435   2HG2  ILE  61          HG23      ILE  61  71.510   1.100  -4.130
  436   3HG2  ILE  61          HG22      ILE  61  72.350   0.265  -2.824
  437   1HD1  ILE  61          HD12      ILE  61  73.234  -0.656  -6.539
  438   2HD1  ILE  61          HD11      ILE  61  71.674  -0.047  -5.984
  439   3HD1  ILE  61          HD13      ILE  61  72.329   0.485  -7.533
  440    H    ILE  62           HN       ILE  62  75.980   0.160  -2.452
  441    HA   ILE  62           HA       ILE  62  74.675   0.544   0.061
  442    HB   ILE  62           HB       ILE  62  77.346  -0.660  -0.700
  443   1HG1  ILE  62          HG12      ILE  62  74.740  -1.871   0.282
  444   2HG1  ILE  62          HG11      ILE  62  75.269  -1.838  -1.401
  445   1HG2  ILE  62          HG22      ILE  62  76.039  -0.367   2.010
  446   2HG2  ILE  62          HG21      ILE  62  77.201  -1.649   1.666
  447   3HG2  ILE  62          HG23      ILE  62  77.691   0.041   1.546
  448   1HD1  ILE  62          HD12      ILE  62  77.404  -2.870   0.217
  449   2HD1  ILE  62          HD11      ILE  62  75.927  -3.760   0.589
  450   3HD1  ILE  62          HD13      ILE  62  76.514  -3.680  -1.073
  451    H    GLU  63           HN       GLU  63  77.664   1.922  -1.288
  452    HA   GLU  63           HA       GLU  63  78.445   3.304   1.107
  453   1HB   GLU  63           HB2      GLU  63  79.189   3.420  -1.779
  454   2HB   GLU  63           HB1      GLU  63  79.609   4.810  -0.775
  455   1HG   GLU  63           HG2      GLU  63  80.199   2.180   0.438
  456   2HG   GLU  63           HG1      GLU  63  81.155   2.569  -0.993
  457    H    GLU  64           HN       GLU  64  76.735   4.464  -1.824
  458    HA   GLU  64           HA       GLU  64  76.335   7.116  -0.805
  459   1HB   GLU  64           HB2      GLU  64  74.620   7.304  -2.603
  460   2HB   GLU  64           HB1      GLU  64  76.153   6.660  -3.191
  461   1HG   GLU  64           HG2      GLU  64  75.091   4.330  -2.691
  462   2HG   GLU  64           HG1      GLU  64  73.562   5.209  -2.708
  463    H    VAL  65           HN       VAL  65  74.635   4.118  -0.251
  464    HA   VAL  65           HA       VAL  65  72.197   5.404   0.710
  465    HB   VAL  65           HB       VAL  65  73.227   2.575   1.105
  466   1HG1  VAL  65          HG11      VAL  65  71.116   3.972   2.390
  467   2HG1  VAL  65          HG13      VAL  65  70.368   2.878   1.224
  468   3HG1  VAL  65          HG12      VAL  65  71.459   2.244   2.457
  469   1HG2  VAL  65          HG23      VAL  65  72.528   3.678  -1.251
  470   2HG2  VAL  65          HG22      VAL  65  72.152   2.002  -0.845
  471   3HG2  VAL  65          HG21      VAL  65  70.921   3.253  -0.658
  472    H    ASP  66           HN       ASP  66  75.155   4.101   2.164
  473    HA   ASP  66           HA       ASP  66  74.201   4.612   4.888
  474   1HB   ASP  66           HB2      ASP  66  76.214   3.033   3.751
  475   2HB   ASP  66           HB1      ASP  66  77.083   4.297   4.621
  476    H    GLU  67           HN       GLU  67  73.723   6.954   4.329
  477    HA   GLU  67           HA       GLU  67  75.853   8.799   3.775
  478   1HB   GLU  67           HB2      GLU  67  74.248  10.526   4.553
  479   2HB   GLU  67           HB1      GLU  67  73.496   9.398   3.426
  480   1HG   GLU  67           HG2      GLU  67  72.763   8.072   5.503
  481   2HG   GLU  67           HG1      GLU  67  73.202   9.508   6.429
  482    H    ASP  68           HN       ASP  68  74.588   7.391   6.741
  483    HA   ASP  68           HA       ASP  68  76.194   9.190   8.431
  484   1HB   ASP  68           HB2      ASP  68  75.267   7.892  10.299
  485   2HB   ASP  68           HB1      ASP  68  73.978   8.381   9.199
  486    H    GLY  69           HN       GLY  69  76.928   6.592   6.530
  487   1HA   GLY  69           HA2      GLY  69  78.640   4.976   6.561
  488   2HA   GLY  69           HA1      GLY  69  79.546   6.228   7.414
  489    H    SER  70           HN       SER  70  76.615   4.992   8.830
  490    HA   SER  70           HA       SER  70  77.933   4.247  11.260
  491   1HB   SER  70           HB2      SER  70  75.765   3.249  11.883
  492   2HB   SER  70           HB1      SER  70  75.537   4.840  11.160
  493    HG   SER  70           HG       SER  70  74.265   2.843  10.410
  494    H    GLY  71           HN       GLY  71  77.571   2.610   8.264
  495   1HA   GLY  71           HA2      GLY  71  78.678   0.579   7.669
  496   2HA   GLY  71           HA1      GLY  71  78.950   0.257   9.383
  497    H    THR  72           HN       THR  72  75.759   1.202   8.508
  498    HA   THR  72           HA       THR  72  74.793  -1.536   8.075
  499    HB   THR  72           HB       THR  72  73.155  -0.914  10.160
  500    HG1  THR  72           HG1      THR  72  75.634  -0.304  11.247
  501   1HG2  THR  72          HG22      THR  72  75.605  -2.559   9.818
  502   2HG2  THR  72          HG21      THR  72  75.044  -2.321  11.472
  503   3HG2  THR  72          HG23      THR  72  73.974  -3.050  10.275
  504    H    ILE  73           HN       ILE  73  72.701  -1.526   7.165
  505    HA   ILE  73           HA       ILE  73  71.718   1.172   6.403
  506    HB   ILE  73           HB       ILE  73  70.854  -1.549   5.386
  507   1HG1  ILE  73          HG12      ILE  73  73.294  -0.868   4.985
  508   2HG1  ILE  73          HG11      ILE  73  72.342  -1.230   3.545
  509   1HG2  ILE  73          HG21      ILE  73  70.172   1.290   4.715
  510   2HG2  ILE  73          HG23      ILE  73  70.206   0.099   3.415
  511   3HG2  ILE  73          HG22      ILE  73  69.121  -0.127   4.788
  512   1HD1  ILE  73          HD13      ILE  73  72.013   1.550   4.233
  513   2HD1  ILE  73          HD12      ILE  73  73.733   1.170   4.131
  514   3HD1  ILE  73          HD11      ILE  73  72.676   0.852   2.754
  515    H    ASP  74           HN       ASP  74  69.781   1.952   7.126
  516    HA   ASP  74           HA       ASP  74  68.192   0.168   8.927
  517   1HB   ASP  74           HB2      ASP  74  69.209   2.853   9.250
  518   2HB   ASP  74           HB1      ASP  74  67.447   2.866   9.340
  519    H    PHE  75           HN       PHE  75  65.788   0.728   8.920
  520    HA   PHE  75           HA       PHE  75  64.654   0.450   6.379
  521   1HB   PHE  75           HB2      PHE  75  63.542   0.222   8.694
  522   2HB   PHE  75           HB1      PHE  75  63.260   1.960   8.590
  523    HD1  PHE  75           HD2      PHE  75  63.093  -0.902   6.172
  524    HD2  PHE  75           HD1      PHE  75  61.092   2.472   7.917
  525    HE1  PHE  75           HE2      PHE  75  61.129  -1.311   4.709
  526    HE2  PHE  75           HE1      PHE  75  59.128   2.066   6.456
  527    HZ   PHE  75           HZ       PHE  75  59.147   0.175   4.852
  528    H    GLU  76           HN       GLU  76  65.365   3.449   8.152
  529    HA   GLU  76           HA       GLU  76  64.088   5.245   6.348
  530   1HB   GLU  76           HB2      GLU  76  65.626   6.954   7.297
  531   2HB   GLU  76           HB1      GLU  76  64.875   5.966   8.551
  532   1HG   GLU  76           HG2      GLU  76  67.007   4.463   8.265
  533   2HG   GLU  76           HG1      GLU  76  67.708   5.917   7.552
  534    H    GLU  77           HN       GLU  77  67.324   3.786   6.291
  535    HA   GLU  77           HA       GLU  77  68.062   5.336   3.897
  536   1HB   GLU  77           HB2      GLU  77  69.540   3.042   5.219
  537   2HB   GLU  77           HB1      GLU  77  70.200   4.198   4.062
  538   1HG   GLU  77           HG2      GLU  77  69.641   6.035   5.699
  539   2HG   GLU  77           HG1      GLU  77  69.222   4.783   6.869
  540    H    PHE  78           HN       PHE  78  66.456   2.391   4.579
  541    HA   PHE  78           HA       PHE  78  67.284   0.894   2.264
  542   1HB   PHE  78           HB2      PHE  78  66.280  -0.523   3.773
  543   2HB   PHE  78           HB1      PHE  78  65.153   0.706   4.337
  544    HD1  PHE  78           HD2      PHE  78  63.176   1.312   2.921
  545    HD2  PHE  78           HD1      PHE  78  65.669  -2.074   2.067
  546    HE1  PHE  78           HE2      PHE  78  61.389   0.361   1.478
  547    HE2  PHE  78           HE1      PHE  78  63.889  -3.027   0.625
  548    HZ   PHE  78           HZ       PHE  78  61.748  -1.810   0.332
  549    H    LEU  79           HN       LEU  79  64.418   2.927   2.944
  550    HA   LEU  79           HA       LEU  79  63.132   2.717   0.462
  551   1HB   LEU  79           HB2      LEU  79  63.436   5.206   2.174
  552   2HB   LEU  79           HB1      LEU  79  62.224   4.976   0.915
  553    HG   LEU  79           HG       LEU  79  62.522   3.171   3.331
  554   1HD1  LEU  79          HD13      LEU  79  60.880   5.633   2.821
  555   2HD1  LEU  79          HD12      LEU  79  60.220   4.347   3.831
  556   3HD1  LEU  79          HD11      LEU  79  61.725   5.145   4.289
  557   1HD2  LEU  79          HD21      LEU  79  61.505   2.206   1.239
  558   2HD2  LEU  79          HD23      LEU  79  60.395   2.252   2.609
  559   3HD2  LEU  79          HD22      LEU  79  60.264   3.455   1.326
  560    H    VAL  80           HN       VAL  80  65.984   4.599   1.350
  561    HA   VAL  80           HA       VAL  80  66.151   6.167  -1.042
  562    HB   VAL  80           HB       VAL  80  68.385   5.153   0.745
  563   1HG1  VAL  80          HG11      VAL  80  69.154   5.960  -1.464
  564   2HG1  VAL  80          HG13      VAL  80  68.286   7.473  -1.207
  565   3HG1  VAL  80          HG12      VAL  80  69.652   7.054  -0.173
  566   1HG2  VAL  80          HG22      VAL  80  66.334   6.691   1.566
  567   2HG2  VAL  80          HG21      VAL  80  67.980   6.931   2.150
  568   3HG2  VAL  80          HG23      VAL  80  67.348   7.946   0.856
  569    H    MET  81           HN       MET  81  67.621   3.042  -0.144
  570    HA   MET  81           HA       MET  81  69.039   2.578  -2.546
  571   1HB   MET  81           HB2      MET  81  68.859   1.205  -0.278
  572   2HB   MET  81           HB1      MET  81  67.652   0.296  -1.190
  573   1HG   MET  81           HG2      MET  81  69.217  -0.342  -2.848
  574   2HG   MET  81           HG1      MET  81  70.377   0.887  -2.343
  575   1HE   MET  81           HE3      MET  81  70.702   1.181   0.060
  576   2HE   MET  81           HE2      MET  81  70.766  -0.066   1.303
  577   3HE   MET  81           HE1      MET  81  72.155   0.189   0.248
  578    H    MET  82           HN       MET  82  65.633   2.047  -1.749
  579    HA   MET  82           HA       MET  82  64.926   0.554  -4.077
  580   1HB   MET  82           HB2      MET  82  63.317   2.435  -2.331
  581   2HB   MET  82           HB1      MET  82  62.605   1.466  -3.620
  582   1HG   MET  82           HG2      MET  82  64.199   0.338  -1.301
  583   2HG   MET  82           HG1      MET  82  62.437   0.359  -1.390
  584   1HE   MET  82           HE3      MET  82  65.282  -1.631  -1.548
  585   2HE   MET  82           HE2      MET  82  65.299  -2.639  -2.994
  586   3HE   MET  82           HE1      MET  82  65.756  -0.940  -3.107
  587    H    VAL  83           HN       VAL  83  64.177   4.012  -3.494
  588    HA   VAL  83           HA       VAL  83  63.662   4.564  -6.254
  589    HB   VAL  83           HB       VAL  83  64.601   6.582  -4.205
  590   1HG1  VAL  83          HG13      VAL  83  64.056   6.943  -6.822
  591   2HG1  VAL  83          HG12      VAL  83  62.424   7.089  -6.169
  592   3HG1  VAL  83          HG11      VAL  83  63.700   8.165  -5.602
  593   1HG2  VAL  83          HG21      VAL  83  62.363   4.815  -4.035
  594   2HG2  VAL  83          HG23      VAL  83  62.762   6.165  -2.972
  595   3HG2  VAL  83          HG22      VAL  83  61.746   6.429  -4.389
  596    H    ARG  84           HN       ARG  84  66.588   3.977  -4.646
  597    HA   ARG  84           HA       ARG  84  68.326   5.768  -6.073
  598   1HB   ARG  84           HB2      ARG  84  68.659   3.282  -4.457
  599   2HB   ARG  84           HB1      ARG  84  69.980   3.721  -5.541
  600   1HG   ARG  84           HG2      ARG  84  69.170   6.114  -4.265
  601   2HG   ARG  84           HG1      ARG  84  69.273   4.888  -3.002
  602   1HD   ARG  84           HD2      ARG  84  71.540   4.509  -3.361
  603   2HD   ARG  84           HD1      ARG  84  71.475   5.077  -5.029
  604    HE   ARG  84           HE       ARG  84  71.641   6.804  -2.623
  605   1HH1  ARG  84          HH11      ARG  84  69.857   7.929  -4.812
  606   2HH1  ARG  84          HH12      ARG  84  70.989   8.879  -5.716
  607   1HH2  ARG  84          HH21      ARG  84  73.779   7.375  -4.312
  608   2HH2  ARG  84          HH22      ARG  84  73.209   8.565  -5.433
  609    H    GLN  85           HN       GLN  85  67.207   2.451  -6.719
  610    HA   GLN  85           HA       GLN  85  68.701   2.400  -9.265
  611   1HB   GLN  85           HB2      GLN  85  67.306   0.439  -7.557
  612   2HB   GLN  85           HB1      GLN  85  67.102   0.171  -9.288
  613   1HG   GLN  85           HG2      GLN  85  69.130  -0.818  -9.253
  614   2HG   GLN  85           HG1      GLN  85  69.804   0.797  -9.028
  615   1HE2  GLN  85          HE22      GLN  85  69.636   0.208  -5.306
  616   2HE2  GLN  85          HE21      GLN  85  68.836   1.278  -6.352
  617    H    MET  86           HN       MET  86  65.405   2.813  -8.094
  618    HA   MET  86           HA       MET  86  63.850   2.401 -10.342
  619   1HB   MET  86           HB2      MET  86  63.771   4.524  -8.215
  620   2HB   MET  86           HB1      MET  86  62.628   4.592  -9.559
  621   1HG   MET  86           HG2      MET  86  61.793   2.378  -9.040
  622   2HG   MET  86           HG1      MET  86  63.038   2.150  -7.812
  623   1HE   MET  86           HE3      MET  86  59.671   3.154  -8.723
  624   2HE   MET  86           HE2      MET  86  59.743   1.902  -7.484
  625   3HE   MET  86           HE1      MET  86  58.941   3.433  -7.137
  626    H    LYS  87           HN       LYS  87  64.700   5.782  -9.695
  627    HA   LYS  87           HA       LYS  87  65.537   6.016 -12.559
  628   1HB   LYS  87           HB2      LYS  87  64.598   8.463 -12.185
  629   2HB   LYS  87           HB1      LYS  87  63.503   7.146 -12.609
  630   1HG   LYS  87           HG2      LYS  87  62.510   8.300 -10.750
  631   2HG   LYS  87           HG1      LYS  87  63.152   6.783 -10.122
  632   1HD   LYS  87           HD2      LYS  87  64.604   7.855  -8.768
  633   2HD   LYS  87           HD1      LYS  87  65.154   8.901 -10.080
  634   1HE   LYS  87           HE2      LYS  87  64.051  10.135  -8.176
  635   2HE   LYS  87           HE1      LYS  87  63.294  10.408  -9.745
  636   1HZ   LYS  87           HZ1      LYS  87  62.319   8.195  -8.095
  637   2HZ   LYS  87           HZ3      LYS  87  61.881   9.773  -7.653
  638   3HZ   LYS  87           HZ2      LYS  87  61.477   9.180  -9.194
  639    H    GLU  88           HN       GLU  88  66.875   5.872  -9.722
  640    HA   GLU  88           HA       GLU  88  68.736   6.848  -8.686
  641   1HB   GLU  88           HB2      GLU  88  69.265   7.990 -11.443
  642   2HB   GLU  88           HB1      GLU  88  70.451   7.657 -10.180
  643   1HG   GLU  88           HG2      GLU  88  70.677   5.546 -10.916
  644   2HG   GLU  88           HG1      GLU  88  68.952   5.263 -10.682
  645    H    ASP  89           HN       ASP  89  69.989   9.349  -9.386
  646    HA   ASP  89           HA       ASP  89  68.086  11.161  -8.085
  647   1HB   ASP  89           HB2      ASP  89  69.959  12.752  -8.076
  648   2HB   ASP  89           HB1      ASP  89  70.499  11.179  -7.494
  649    H    ALA  90           HN       ALA  90  68.715  10.264 -11.268
  650    HA   ALA  90           HA       ALA  90  67.782  11.118 -13.258
  651   1HB   ALA  90           HB3      ALA  90  66.195  12.251 -11.304
  652   2HB   ALA  90           HB2      ALA  90  66.835  13.666 -12.138
  653   3HB   ALA  90           HB1      ALA  90  65.948  12.436 -13.040
   
  No H/Q in entry =         653
  Start of MODEL   11
    1   1H    ALA   1           HT3      ALA   1  67.145   9.736  11.420
    2   2H    ALA   1           HT2      ALA   1  66.868   8.976  12.914
    3   3H    ALA   1           HT1      ALA   1  65.600   9.779  12.119
    4    HA   ALA   1           HA       ALA   1  66.216  11.281  13.756
    5   1HB   ALA   1           HB2      ALA   1  68.958  10.233  13.137
    6   2HB   ALA   1           HB1      ALA   1  68.799  11.845  13.838
    7   3HB   ALA   1           HB3      ALA   1  68.170  10.441  14.701
    8    H    SER   2           HN       SER   2  68.938  11.719  11.533
    9    HA   SER   2           HA       SER   2  68.054  14.369  10.814
   10   1HB   SER   2           HB2      SER   2  70.040  14.526   9.621
   11   2HB   SER   2           HB1      SER   2  70.453  13.247  10.759
   12    HG   SER   2           HG       SER   2  70.925  12.297   8.904
   13    H    MET   3           HN       MET   3  68.543  14.357   7.997
   14    HA   MET   3           HA       MET   3  66.904  12.450   6.610
   15   1HB   MET   3           HB2      MET   3  65.329  14.088   8.087
   16   2HB   MET   3           HB1      MET   3  65.478  15.056   6.619
   17   1HG   MET   3           HG2      MET   3  64.726  13.147   5.266
   18   2HG   MET   3           HG1      MET   3  64.614  12.149   6.716
   19   1HE   MET   3           HE2      MET   3  63.170  11.885   8.063
   20   2HE   MET   3           HE1      MET   3  62.479  13.251   8.934
   21   3HE   MET   3           HE3      MET   3  61.464  12.273   7.867
   22    H    THR   4           HN       THR   4  68.910  12.757   5.346
   23    HA   THR   4           HA       THR   4  69.607  15.260   4.140
   24    HB   THR   4           HB       THR   4  71.083  14.004   2.754
   25    HG1  THR   4           HG1      THR   4  69.738  11.616   3.379
   26   1HG2  THR   4          HG23      THR   4  71.422  13.845   5.280
   27   2HG2  THR   4          HG22      THR   4  70.722  12.228   5.172
   28   3HG2  THR   4          HG21      THR   4  72.218  12.602   4.316
   29    H    ASP   5           HN       ASP   5  69.477  15.580   1.675
   30    HA   ASP   5           HA       ASP   5  66.721  15.649   0.885
   31   1HB   ASP   5           HB2      ASP   5  68.985  15.786  -1.095
   32   2HB   ASP   5           HB1      ASP   5  67.471  16.689  -1.079
   33    H    GLN   6           HN       GLN   6  69.130  13.193   0.672
   34    HA   GLN   6           HA       GLN   6  68.274  11.778  -1.638
   35   1HB   GLN   6           HB2      GLN   6  69.792  11.141   0.825
   36   2HB   GLN   6           HB1      GLN   6  69.034   9.761   0.027
   37   1HG   GLN   6           HG2      GLN   6  70.385   9.910  -1.808
   38   2HG   GLN   6           HG1      GLN   6  70.420  11.674  -1.765
   39   1HE2  GLN   6          HE22      GLN   6  72.914   9.927   0.992
   40   2HE2  GLN   6          HE21      GLN   6  71.302   9.411   0.881
   41    H    GLN   7           HN       GLN   7  67.165  11.534   1.748
   42    HA   GLN   7           HA       GLN   7  65.142   9.541   1.072
   43   1HB   GLN   7           HB2      GLN   7  65.257  11.248   3.569
   44   2HB   GLN   7           HB1      GLN   7  64.499   9.667   3.376
   45   1HG   GLN   7           HG2      GLN   7  66.829   8.781   2.798
   46   2HG   GLN   7           HG1      GLN   7  67.450  10.320   3.392
   47   1HE2  GLN   7          HE22      GLN   7  67.581   8.448   6.466
   48   2HE2  GLN   7          HE21      GLN   7  68.504   8.865   5.105
   49    H    ALA   8           HN       ALA   8  65.341  12.998   1.068
   50    HA   ALA   8           HA       ALA   8  62.546  13.588   1.384
   51   1HB   ALA   8           HB2      ALA   8  64.879  15.055   0.164
   52   2HB   ALA   8           HB1      ALA   8  63.244  15.707   0.042
   53   3HB   ALA   8           HB3      ALA   8  63.975  15.445   1.627
   54    H    GLU   9           HN       GLU   9  64.572  13.024  -1.497
   55    HA   GLU   9           HA       GLU   9  62.313  13.335  -3.316
   56   1HB   GLU   9           HB2      GLU   9  65.144  13.160  -3.542
   57   2HB   GLU   9           HB1      GLU   9  64.464  11.842  -4.496
   58   1HG   GLU   9           HG2      GLU   9  62.982  13.434  -5.654
   59   2HG   GLU   9           HG1      GLU   9  63.651  14.757  -4.698
   60    H    ALA  10           HN       ALA  10  63.913  10.667  -1.668
   61    HA   ALA  10           HA       ALA  10  62.710   8.558  -3.219
   62   1HB   ALA  10           HB1      ALA  10  64.181   8.777  -0.645
   63   2HB   ALA  10           HB3      ALA  10  63.147   7.362  -0.836
   64   3HB   ALA  10           HB2      ALA  10  64.436   7.674  -1.997
   65    H    ARG  11           HN       ARG  11  61.982   9.387   0.190
   66    HA   ARG  11           HA       ARG  11  59.486   8.070   0.275
   67   1HB   ARG  11           HB2      ARG  11  60.956   9.938   1.936
   68   2HB   ARG  11           HB1      ARG  11  59.232  10.309   1.956
   69   1HG   ARG  11           HG2      ARG  11  58.720   8.417   3.098
   70   2HG   ARG  11           HG1      ARG  11  59.823   7.434   2.134
   71   1HD   ARG  11           HD2      ARG  11  61.706   8.072   3.456
   72   2HD   ARG  11           HD1      ARG  11  60.805   9.373   4.236
   73    HE   ARG  11           HE       ARG  11  60.750   6.563   4.998
   74   1HH1  ARG  11          HH21      ARG  11  57.888   7.152   4.477
   75   2HH1  ARG  11          HH22      ARG  11  57.357   7.814   5.987
   76   1HH2  ARG  11          HH11      ARG  11  60.564   8.448   7.141
   77   2HH2  ARG  11          HH12      ARG  11  58.871   8.546   7.495
   78    H    ALA  12           HN       ALA  12  60.296  11.339  -0.810
   79    HA   ALA  12           HA       ALA  12  57.664  12.386  -1.002
   80   1HB   ALA  12           HB2      ALA  12  60.125  12.908  -2.693
   81   2HB   ALA  12           HB1      ALA  12  58.639  13.850  -2.814
   82   3HB   ALA  12           HB3      ALA  12  59.562  13.849  -1.310
   83    H    PHE  13           HN       PHE  13  59.495  10.321  -3.229
   84    HA   PHE  13           HA       PHE  13  57.302  10.383  -5.198
   85   1HB   PHE  13           HB2      PHE  13  59.578  10.320  -6.057
   86   2HB   PHE  13           HB1      PHE  13  59.923   8.860  -5.128
   87    HD1  PHE  13           HD1      PHE  13  57.940  10.246  -7.942
   88    HD2  PHE  13           HD2      PHE  13  59.194   6.697  -5.869
   89    HE1  PHE  13           HE1      PHE  13  57.061   8.852  -9.797
   90    HE2  PHE  13           HE2      PHE  13  58.314   5.305  -7.722
   91    HZ   PHE  13           HZ       PHE  13  57.248   6.381  -9.685
   92    H    LEU  14           HN       LEU  14  58.270   8.487  -2.485
   93    HA   LEU  14           HA       LEU  14  56.698   6.143  -3.393
   94   1HB   LEU  14           HB2      LEU  14  58.136   6.523  -0.753
   95   2HB   LEU  14           HB1      LEU  14  57.584   5.006  -1.463
   96    HG   LEU  14           HG       LEU  14  59.524   6.762  -2.950
   97   1HD1  LEU  14          HD13      LEU  14  59.999   5.212  -0.488
   98   2HD1  LEU  14          HD12      LEU  14  61.094   4.818  -1.814
   99   3HD1  LEU  14          HD11      LEU  14  60.980   6.478  -1.228
  100   1HD2  LEU  14          HD23      LEU  14  58.428   4.881  -4.122
  101   2HD2  LEU  14          HD22      LEU  14  60.158   4.591  -3.940
  102   3HD2  LEU  14          HD21      LEU  14  59.011   3.772  -2.881
  103    H    SER  15           HN       SER  15  54.809   5.449  -2.293
  104    HA   SER  15           HA       SER  15  53.517   7.579  -0.649
  105   1HB   SER  15           HB2      SER  15  51.469   6.928  -1.526
  106   2HB   SER  15           HB1      SER  15  52.524   6.541  -2.882
  107    HG   SER  15           HG       SER  15  51.861   4.571  -2.635
  108    H    GLU  16           HN       GLU  16  52.152   6.803   1.174
  109    HA   GLU  16           HA       GLU  16  53.558   5.026   2.898
  110   1HB   GLU  16           HB2      GLU  16  51.542   5.130   4.325
  111   2HB   GLU  16           HB1      GLU  16  51.977   6.732   3.727
  112   1HG   GLU  16           HG2      GLU  16  49.805   6.848   3.072
  113   2HG   GLU  16           HG1      GLU  16  50.325   5.827   1.731
  114    H    GLU  17           HN       GLU  17  51.258   4.422   0.377
  115    HA   GLU  17           HA       GLU  17  50.327   1.851   1.296
  116   1HB   GLU  17           HB2      GLU  17  49.823   3.553  -0.898
  117   2HB   GLU  17           HB1      GLU  17  50.416   2.041  -1.589
  118   1HG   GLU  17           HG2      GLU  17  48.110   2.370   0.352
  119   2HG   GLU  17           HG1      GLU  17  48.009   1.867  -1.337
  120    H    MET  18           HN       MET  18  53.153   2.925  -0.507
  121    HA   MET  18           HA       MET  18  53.945   0.131  -1.072
  122   1HB   MET  18           HB2      MET  18  54.491   2.686  -2.244
  123   2HB   MET  18           HB1      MET  18  56.020   1.982  -1.719
  124   1HG   MET  18           HG2      MET  18  55.268  -0.174  -2.858
  125   2HG   MET  18           HG1      MET  18  53.971   0.774  -3.585
  126   1HE   MET  18           HE1      MET  18  56.173  -0.986  -4.557
  127   2HE   MET  18           HE3      MET  18  55.795  -0.270  -6.130
  128   3HE   MET  18           HE2      MET  18  57.452  -0.263  -5.529
  129    H    ILE  19           HN       ILE  19  55.449   2.976   0.511
  130    HA   ILE  19           HA       ILE  19  57.653   1.761   1.676
  131    HB   ILE  19           HB       ILE  19  55.793   3.856   2.828
  132   1HG1  ILE  19          HG12      ILE  19  58.524   4.609   2.139
  133   2HG1  ILE  19          HG11      ILE  19  57.680   3.907   0.758
  134   1HG2  ILE  19          HG21      ILE  19  58.417   2.763   3.867
  135   2HG2  ILE  19          HG23      ILE  19  57.803   4.353   4.325
  136   3HG2  ILE  19          HG22      ILE  19  56.885   2.903   4.729
  137   1HD1  ILE  19          HD13      ILE  19  55.792   5.590   1.973
  138   2HD1  ILE  19          HD12      ILE  19  57.302   6.500   2.009
  139   3HD1  ILE  19          HD11      ILE  19  56.671   5.901   0.476
  140    H    ALA  20           HN       ALA  20  54.280   1.399   2.583
  141    HA   ALA  20           HA       ALA  20  54.705   0.195   5.151
  142   1HB   ALA  20           HB2      ALA  20  52.479   0.522   3.264
  143   2HB   ALA  20           HB1      ALA  20  52.396  -0.976   4.189
  144   3HB   ALA  20           HB3      ALA  20  52.472   0.573   5.028
  145    H    GLU  21           HN       GLU  21  54.198  -1.261   1.923
  146    HA   GLU  21           HA       GLU  21  54.504  -3.969   2.791
  147   1HB   GLU  21           HB2      GLU  21  54.395  -2.523   0.237
  148   2HB   GLU  21           HB1      GLU  21  55.424  -3.954   0.184
  149   1HG   GLU  21           HG2      GLU  21  53.440  -5.132   1.403
  150   2HG   GLU  21           HG1      GLU  21  52.488  -3.770   0.813
  151    H    PHE  22           HN       PHE  22  56.859  -1.680   1.382
  152    HA   PHE  22           HA       PHE  22  59.113  -3.347   1.319
  153   1HB   PHE  22           HB2      PHE  22  58.882  -0.399   1.971
  154   2HB   PHE  22           HB1      PHE  22  60.427  -1.215   1.736
  155    HD1  PHE  22           HD1      PHE  22  59.777  -3.128  -0.420
  156    HD2  PHE  22           HD2      PHE  22  58.642   0.986   0.073
  157    HE1  PHE  22           HE1      PHE  22  59.528  -2.902  -2.877
  158    HE2  PHE  22           HE2      PHE  22  58.393   1.212  -2.384
  159    HZ   PHE  22           HZ       PHE  22  58.836  -0.732  -3.859
  160    H    LYS  23           HN       LYS  23  57.474  -1.968   4.076
  161    HA   LYS  23           HA       LYS  23  59.570  -2.177   6.000
  162   1HB   LYS  23           HB2      LYS  23  57.501  -0.983   6.504
  163   2HB   LYS  23           HB1      LYS  23  56.572  -2.474   6.343
  164   1HG   LYS  23           HG2      LYS  23  56.973  -2.039   8.709
  165   2HG   LYS  23           HG1      LYS  23  57.901  -3.456   8.216
  166   1HD   LYS  23           HD2      LYS  23  59.737  -2.425   9.017
  167   2HD   LYS  23           HD1      LYS  23  59.583  -1.270   7.692
  168   1HE   LYS  23           HE2      LYS  23  59.545   0.145   9.546
  169   2HE   LYS  23           HE1      LYS  23  57.823  -0.121   9.267
  170   1HZ   LYS  23           HZ1      LYS  23  59.500  -1.679  11.160
  171   2HZ   LYS  23           HZ3      LYS  23  58.459  -0.414  11.602
  172   3HZ   LYS  23           HZ2      LYS  23  57.824  -1.841  10.930
  173    H    ALA  24           HN       ALA  24  57.053  -4.518   5.043
  174    HA   ALA  24           HA       ALA  24  57.690  -6.597   6.820
  175   1HB   ALA  24           HB3      ALA  24  56.595  -6.521   4.027
  176   2HB   ALA  24           HB2      ALA  24  56.996  -8.078   4.753
  177   3HB   ALA  24           HB1      ALA  24  55.804  -7.027   5.520
  178    H    ALA  25           HN       ALA  25  59.302  -5.649   3.817
  179    HA   ALA  25           HA       ALA  25  61.039  -7.947   3.684
  180   1HB   ALA  25           HB2      ALA  25  60.496  -5.768   2.051
  181   2HB   ALA  25           HB1      ALA  25  62.156  -5.479   2.577
  182   3HB   ALA  25           HB3      ALA  25  61.738  -6.985   1.759
  183    H    PHE  26           HN       PHE  26  61.315  -4.749   5.189
  184    HA   PHE  26           HA       PHE  26  64.061  -4.872   5.899
  185   1HB   PHE  26           HB2      PHE  26  62.412  -2.906   6.127
  186   2HB   PHE  26           HB1      PHE  26  61.929  -3.645   7.654
  187    HD1  PHE  26           HD1      PHE  26  65.140  -2.911   5.829
  188    HD2  PHE  26           HD2      PHE  26  62.986  -2.822   9.544
  189    HE1  PHE  26           HE1      PHE  26  67.110  -1.905   6.948
  190    HE2  PHE  26           HE2      PHE  26  64.957  -1.818  10.663
  191    HZ   PHE  26           HZ       PHE  26  67.018  -1.358   9.364
  192    H    ASP  27           HN       ASP  27  61.247  -5.658   7.987
  193    HA   ASP  27           HA       ASP  27  62.734  -6.772  10.119
  194   1HB   ASP  27           HB2      ASP  27  60.220  -6.237  10.011
  195   2HB   ASP  27           HB1      ASP  27  60.037  -7.825   9.265
  196    H    MET  28           HN       MET  28  62.251  -8.015   6.951
  197    HA   MET  28           HA       MET  28  62.532 -10.823   7.663
  198   1HB   MET  28           HB2      MET  28  61.448 -10.641   5.630
  199   2HB   MET  28           HB1      MET  28  62.356  -9.209   5.157
  200   1HG   MET  28           HG2      MET  28  63.009 -11.103   3.761
  201   2HG   MET  28           HG1      MET  28  64.355 -10.621   4.791
  202   1HE   MET  28           HE1      MET  28  65.687 -11.915   5.526
  203   2HE   MET  28           HE3      MET  28  65.536 -13.475   6.344
  204   3HE   MET  28           HE2      MET  28  65.554 -13.397   4.584
  205    H    PHE  29           HN       PHE  29  64.686  -8.239   6.521
  206    HA   PHE  29           HA       PHE  29  66.989 -10.033   6.361
  207   1HB   PHE  29           HB2      PHE  29  67.365  -7.082   6.553
  208   2HB   PHE  29           HB1      PHE  29  68.126  -8.242   5.466
  209    HD1  PHE  29           HD1      PHE  29  65.898  -9.617   4.211
  210    HD2  PHE  29           HD2      PHE  29  66.294  -5.468   5.245
  211    HE1  PHE  29           HE1      PHE  29  64.271  -9.020   2.438
  212    HE2  PHE  29           HE2      PHE  29  64.666  -4.870   3.472
  213    HZ   PHE  29           HZ       PHE  29  63.656  -6.648   2.068
  214    H    ASP  30           HN       ASP  30  65.886  -7.476   8.593
  215    HA   ASP  30           HA       ASP  30  67.950  -8.437  10.531
  216   1HB   ASP  30           HB2      ASP  30  68.137  -6.046   9.860
  217   2HB   ASP  30           HB1      ASP  30  66.504  -5.772  10.466
  218    H    ALA  31           HN       ALA  31  66.273 -10.195  10.975
  219    HA   ALA  31           HA       ALA  31  63.713  -9.783  12.007
  220   1HB   ALA  31           HB3      ALA  31  65.707 -11.871  12.145
  221   2HB   ALA  31           HB2      ALA  31  64.901 -11.710  13.705
  222   3HB   ALA  31           HB1      ALA  31  63.952 -12.012  12.249
  223    H    ASP  32           HN       ASP  32  66.406 -10.392  14.266
  224    HA   ASP  32           HA       ASP  32  65.098  -8.593  16.215
  225   1HB   ASP  32           HB2      ASP  32  67.491 -10.445  16.413
  226   2HB   ASP  32           HB1      ASP  32  66.924  -9.434  17.743
  227    H    GLY  33           HN       GLY  33  68.583  -8.940  16.069
  228   1HA   GLY  33           HA2      GLY  33  70.241  -7.289  16.005
  229   2HA   GLY  33           HA1      GLY  33  69.364  -6.722  14.584
  230    H    GLY  34           HN       GLY  34  70.399  -4.694  15.754
  231   1HA   GLY  34           HA2      GLY  34  68.777  -3.657  17.971
  232   2HA   GLY  34           HA1      GLY  34  70.099  -2.808  17.169
  233    H    GLY  35           HN       GLY  35  67.937  -4.145  14.929
  234   1HA   GLY  35           HA2      GLY  35  65.865  -3.165  14.068
  235   2HA   GLY  35           HA1      GLY  35  66.335  -1.632  14.806
  236    H    ASP  36           HN       ASP  36  68.524  -3.688  12.952
  237    HA   ASP  36           HA       ASP  36  68.242  -2.163  10.495
  238   1HB   ASP  36           HB2      ASP  36  70.371  -1.010  10.544
  239   2HB   ASP  36           HB1      ASP  36  69.474  -0.556  11.994
  240    H    ILE  37           HN       ILE  37  69.155  -3.309   8.803
  241    HA   ILE  37           HA       ILE  37  70.648  -5.768   9.579
  242    HB   ILE  37           HB       ILE  37  68.982  -6.655   8.322
  243   1HG1  ILE  37          HG12      ILE  37  71.206  -6.699   6.916
  244   2HG1  ILE  37          HG11      ILE  37  69.700  -7.246   6.193
  245   1HG2  ILE  37          HG22      ILE  37  68.762  -3.919   7.081
  246   2HG2  ILE  37          HG21      ILE  37  67.890  -5.294   6.404
  247   3HG2  ILE  37          HG23      ILE  37  67.581  -4.783   8.064
  248   1HD1  ILE  37          HD11      ILE  37  69.378  -5.004   5.184
  249   2HD1  ILE  37          HD13      ILE  37  70.916  -4.484   5.877
  250   3HD1  ILE  37          HD12      ILE  37  70.884  -5.751   4.650
  251    H    SER  38           HN       SER  38  72.506  -6.362   8.323
  252    HA   SER  38           HA       SER  38  74.156  -4.049   7.635
  253   1HB   SER  38           HB2      SER  38  74.569  -6.891   8.182
  254   2HB   SER  38           HB1      SER  38  75.549  -6.321   6.835
  255    HG   SER  38           HG       SER  38  75.972  -5.959   9.403
  256    H    THR  39           HN       THR  39  75.076  -3.641   5.545
  257    HA   THR  39           HA       THR  39  73.294  -4.028   3.343
  258    HB   THR  39           HB       THR  39  74.921  -2.924   2.015
  259    HG1  THR  39           HG1      THR  39  76.725  -4.022   3.883
  260   1HG2  THR  39          HG23      THR  39  74.483  -2.058   4.740
  261   2HG2  THR  39          HG22      THR  39  76.063  -1.519   4.172
  262   3HG2  THR  39          HG21      THR  39  74.607  -1.086   3.273
  263    H    LYS  40           HN       LYS  40  75.738  -6.038   4.720
  264    HA   LYS  40           HA       LYS  40  76.555  -7.567   2.482
  265   1HB   LYS  40           HB2      LYS  40  75.972  -8.759   5.202
  266   2HB   LYS  40           HB1      LYS  40  77.199  -9.257   4.038
  267   1HG   LYS  40           HG2      LYS  40  78.155  -6.865   4.332
  268   2HG   LYS  40           HG1      LYS  40  77.162  -6.802   5.788
  269   1HD   LYS  40           HD2      LYS  40  78.918  -9.190   5.340
  270   2HD   LYS  40           HD1      LYS  40  79.648  -7.690   5.915
  271   1HE   LYS  40           HE2      LYS  40  77.265  -8.095   7.416
  272   2HE   LYS  40           HE1      LYS  40  78.147  -9.622   7.411
  273   1HZ   LYS  40           HZ3      LYS  40  80.012  -7.592   7.771
  274   2HZ   LYS  40           HZ2      LYS  40  78.726  -7.263   8.832
  275   3HZ   LYS  40           HZ1      LYS  40  79.522  -8.763   8.896
  276    H    ALA  41           HN       ALA  41  73.573  -7.613   4.346
  277    HA   ALA  41           HA       ALA  41  72.597 -10.003   2.912
  278   1HB   ALA  41           HB2      ALA  41  72.023  -8.802   5.405
  279   2HB   ALA  41           HB1      ALA  41  70.561  -8.628   4.431
  280   3HB   ALA  41           HB3      ALA  41  71.254 -10.226   4.705
  281    H    LEU  42           HN       LEU  42  72.477  -6.554   2.655
  282    HA   LEU  42           HA       LEU  42  70.052  -6.014   1.422
  283   1HB   LEU  42           HB2      LEU  42  72.740  -4.872   1.311
  284   2HB   LEU  42           HB1      LEU  42  71.871  -4.667  -0.208
  285    HG   LEU  42           HG       LEU  42  71.361  -2.765   1.190
  286   1HD1  LEU  42          HD12      LEU  42  69.458  -4.374   0.068
  287   2HD1  LEU  42          HD11      LEU  42  68.885  -4.280   1.734
  288   3HD1  LEU  42          HD13      LEU  42  69.119  -2.804   0.796
  289   1HD2  LEU  42          HD23      LEU  42  71.557  -4.707   3.273
  290   2HD2  LEU  42          HD22      LEU  42  71.392  -2.960   3.432
  291   3HD2  LEU  42          HD21      LEU  42  69.954  -3.979   3.364
  292    H    GLY  43           HN       GLY  43  72.763  -7.838   0.124
  293   1HA   GLY  43           HA2      GLY  43  72.005  -7.877  -2.616
  294   2HA   GLY  43           HA1      GLY  43  72.918  -9.156  -1.813
  295    H    THR  44           HN       THR  44  71.176 -10.165   0.012
  296    HA   THR  44           HA       THR  44  69.390 -11.748  -1.581
  297    HB   THR  44           HB       THR  44  69.638 -11.291   1.400
  298    HG1  THR  44           HG1      THR  44  70.519 -13.333   1.314
  299   1HG2  THR  44          HG21      THR  44  67.632 -12.905  -0.159
  300   2HG2  THR  44          HG23      THR  44  68.138 -13.418   1.451
  301   3HG2  THR  44          HG22      THR  44  67.363 -11.850   1.229
  302    H    VAL  45           HN       VAL  45  68.965  -8.854   0.397
  303    HA   VAL  45           HA       VAL  45  66.138  -8.704   0.395
  304    HB   VAL  45           HB       VAL  45  68.162  -6.447   0.260
  305   1HG1  VAL  45          HG13      VAL  45  65.210  -6.568   0.672
  306   2HG1  VAL  45          HG12      VAL  45  66.126  -5.431   1.666
  307   3HG1  VAL  45          HG11      VAL  45  66.187  -5.316  -0.095
  308   1HG2  VAL  45          HG23      VAL  45  67.238  -8.286   2.391
  309   2HG2  VAL  45          HG22      VAL  45  68.755  -7.400   2.252
  310   3HG2  VAL  45          HG21      VAL  45  67.308  -6.582   2.837
  311    H    MET  46           HN       MET  46  68.507  -7.759  -2.061
  312    HA   MET  46           HA       MET  46  66.692  -6.354  -3.774
  313   1HB   MET  46           HB2      MET  46  69.195  -7.911  -4.493
  314   2HB   MET  46           HB1      MET  46  68.386  -6.735  -5.531
  315   1HG   MET  46           HG2      MET  46  68.954  -5.691  -2.851
  316   2HG   MET  46           HG1      MET  46  70.409  -6.156  -3.731
  317   1HE   MET  46           HE3      MET  46  69.951  -3.644  -2.664
  318   2HE   MET  46           HE2      MET  46  69.973  -2.324  -3.830
  319   3HE   MET  46           HE1      MET  46  68.440  -2.867  -3.154
  320    H    ARG  47           HN       ARG  47  68.151  -9.491  -4.637
  321    HA   ARG  47           HA       ARG  47  66.272 -10.288  -6.516
  322   1HB   ARG  47           HB2      ARG  47  67.668 -12.050  -4.478
  323   2HB   ARG  47           HB1      ARG  47  66.881 -12.631  -5.947
  324   1HG   ARG  47           HG2      ARG  47  68.814 -12.266  -7.044
  325   2HG   ARG  47           HG1      ARG  47  68.571 -10.539  -6.781
  326   1HD   ARG  47           HD2      ARG  47  70.785 -11.504  -5.934
  327   2HD   ARG  47           HD1      ARG  47  69.854 -10.562  -4.770
  328    HE   ARG  47           HE       ARG  47  69.287 -12.610  -3.623
  329   1HH1  ARG  47          HH11      ARG  47  69.401 -14.139  -6.371
  330   2HH1  ARG  47          HH12      ARG  47  70.671 -15.262  -6.016
  331   1HH2  ARG  47          HH21      ARG  47  71.727 -13.577  -3.176
  332   2HH2  ARG  47          HH22      ARG  47  71.989 -14.944  -4.208
  333    H    MET  48           HN       MET  48  65.888 -10.159  -3.051
  334    HA   MET  48           HA       MET  48  63.650 -11.924  -2.801
  335   1HB   MET  48           HB2      MET  48  65.085 -10.106  -1.128
  336   2HB   MET  48           HB1      MET  48  63.366  -9.738  -0.980
  337   1HG   MET  48           HG2      MET  48  63.070 -12.317  -0.765
  338   2HG   MET  48           HG1      MET  48  64.795 -12.323  -0.396
  339   1HE   MET  48           HE3      MET  48  65.412 -12.699   1.374
  340   2HE   MET  48           HE2      MET  48  65.495 -11.496   2.658
  341   3HE   MET  48           HE1      MET  48  64.401 -12.867   2.816
  342    H    LEU  49           HN       LEU  49  63.507  -8.342  -2.691
  343    HA   LEU  49           HA       LEU  49  60.770  -8.049  -3.099
  344   1HB   LEU  49           HB2      LEU  49  62.722  -6.251  -4.532
  345   2HB   LEU  49           HB1      LEU  49  61.189  -5.825  -3.775
  346    HG   LEU  49           HG       LEU  49  63.804  -6.519  -2.432
  347   1HD1  LEU  49          HD11      LEU  49  62.797  -4.121  -3.181
  348   2HD1  LEU  49          HD13      LEU  49  62.059  -4.271  -1.586
  349   3HD1  LEU  49          HD12      LEU  49  63.814  -4.333  -1.755
  350   1HD2  LEU  49          HD21      LEU  49  61.895  -7.782  -1.383
  351   2HD2  LEU  49          HD23      LEU  49  62.636  -6.599  -0.305
  352   3HD2  LEU  49          HD22      LEU  49  61.099  -6.237  -1.090
  353    H    GLY  50           HN       GLY  50  63.248  -8.129  -5.689
  354   1HA   GLY  50           HA2      GLY  50  62.278  -9.856  -7.493
  355   2HA   GLY  50           HA1      GLY  50  61.104  -8.553  -7.684
  356    H    GLN  51           HN       GLN  51  64.620  -8.383  -7.097
  357    HA   GLN  51           HA       GLN  51  65.091  -7.411  -9.831
  358   1HB   GLN  51           HB2      GLN  51  65.854  -5.218  -9.218
  359   2HB   GLN  51           HB1      GLN  51  64.261  -5.418  -8.487
  360   1HG   GLN  51           HG2      GLN  51  65.385  -6.135  -6.366
  361   2HG   GLN  51           HG1      GLN  51  66.938  -5.749  -7.107
  362   1HE2  GLN  51          HE22      GLN  51  66.372  -2.193  -7.012
  363   2HE2  GLN  51          HE21      GLN  51  67.170  -3.406  -7.893
  364    H    ASN  52           HN       ASN  52  67.145  -7.968 -10.438
  365    HA   ASN  52           HA       ASN  52  69.116  -8.550  -8.267
  366   1HB   ASN  52           HB2      ASN  52  69.119 -10.125 -10.823
  367   2HB   ASN  52           HB1      ASN  52  69.714 -10.588  -9.228
  368   1HD2  ASN  52          HD22      ASN  52  66.323 -12.178 -10.039
  369   2HD2  ASN  52          HD21      ASN  52  67.723 -12.021 -10.988
  370    HA   PRO  53           HA       PRO  53  71.005  -5.601 -11.191
  371   1HB   PRO  53           HB2      PRO  53  72.232  -4.136  -9.215
  372   2HB   PRO  53           HB1      PRO  53  70.572  -3.843  -9.763
  373   1HG   PRO  53           HG2      PRO  53  71.517  -5.131  -7.245
  374   2HG   PRO  53           HG1      PRO  53  70.003  -4.268  -7.564
  375   1HD   PRO  53           HD2      PRO  53  70.318  -7.081  -7.449
  376   2HD   PRO  53           HD1      PRO  53  68.905  -6.212  -8.085
  377    H    THR  54           HN       THR  54  73.513  -4.799 -10.953
  378    HA   THR  54           HA       THR  54  75.061  -7.308 -10.713
  379    HB   THR  54           HB       THR  54  76.916  -5.705 -11.608
  380    HG1  THR  54           HG1      THR  54  75.394  -3.886 -11.075
  381   1HG2  THR  54          HG22      THR  54  74.554  -6.875 -12.965
  382   2HG2  THR  54          HG21      THR  54  75.489  -5.714 -13.908
  383   3HG2  THR  54          HG23      THR  54  76.272  -7.153 -13.253
  384    H    LYS  55           HN       LYS  55  76.594  -7.656  -9.129
  385    HA   LYS  55           HA       LYS  55  76.493  -6.324  -6.661
  386   1HB   LYS  55           HB2      LYS  55  77.585  -8.531  -7.031
  387   2HB   LYS  55           HB1      LYS  55  78.912  -7.713  -7.856
  388   1HG   LYS  55           HG2      LYS  55  78.823  -6.271  -5.559
  389   2HG   LYS  55           HG1      LYS  55  78.275  -7.837  -4.962
  390   1HD   LYS  55           HD2      LYS  55  80.602  -8.024  -4.762
  391   2HD   LYS  55           HD1      LYS  55  80.304  -8.774  -6.331
  392   1HE   LYS  55           HE2      LYS  55  80.978  -6.806  -7.506
  393   2HE   LYS  55           HE1      LYS  55  80.951  -5.834  -6.035
  394   1HZ   LYS  55           HZ1      LYS  55  82.770  -8.136  -6.484
  395   2HZ   LYS  55           HZ3      LYS  55  83.204  -6.516  -6.736
  396   3HZ   LYS  55           HZ2      LYS  55  82.798  -7.054  -5.176
  397    H    GLU  56           HN       GLU  56  78.062  -5.365  -9.595
  398    HA   GLU  56           HA       GLU  56  80.062  -3.631  -8.505
  399   1HB   GLU  56           HB2      GLU  56  78.746  -4.024 -11.126
  400   2HB   GLU  56           HB1      GLU  56  79.388  -2.406 -10.844
  401   1HG   GLU  56           HG2      GLU  56  81.378  -3.274 -11.495
  402   2HG   GLU  56           HG1      GLU  56  81.416  -4.020  -9.896
  403    H    GLU  57           HN       GLU  57  77.009  -2.588 -10.062
  404    HA   GLU  57           HA       GLU  57  77.056   0.009  -8.870
  405   1HB   GLU  57           HB2      GLU  57  75.276  -1.532 -10.565
  406   2HB   GLU  57           HB1      GLU  57  74.360  -0.630  -9.355
  407   1HG   GLU  57           HG2      GLU  57  75.248   1.448 -10.064
  408   2HG   GLU  57           HG1      GLU  57  76.559   0.677 -10.957
  409    H    LEU  58           HN       LEU  58  76.305  -3.049  -7.548
  410    HA   LEU  58           HA       LEU  58  74.357  -2.222  -5.582
  411   1HB   LEU  58           HB2      LEU  58  75.368  -4.640  -6.400
  412   2HB   LEU  58           HB1      LEU  58  76.157  -4.439  -4.837
  413    HG   LEU  58           HG       LEU  58  73.957  -5.597  -4.653
  414   1HD1  LEU  58          HD12      LEU  58  74.497  -2.947  -3.360
  415   2HD1  LEU  58          HD11      LEU  58  72.968  -3.761  -3.024
  416   3HD1  LEU  58          HD13      LEU  58  74.495  -4.557  -2.643
  417   1HD2  LEU  58          HD23      LEU  58  73.117  -3.882  -6.577
  418   2HD2  LEU  58          HD22      LEU  58  72.012  -4.710  -5.481
  419   3HD2  LEU  58          HD21      LEU  58  72.507  -3.052  -5.146
  420    H    ASP  59           HN       ASP  59  77.899  -2.720  -5.418
  421    HA   ASP  59           HA       ASP  59  78.196  -1.943  -2.695
  422   1HB   ASP  59           HB2      ASP  59  79.900  -2.897  -4.559
  423   2HB   ASP  59           HB1      ASP  59  80.356  -1.193  -4.598
  424    H    ALA  60           HN       ALA  60  78.531   0.020  -5.674
  425    HA   ALA  60           HA       ALA  60  79.075   2.487  -4.368
  426   1HB   ALA  60           HB1      ALA  60  78.971   1.742  -6.956
  427   2HB   ALA  60           HB3      ALA  60  77.407   2.547  -6.835
  428   3HB   ALA  60           HB2      ALA  60  78.887   3.431  -6.456
  429    H    ILE  61           HN       ILE  61  76.047   0.817  -5.038
  430    HA   ILE  61           HA       ILE  61  74.288   2.996  -4.424
  431    HB   ILE  61           HB       ILE  61  74.001  -0.007  -4.438
  432   1HG1  ILE  61          HG12      ILE  61  72.574   2.143  -6.023
  433   2HG1  ILE  61          HG11      ILE  61  74.084   1.402  -6.552
  434   1HG2  ILE  61          HG22      ILE  61  72.259   1.981  -3.133
  435   2HG2  ILE  61          HG21      ILE  61  71.427   0.928  -4.279
  436   3HG2  ILE  61          HG23      ILE  61  72.321   0.229  -2.929
  437   1HD1  ILE  61          HD13      ILE  61  71.989  -0.511  -5.724
  438   2HD1  ILE  61          HD12      ILE  61  71.610   0.425  -7.169
  439   3HD1  ILE  61          HD11      ILE  61  73.072  -0.559  -7.116
  440    H    ILE  62           HN       ILE  62  75.273   0.208  -2.398
  441    HA   ILE  62           HA       ILE  62  74.065   0.979   0.002
  442    HB   ILE  62           HB       ILE  62  76.721  -0.393  -0.485
  443   1HG1  ILE  62          HG12      ILE  62  74.249  -1.687   0.609
  444   2HG1  ILE  62          HG11      ILE  62  74.315  -1.329  -1.116
  445   1HG2  ILE  62          HG21      ILE  62  75.226   0.209   2.063
  446   2HG2  ILE  62          HG23      ILE  62  76.264  -1.211   1.936
  447   3HG2  ILE  62          HG22      ILE  62  76.945   0.402   1.722
  448   1HD1  ILE  62          HD11      ILE  62  76.755  -2.580  -0.009
  449   2HD1  ILE  62          HD13      ILE  62  75.321  -3.607  -0.001
  450   3HD1  ILE  62          HD12      ILE  62  75.901  -2.917  -1.516
  451    H    GLU  63           HN       GLU  63  76.992   2.240  -1.500
  452    HA   GLU  63           HA       GLU  63  77.987   3.674   0.772
  453   1HB   GLU  63           HB2      GLU  63  78.307   4.042  -2.210
  454   2HB   GLU  63           HB1      GLU  63  79.073   5.131  -1.053
  455   1HG   GLU  63           HG2      GLU  63  80.017   3.021   0.067
  456   2HG   GLU  63           HG1      GLU  63  79.522   2.163  -1.393
  457    H    GLU  64           HN       GLU  64  76.055   4.846  -2.013
  458    HA   GLU  64           HA       GLU  64  75.592   7.438  -0.853
  459   1HB   GLU  64           HB2      GLU  64  74.010   5.939  -2.965
  460   2HB   GLU  64           HB1      GLU  64  73.854   7.659  -2.605
  461   1HG   GLU  64           HG2      GLU  64  76.488   6.393  -3.384
  462   2HG   GLU  64           HG1      GLU  64  75.375   7.079  -4.568
  463    H    VAL  65           HN       VAL  65  74.300   4.367  -0.138
  464    HA   VAL  65           HA       VAL  65  71.701   5.364   0.799
  465    HB   VAL  65           HB       VAL  65  73.057   2.673   1.159
  466   1HG1  VAL  65          HG13      VAL  65  71.260   3.384   2.860
  467   2HG1  VAL  65          HG12      VAL  65  70.126   3.323   1.510
  468   3HG1  VAL  65          HG11      VAL  65  70.987   1.866   2.005
  469   1HG2  VAL  65          HG23      VAL  65  72.309   3.601  -1.191
  470   2HG2  VAL  65          HG22      VAL  65  71.886   1.953  -0.730
  471   3HG2  VAL  65          HG21      VAL  65  70.686   3.239  -0.600
  472    H    ASP  66           HN       ASP  66  74.809   4.397   2.210
  473    HA   ASP  66           HA       ASP  66  73.867   4.736   4.950
  474   1HB   ASP  66           HB2      ASP  66  76.339   3.914   3.604
  475   2HB   ASP  66           HB1      ASP  66  76.634   4.909   5.030
  476    H    GLU  67           HN       GLU  67  72.992   6.916   4.831
  477    HA   GLU  67           HA       GLU  67  74.577   9.179   4.038
  478   1HB   GLU  67           HB2      GLU  67  72.877  10.482   5.387
  479   2HB   GLU  67           HB1      GLU  67  72.179   9.420   4.164
  480   1HG   GLU  67           HG2      GLU  67  70.933   8.518   5.816
  481   2HG   GLU  67           HG1      GLU  67  72.423   7.793   6.421
  482    H    ASP  68           HN       ASP  68  74.138   7.488   7.115
  483    HA   ASP  68           HA       ASP  68  75.905   9.438   8.474
  484   1HB   ASP  68           HB2      ASP  68  75.445   7.866  10.465
  485   2HB   ASP  68           HB1      ASP  68  74.076   8.790   9.844
  486    H    GLY  69           HN       GLY  69  76.264   6.684   6.615
  487   1HA   GLY  69           HA2      GLY  69  78.004   5.123   6.367
  488   2HA   GLY  69           HA1      GLY  69  79.034   6.434   6.944
  489    H    SER  70           HN       SER  70  76.442   4.845   8.768
  490    HA   SER  70           HA       SER  70  78.204   4.449  11.039
  491   1HB   SER  70           HB2      SER  70  76.109   2.982  11.749
  492   2HB   SER  70           HB1      SER  70  76.013   4.741  11.740
  493    HG   SER  70           HG       SER  70  74.482   4.496  10.333
  494    H    GLY  71           HN       GLY  71  77.300   2.557   8.271
  495   1HA   GLY  71           HA2      GLY  71  78.761   0.666   7.659
  496   2HA   GLY  71           HA1      GLY  71  78.908   0.295   9.378
  497    H    THR  72           HN       THR  72  75.757   1.227   8.546
  498    HA   THR  72           HA       THR  72  74.875  -1.513   7.867
  499    HB   THR  72           HB       THR  72  73.090  -0.831   9.879
  500    HG1  THR  72           HG1      THR  72  74.302   0.695  10.816
  501   1HG2  THR  72          HG22      THR  72  75.352  -2.727   9.525
  502   2HG2  THR  72          HG21      THR  72  74.736  -2.532  11.166
  503   3HG2  THR  72          HG23      THR  72  73.654  -3.051   9.875
  504    H    ILE  73           HN       ILE  73  72.332  -1.436   7.685
  505    HA   ILE  73           HA       ILE  73  71.579   1.212   6.511
  506    HB   ILE  73           HB       ILE  73  70.737  -1.544   5.565
  507   1HG1  ILE  73          HG12      ILE  73  73.160  -0.792   5.137
  508   2HG1  ILE  73          HG11      ILE  73  72.213  -1.242   3.719
  509   1HG2  ILE  73          HG22      ILE  73  69.040   0.246   5.249
  510   2HG2  ILE  73          HG21      ILE  73  70.239   1.204   4.379
  511   3HG2  ILE  73          HG23      ILE  73  69.687  -0.334   3.715
  512   1HD1  ILE  73          HD11      ILE  73  71.916   1.585   4.434
  513   2HD1  ILE  73          HD13      ILE  73  73.577   1.145   4.040
  514   3HD1  ILE  73          HD12      ILE  73  72.289   0.855   2.871
  515    H    ASP  74           HN       ASP  74  69.565   2.000   7.092
  516    HA   ASP  74           HA       ASP  74  67.950   0.277   8.932
  517   1HB   ASP  74           HB2      ASP  74  68.521   3.244   8.958
  518   2HB   ASP  74           HB1      ASP  74  67.129   2.568   9.806
  519    H    PHE  75           HN       PHE  75  65.552   1.013   8.921
  520    HA   PHE  75           HA       PHE  75  64.448   0.694   6.354
  521   1HB   PHE  75           HB2      PHE  75  63.308   0.590   8.695
  522   2HB   PHE  75           HB1      PHE  75  63.026   2.315   8.455
  523    HD1  PHE  75           HD2      PHE  75  62.997  -0.613   6.111
  524    HD2  PHE  75           HD1      PHE  75  60.804   2.661   7.819
  525    HE1  PHE  75           HE2      PHE  75  61.072  -1.131   4.634
  526    HE2  PHE  75           HE1      PHE  75  58.879   2.144   6.343
  527    HZ   PHE  75           HZ       PHE  75  59.013   0.247   4.751
  528    H    GLU  76           HN       GLU  76  65.243   3.688   8.092
  529    HA   GLU  76           HA       GLU  76  64.068   5.538   6.304
  530   1HB   GLU  76           HB2      GLU  76  66.663   5.835   7.847
  531   2HB   GLU  76           HB1      GLU  76  65.711   7.156   7.171
  532   1HG   GLU  76           HG2      GLU  76  64.440   5.188   9.060
  533   2HG   GLU  76           HG1      GLU  76  65.382   6.542   9.686
  534    H    GLU  77           HN       GLU  77  67.469   4.394   6.317
  535    HA   GLU  77           HA       GLU  77  68.013   5.593   3.735
  536   1HB   GLU  77           HB2      GLU  77  69.557   3.385   5.121
  537   2HB   GLU  77           HB1      GLU  77  70.160   4.490   3.886
  538   1HG   GLU  77           HG2      GLU  77  70.046   6.361   5.352
  539   2HG   GLU  77           HG1      GLU  77  69.063   5.477   6.521
  540    H    PHE  78           HN       PHE  78  66.348   2.798   4.675
  541    HA   PHE  78           HA       PHE  78  67.070   1.022   2.529
  542   1HB   PHE  78           HB2      PHE  78  65.388   0.924   4.767
  543   2HB   PHE  78           HB1      PHE  78  64.301   0.762   3.387
  544    HD1  PHE  78           HD2      PHE  78  64.645  -1.053   1.723
  545    HD2  PHE  78           HD1      PHE  78  66.981  -0.791   5.316
  546    HE1  PHE  78           HE2      PHE  78  65.378  -3.404   1.418
  547    HE2  PHE  78           HE1      PHE  78  67.715  -3.142   5.013
  548    HZ   PHE  78           HZ       PHE  78  66.912  -4.447   3.063
  549    H    LEU  79           HN       LEU  79  64.070   2.926   2.956
  550    HA   LEU  79           HA       LEU  79  62.970   2.650   0.430
  551   1HB   LEU  79           HB2      LEU  79  63.130   5.238   2.010
  552   2HB   LEU  79           HB1      LEU  79  61.963   4.879   0.738
  553    HG   LEU  79           HG       LEU  79  62.244   3.132   3.189
  554   1HD1  LEU  79          HD13      LEU  79  60.834   5.740   2.823
  555   2HD1  LEU  79          HD12      LEU  79  59.999   4.476   3.726
  556   3HD1  LEU  79          HD11      LEU  79  61.573   5.056   4.272
  557   1HD2  LEU  79          HD23      LEU  79  60.142   3.542   1.047
  558   2HD2  LEU  79          HD22      LEU  79  61.060   2.074   1.384
  559   3HD2  LEU  79          HD21      LEU  79  59.838   2.632   2.528
  560    H    VAL  80           HN       VAL  80  65.834   4.437   1.328
  561    HA   VAL  80           HA       VAL  80  66.041   6.006  -1.090
  562    HB   VAL  80           HB       VAL  80  68.073   5.142   0.983
  563   1HG1  VAL  80          HG11      VAL  80  68.402   6.504  -1.640
  564   2HG1  VAL  80          HG13      VAL  80  69.259   7.220  -0.274
  565   3HG1  VAL  80          HG12      VAL  80  69.557   5.540  -0.718
  566   1HG2  VAL  80          HG23      VAL  80  66.613   7.726   0.363
  567   2HG2  VAL  80          HG22      VAL  80  66.479   6.747   1.824
  568   3HG2  VAL  80          HG21      VAL  80  67.971   7.623   1.484
  569    H    MET  81           HN       MET  81  67.670   2.997  -0.031
  570    HA   MET  81           HA       MET  81  69.124   2.514  -2.402
  571   1HB   MET  81           HB2      MET  81  69.169   1.241  -0.143
  572   2HB   MET  81           HB1      MET  81  67.846   0.286  -0.817
  573   1HG   MET  81           HG2      MET  81  69.232  -0.330  -2.738
  574   2HG   MET  81           HG1      MET  81  70.546   0.682  -2.141
  575   1HE   MET  81           HE2      MET  81  70.918   0.724   0.273
  576   2HE   MET  81           HE1      MET  81  70.356  -0.493   1.417
  577   3HE   MET  81           HE3      MET  81  71.981  -0.606   0.727
  578    H    MET  82           HN       MET  82  65.731   1.927  -1.659
  579    HA   MET  82           HA       MET  82  65.162   0.220  -3.892
  580   1HB   MET  82           HB2      MET  82  63.341   2.153  -2.425
  581   2HB   MET  82           HB1      MET  82  62.806   0.864  -3.503
  582   1HG   MET  82           HG2      MET  82  64.553   0.310  -1.102
  583   2HG   MET  82           HG1      MET  82  62.794   0.335  -0.991
  584   1HE   MET  82           HE3      MET  82  65.785  -1.242  -1.438
  585   2HE   MET  82           HE2      MET  82  65.485  -2.906  -1.939
  586   3HE   MET  82           HE1      MET  82  65.802  -1.670  -3.154
  587    H    VAL  83           HN       VAL  83  64.244   3.663  -3.520
  588    HA   VAL  83           HA       VAL  83  63.721   4.037  -6.306
  589    HB   VAL  83           HB       VAL  83  64.597   6.238  -4.435
  590   1HG1  VAL  83          HG11      VAL  83  64.141   6.767  -6.824
  591   2HG1  VAL  83          HG13      VAL  83  62.517   6.101  -6.641
  592   3HG1  VAL  83          HG12      VAL  83  62.986   7.544  -5.740
  593   1HG2  VAL  83          HG22      VAL  83  62.221   4.458  -4.298
  594   2HG2  VAL  83          HG21      VAL  83  63.009   5.383  -3.019
  595   3HG2  VAL  83          HG23      VAL  83  61.903   6.186  -4.133
  596    H    ARG  84           HN       ARG  84  66.667   3.731  -4.625
  597    HA   ARG  84           HA       ARG  84  68.314   5.477  -6.212
  598   1HB   ARG  84           HB2      ARG  84  68.717   3.901  -3.985
  599   2HB   ARG  84           HB1      ARG  84  69.616   3.032  -5.230
  600   1HG   ARG  84           HG2      ARG  84  71.267   4.550  -5.091
  601   2HG   ARG  84           HG1      ARG  84  70.136   5.813  -5.579
  602   1HD   ARG  84           HD2      ARG  84  69.365   5.790  -3.105
  603   2HD   ARG  84           HD1      ARG  84  70.868   4.922  -2.793
  604    HE   ARG  84           HE       ARG  84  71.783   7.097  -2.789
  605   1HH1  ARG  84          HH11      ARG  84  72.029   6.827  -5.779
  606   2HH1  ARG  84          HH12      ARG  84  71.264   8.279  -6.330
  607   1HH2  ARG  84          HH21      ARG  84  69.700   8.918  -3.302
  608   2HH2  ARG  84          HH22      ARG  84  69.943   9.463  -4.928
  609    H    GLN  85           HN       GLN  85  66.986   2.292  -6.771
  610    HA   GLN  85           HA       GLN  85  68.642   2.103  -9.246
  611   1HB   GLN  85           HB2      GLN  85  69.192   0.173  -8.079
  612   2HB   GLN  85           HB1      GLN  85  67.615   0.067  -7.305
  613   1HG   GLN  85           HG2      GLN  85  67.817  -1.724  -8.936
  614   2HG   GLN  85           HG1      GLN  85  66.624  -0.559  -9.509
  615   1HE2  GLN  85          HE22      GLN  85  68.722  -1.092 -12.460
  616   2HE2  GLN  85          HE21      GLN  85  67.481  -1.877 -11.608
  617    H    MET  86           HN       MET  86  65.371   1.638  -7.905
  618    HA   MET  86           HA       MET  86  64.149   0.970 -10.418
  619   1HB   MET  86           HB2      MET  86  62.069   1.206  -9.302
  620   2HB   MET  86           HB1      MET  86  63.187   0.666  -8.050
  621   1HG   MET  86           HG2      MET  86  62.597   2.480  -6.852
  622   2HG   MET  86           HG1      MET  86  63.405   3.467  -8.069
  623   1HE   MET  86           HE3      MET  86  60.401   1.569  -7.013
  624   2HE   MET  86           HE2      MET  86  60.068   3.117  -6.236
  625   3HE   MET  86           HE1      MET  86  58.997   2.527  -7.505
  626    H    LYS  87           HN       LYS  87  65.402   3.918  -9.245
  627    HA   LYS  87           HA       LYS  87  63.635   5.830 -10.360
  628   1HB   LYS  87           HB2      LYS  87  66.154   5.890  -9.155
  629   2HB   LYS  87           HB1      LYS  87  66.433   6.541 -10.770
  630   1HG   LYS  87           HG2      LYS  87  64.909   8.301 -10.463
  631   2HG   LYS  87           HG1      LYS  87  64.090   7.484  -9.131
  632   1HD   LYS  87           HD2      LYS  87  65.440   8.496  -7.647
  633   2HD   LYS  87           HD1      LYS  87  66.858   7.817  -8.447
  634   1HE   LYS  87           HE2      LYS  87  66.943  10.290  -8.413
  635   2HE   LYS  87           HE1      LYS  87  66.854   9.672 -10.062
  636   1HZ   LYS  87           HZ1      LYS  87  64.320  10.205  -8.739
  637   2HZ   LYS  87           HZ3      LYS  87  65.251  11.564  -9.136
  638   3HZ   LYS  87           HZ2      LYS  87  64.783  10.472 -10.350
  639    H    GLU  88           HN       GLU  88  66.456   4.233 -11.874
  640    HA   GLU  88           HA       GLU  88  67.053   4.080 -14.145
  641   1HB   GLU  88           HB2      GLU  88  64.039   3.779 -14.226
  642   2HB   GLU  88           HB1      GLU  88  65.073   3.510 -15.629
  643   1HG   GLU  88           HG2      GLU  88  66.210   1.698 -14.566
  644   2HG   GLU  88           HG1      GLU  88  65.519   2.097 -12.992
  645    H    ASP  89           HN       ASP  89  66.691   6.782 -13.109
  646    HA   ASP  89           HA       ASP  89  65.713   8.151 -15.585
  647   1HB   ASP  89           HB2      ASP  89  65.021   8.575 -12.870
  648   2HB   ASP  89           HB1      ASP  89  66.018   9.948 -13.353
  649    H    ALA  90           HN       ALA  90  68.398   7.035 -15.163
  650    HA   ALA  90           HA       ALA  90  69.952   9.270 -16.064
  651   1HB   ALA  90           HB2      ALA  90  69.662   9.160 -13.265
  652   2HB   ALA  90           HB1      ALA  90  71.273   8.526 -13.593
  653   3HB   ALA  90           HB3      ALA  90  70.823  10.130 -14.170
   
  No H/Q in entry =         653
  Start of MODEL   12
    1   1H    ALA   1           HT1      ALA   1  68.004  18.272  11.413
    2   2H    ALA   1           HT3      ALA   1  69.442  19.154  11.240
    3   3H    ALA   1           HT2      ALA   1  68.484  18.821   9.877
    4    HA   ALA   1           HA       ALA   1  70.207  17.291   9.707
    5   1HB   ALA   1           HB3      ALA   1  70.773  17.807  12.239
    6   2HB   ALA   1           HB2      ALA   1  69.837  16.339  12.528
    7   3HB   ALA   1           HB1      ALA   1  71.277  16.282  11.510
    8    H    SER   2           HN       SER   2  70.044  14.763   9.926
    9    HA   SER   2           HA       SER   2  68.746  12.850   9.525
   10   1HB   SER   2           HB2      SER   2  67.106  14.375  11.531
   11   2HB   SER   2           HB1      SER   2  66.442  12.926  10.782
   12    HG   SER   2           HG       SER   2  69.050  12.899  11.829
   13    H    MET   3           HN       MET   3  66.589  12.173   8.499
   14    HA   MET   3           HA       MET   3  65.196  12.402   6.618
   15   1HB   MET   3           HB2      MET   3  64.506  14.370   8.571
   16   2HB   MET   3           HB1      MET   3  64.345  15.110   6.977
   17   1HG   MET   3           HG2      MET   3  62.419  13.993   6.664
   18   2HG   MET   3           HG1      MET   3  63.293  12.468   6.800
   19   1HE   MET   3           HE2      MET   3  63.324  11.045   8.205
   20   2HE   MET   3           HE1      MET   3  63.715  11.451   9.874
   21   3HE   MET   3           HE3      MET   3  62.131  10.775   9.473
   22    H    THR   4           HN       THR   4  67.938  13.029   6.139
   23    HA   THR   4           HA       THR   4  68.500  15.470   4.891
   24    HB   THR   4           HB       THR   4  70.067  14.138   3.429
   25    HG1  THR   4           HG1      THR   4  68.555  12.098   4.610
   26   1HG2  THR   4          HG23      THR   4  69.968  13.620   6.406
   27   2HG2  THR   4          HG22      THR   4  71.344  13.170   5.401
   28   3HG2  THR   4          HG21      THR   4  70.886  14.866   5.560
   29    H    ASP   5           HN       ASP   5  68.746  15.705   2.389
   30    HA   ASP   5           HA       ASP   5  66.104  15.585   1.243
   31   1HB   ASP   5           HB2      ASP   5  68.827  16.373   0.262
   32   2HB   ASP   5           HB1      ASP   5  67.530  16.142  -0.912
   33    H    GLN   6           HN       GLN   6  68.916  13.488   1.096
   34    HA   GLN   6           HA       GLN   6  68.305  11.990  -1.221
   35   1HB   GLN   6           HB2      GLN   6  69.868  11.558   1.245
   36   2HB   GLN   6           HB1      GLN   6  69.300  10.081   0.467
   37   1HG   GLN   6           HG2      GLN   6  70.245  11.850  -1.571
   38   2HG   GLN   6           HG1      GLN   6  71.480  11.747  -0.314
   39   1HE2  GLN   6          HE22      GLN   6  72.310   8.381  -1.033
   40   2HE2  GLN   6          HE21      GLN   6  72.554   9.708  -0.003
   41    H    GLN   7           HN       GLN   7  67.186  11.505   2.136
   42    HA   GLN   7           HA       GLN   7  65.471   9.270   1.371
   43   1HB   GLN   7           HB2      GLN   7  65.644  10.929   3.904
   44   2HB   GLN   7           HB1      GLN   7  64.601   9.520   3.717
   45   1HG   GLN   7           HG2      GLN   7  66.434   8.043   3.505
   46   2HG   GLN   7           HG1      GLN   7  67.559   9.354   3.149
   47   1HE2  GLN   7          HE22      GLN   7  68.487   9.495   6.535
   48   2HE2  GLN   7          HE21      GLN   7  68.966   9.505   4.907
   49    H    ALA   8           HN       ALA   8  65.201  12.709   1.395
   50    HA   ALA   8           HA       ALA   8  62.326  12.875   1.666
   51   1HB   ALA   8           HB3      ALA   8  64.300  14.719   1.737
   52   2HB   ALA   8           HB2      ALA   8  63.759  14.937   0.072
   53   3HB   ALA   8           HB1      ALA   8  62.619  15.135   1.403
   54    H    GLU   9           HN       GLU   9  64.536  12.425  -1.047
   55    HA   GLU   9           HA       GLU   9  62.488  12.812  -3.076
   56   1HB   GLU   9           HB2      GLU   9  65.017  13.047  -3.396
   57   2HB   GLU   9           HB1      GLU   9  65.076  11.284  -3.412
   58   1HG   GLU   9           HG2      GLU   9  64.565  11.364  -5.604
   59   2HG   GLU   9           HG1      GLU   9  62.971  11.966  -5.146
   60    H    ALA  10           HN       ALA  10  64.163   9.916  -1.790
   61    HA   ALA  10           HA       ALA  10  62.760   7.960  -3.234
   62   1HB   ALA  10           HB1      ALA  10  64.163   8.047  -0.619
   63   2HB   ALA  10           HB3      ALA  10  63.032   6.712  -0.843
   64   3HB   ALA  10           HB2      ALA  10  64.371   6.935  -1.971
   65    H    ARG  11           HN       ARG  11  61.952   8.826   0.147
   66    HA   ARG  11           HA       ARG  11  59.420   7.618   0.212
   67   1HB   ARG  11           HB2      ARG  11  60.906   9.421   1.851
   68   2HB   ARG  11           HB1      ARG  11  59.274  10.067   1.684
   69   1HG   ARG  11           HG2      ARG  11  58.282   8.117   2.575
   70   2HG   ARG  11           HG1      ARG  11  59.738   7.155   2.316
   71   1HD   ARG  11           HD2      ARG  11  59.261   7.917   4.729
   72   2HD   ARG  11           HD1      ARG  11  60.885   8.205   4.107
   73    HE   ARG  11           HE       ARG  11  59.429  10.524   3.509
   74   1HH1  ARG  11          HH21      ARG  11  58.388   9.341   6.273
   75   2HH1  ARG  11          HH22      ARG  11  59.241  10.394   7.350
   76   1HH2  ARG  11          HH11      ARG  11  61.366  11.613   4.896
   77   2HH2  ARG  11          HH12      ARG  11  60.928  11.681   6.570
   78    H    ALA  12           HN       ALA  12  60.363  10.740  -1.131
   79    HA   ALA  12           HA       ALA  12  57.780  11.875  -1.450
   80   1HB   ALA  12           HB2      ALA  12  60.456  12.271  -2.642
   81   2HB   ALA  12           HB1      ALA  12  59.108  12.781  -3.659
   82   3HB   ALA  12           HB3      ALA  12  59.303  13.464  -2.044
   83    H    PHE  13           HN       PHE  13  59.620   9.693  -3.582
   84    HA   PHE  13           HA       PHE  13  57.363   9.573  -5.478
   85   1HB   PHE  13           HB2      PHE  13  59.558   9.548  -6.470
   86   2HB   PHE  13           HB1      PHE  13  60.083   8.239  -5.410
   87    HD1  PHE  13           HD1      PHE  13  57.745   9.104  -8.175
   88    HD2  PHE  13           HD2      PHE  13  59.638   5.962  -5.943
   89    HE1  PHE  13           HE1      PHE  13  56.925   7.441  -9.823
   90    HE2  PHE  13           HE2      PHE  13  58.819   4.298  -7.589
   91    HZ   PHE  13           HZ       PHE  13  57.463   5.037  -9.529
   92    H    LEU  14           HN       LEU  14  58.294   8.014  -2.621
   93    HA   LEU  14           HA       LEU  14  57.009   5.447  -3.360
   94   1HB   LEU  14           HB2      LEU  14  58.423   6.379  -0.846
   95   2HB   LEU  14           HB1      LEU  14  57.686   4.786  -1.022
   96    HG   LEU  14           HG       LEU  14  59.906   5.931  -2.743
   97   1HD1  LEU  14          HD13      LEU  14  60.607   5.183  -0.484
   98   2HD1  LEU  14          HD12      LEU  14  59.864   3.612  -0.786
   99   3HD1  LEU  14          HD11      LEU  14  61.251   4.131  -1.744
  100   1HD2  LEU  14          HD23      LEU  14  58.054   3.636  -3.056
  101   2HD2  LEU  14          HD22      LEU  14  58.945   4.539  -4.282
  102   3HD2  LEU  14          HD21      LEU  14  59.756   3.282  -3.348
  103    H    SER  15           HN       SER  15  55.059   4.755  -2.436
  104    HA   SER  15           HA       SER  15  53.459   6.911  -1.149
  105   1HB   SER  15           HB2      SER  15  52.240   4.312  -1.973
  106   2HB   SER  15           HB1      SER  15  51.576   5.941  -2.068
  107    HG   SER  15           HG       SER  15  53.125   6.324  -3.755
  108    H    GLU  16           HN       GLU  16  52.341   6.492   0.825
  109    HA   GLU  16           HA       GLU  16  53.697   5.016   2.795
  110   1HB   GLU  16           HB2      GLU  16  50.953   6.160   2.548
  111   2HB   GLU  16           HB1      GLU  16  51.227   4.994   3.842
  112   1HG   GLU  16           HG2      GLU  16  52.044   6.741   5.029
  113   2HG   GLU  16           HG1      GLU  16  53.464   6.619   3.991
  114    H    GLU  17           HN       GLU  17  51.295   3.956   0.469
  115    HA   GLU  17           HA       GLU  17  50.670   1.449   1.752
  116   1HB   GLU  17           HB2      GLU  17  49.540   2.760  -0.286
  117   2HB   GLU  17           HB1      GLU  17  50.582   1.689  -1.225
  118   1HG   GLU  17           HG2      GLU  17  49.402  -0.178  -0.649
  119   2HG   GLU  17           HG1      GLU  17  49.101   0.396   0.991
  120    H    MET  18           HN       MET  18  53.069   2.411  -0.695
  121    HA   MET  18           HA       MET  18  54.057  -0.276  -1.110
  122   1HB   MET  18           HB2      MET  18  55.389   2.402  -1.620
  123   2HB   MET  18           HB1      MET  18  55.954   0.849  -2.237
  124   1HG   MET  18           HG2      MET  18  53.603   0.600  -3.261
  125   2HG   MET  18           HG1      MET  18  53.415   2.323  -2.937
  126   1HE   MET  18           HE1      MET  18  53.418   3.635  -4.897
  127   2HE   MET  18           HE3      MET  18  54.127   3.160  -6.447
  128   3HE   MET  18           HE2      MET  18  52.923   2.132  -5.672
  129    H    ILE  19           HN       ILE  19  55.471   2.520   0.637
  130    HA   ILE  19           HA       ILE  19  57.707   1.322   1.746
  131    HB   ILE  19           HB       ILE  19  55.758   3.257   3.020
  132   1HG1  ILE  19          HG12      ILE  19  58.441   4.191   2.389
  133   2HG1  ILE  19          HG11      ILE  19  57.648   3.521   0.963
  134   1HG2  ILE  19          HG22      ILE  19  58.454   2.264   3.980
  135   2HG2  ILE  19          HG21      ILE  19  57.707   3.751   4.567
  136   3HG2  ILE  19          HG23      ILE  19  56.916   2.198   4.843
  137   1HD1  ILE  19          HD11      ILE  19  55.657   4.943   1.449
  138   2HD1  ILE  19          HD13      ILE  19  56.536   5.666   2.795
  139   3HD1  ILE  19          HD12      ILE  19  57.109   5.895   1.143
  140    H    ALA  20           HN       ALA  20  54.341   0.889   2.742
  141    HA   ALA  20           HA       ALA  20  54.873  -0.542   5.165
  142   1HB   ALA  20           HB2      ALA  20  52.573   0.090   3.527
  143   2HB   ALA  20           HB1      ALA  20  52.505  -1.594   4.047
  144   3HB   ALA  20           HB3      ALA  20  52.633  -0.306   5.245
  145    H    GLU  21           HN       GLU  21  54.235  -1.704   1.843
  146    HA   GLU  21           HA       GLU  21  54.479  -4.479   2.413
  147   1HB   GLU  21           HB2      GLU  21  54.899  -2.820  -0.066
  148   2HB   GLU  21           HB1      GLU  21  55.246  -4.550  -0.078
  149   1HG   GLU  21           HG2      GLU  21  52.980  -5.080   0.562
  150   2HG   GLU  21           HG1      GLU  21  52.605  -3.377   0.831
  151    H    PHE  22           HN       PHE  22  56.929  -2.027   1.673
  152    HA   PHE  22           HA       PHE  22  59.124  -3.878   1.446
  153   1HB   PHE  22           HB2      PHE  22  59.293  -0.989   2.332
  154   2HB   PHE  22           HB1      PHE  22  60.542  -1.943   1.536
  155    HD1  PHE  22           HD1      PHE  22  58.286  -3.313  -0.298
  156    HD2  PHE  22           HD2      PHE  22  59.499   0.726   0.527
  157    HE1  PHE  22           HE1      PHE  22  57.421  -2.601  -2.510
  158    HE2  PHE  22           HE2      PHE  22  58.633   1.437  -1.685
  159    HZ   PHE  22           HZ       PHE  22  57.594  -0.225  -3.203
  160    H    LYS  23           HN       LYS  23  57.530  -2.326   4.160
  161    HA   LYS  23           HA       LYS  23  59.592  -2.740   6.107
  162   1HB   LYS  23           HB2      LYS  23  57.676  -1.251   6.516
  163   2HB   LYS  23           HB1      LYS  23  56.583  -2.635   6.471
  164   1HG   LYS  23           HG2      LYS  23  57.227  -1.924   8.799
  165   2HG   LYS  23           HG1      LYS  23  57.627  -3.602   8.429
  166   1HD   LYS  23           HD2      LYS  23  59.942  -3.003   7.979
  167   2HD   LYS  23           HD1      LYS  23  59.572  -1.291   8.191
  168   1HE   LYS  23           HE2      LYS  23  59.211  -3.387  10.350
  169   2HE   LYS  23           HE1      LYS  23  60.619  -2.334  10.218
  170   1HZ   LYS  23           HZ1      LYS  23  58.279  -0.784  10.046
  171   2HZ   LYS  23           HZ3      LYS  23  58.173  -1.773  11.420
  172   3HZ   LYS  23           HZ2      LYS  23  59.501  -0.731  11.224
  173    H    ALA  24           HN       ALA  24  57.646  -4.956   4.420
  174    HA   ALA  24           HA       ALA  24  57.453  -6.972   6.513
  175   1HB   ALA  24           HB2      ALA  24  55.911  -6.837   4.523
  176   2HB   ALA  24           HB1      ALA  24  57.259  -7.360   3.513
  177   3HB   ALA  24           HB3      ALA  24  56.629  -8.430   4.764
  178    H    ALA  25           HN       ALA  25  59.597  -6.415   3.721
  179    HA   ALA  25           HA       ALA  25  61.180  -8.792   4.189
  180   1HB   ALA  25           HB2      ALA  25  61.133  -6.597   2.303
  181   2HB   ALA  25           HB1      ALA  25  62.782  -6.891   2.857
  182   3HB   ALA  25           HB3      ALA  25  61.851  -8.197   2.121
  183    H    PHE  26           HN       PHE  26  61.431  -5.401   5.189
  184    HA   PHE  26           HA       PHE  26  64.018  -5.335   6.238
  185   1HB   PHE  26           HB2      PHE  26  62.309  -3.451   6.214
  186   2HB   PHE  26           HB1      PHE  26  61.608  -4.178   7.662
  187    HD1  PHE  26           HD1      PHE  26  64.948  -3.143   6.298
  188    HD2  PHE  26           HD2      PHE  26  62.402  -3.487   9.740
  189    HE1  PHE  26           HE1      PHE  26  66.679  -2.035   7.689
  190    HE2  PHE  26           HE2      PHE  26  64.131  -2.380  11.132
  191    HZ   PHE  26           HZ       PHE  26  66.271  -1.653  10.106
  192    H    ASP  27           HN       ASP  27  61.198  -5.874   8.372
  193    HA   ASP  27           HA       ASP  27  62.593  -6.948  10.540
  194   1HB   ASP  27           HB2      ASP  27  60.050  -6.427  10.248
  195   2HB   ASP  27           HB1      ASP  27  59.935  -8.111   9.737
  196    H    MET  28           HN       MET  28  61.945  -8.415   7.460
  197    HA   MET  28           HA       MET  28  62.145 -11.164   8.162
  198   1HB   MET  28           HB2      MET  28  61.910  -9.714   5.797
  199   2HB   MET  28           HB1      MET  28  63.474 -10.514   5.642
  200   1HG   MET  28           HG2      MET  28  61.543 -12.345   6.761
  201   2HG   MET  28           HG1      MET  28  60.925 -11.667   5.256
  202   1HE   MET  28           HE2      MET  28  62.773 -10.923   3.598
  203   2HE   MET  28           HE1      MET  28  63.894 -12.075   2.877
  204   3HE   MET  28           HE3      MET  28  62.148 -12.316   2.717
  205    H    PHE  29           HN       PHE  29  64.766  -9.149   6.756
  206    HA   PHE  29           HA       PHE  29  66.778 -11.033   7.744
  207   1HB   PHE  29           HB2      PHE  29  67.311  -8.272   6.633
  208   2HB   PHE  29           HB1      PHE  29  68.367  -9.684   6.598
  209    HD1  PHE  29           HD1      PHE  29  67.653 -11.711   5.226
  210    HD2  PHE  29           HD2      PHE  29  65.741  -7.879   4.905
  211    HE1  PHE  29           HE1      PHE  29  66.695 -12.373   3.037
  212    HE2  PHE  29           HE2      PHE  29  64.781  -8.541   2.715
  213    HZ   PHE  29           HZ       PHE  29  65.258 -10.788   1.781
  214    H    ASP  30           HN       ASP  30  65.032  -8.555   9.169
  215    HA   ASP  30           HA       ASP  30  67.257  -7.893  11.049
  216   1HB   ASP  30           HB2      ASP  30  66.228  -5.928  10.031
  217   2HB   ASP  30           HB1      ASP  30  64.625  -6.481  10.520
  218    H    ALA  31           HN       ALA  31  66.541 -10.295  11.694
  219    HA   ALA  31           HA       ALA  31  64.119 -10.518  13.273
  220   1HB   ALA  31           HB2      ALA  31  65.973 -12.304  12.226
  221   2HB   ALA  31           HB1      ALA  31  66.249 -12.399  13.965
  222   3HB   ALA  31           HB3      ALA  31  64.644 -12.718  13.309
  223    H    ASP  32           HN       ASP  32  67.324  -9.350  13.875
  224    HA   ASP  32           HA       ASP  32  67.304  -9.722  16.748
  225   1HB   ASP  32           HB2      ASP  32  69.179  -8.907  14.856
  226   2HB   ASP  32           HB1      ASP  32  68.877  -7.449  15.803
  227    H    GLY  33           HN       GLY  33  65.577  -7.667  14.688
  228   1HA   GLY  33           HA2      GLY  33  64.179  -5.834  15.120
  229   2HA   GLY  33           HA1      GLY  33  64.235  -6.327  16.814
  230    H    GLY  34           HN       GLY  34  67.225  -5.630  15.188
  231   1HA   GLY  34           HA2      GLY  34  67.880  -3.561  17.100
  232   2HA   GLY  34           HA1      GLY  34  68.850  -4.004  15.693
  233    H    GLY  35           HN       GLY  35  66.322  -3.581  14.004
  234   1HA   GLY  35           HA2      GLY  35  65.091  -1.722  13.122
  235   2HA   GLY  35           HA1      GLY  35  66.004  -0.647  14.181
  236    H    ASP  36           HN       ASP  36  67.930  -2.934  12.523
  237    HA   ASP  36           HA       ASP  36  68.339  -1.381  10.098
  238   1HB   ASP  36           HB2      ASP  36  70.540  -0.528  10.568
  239   2HB   ASP  36           HB1      ASP  36  69.495  -0.004  11.889
  240    H    ILE  37           HN       ILE  37  69.134  -2.771   8.579
  241    HA   ILE  37           HA       ILE  37  70.336  -5.312   9.581
  242    HB   ILE  37           HB       ILE  37  68.620  -6.149   8.361
  243   1HG1  ILE  37          HG12      ILE  37  70.815  -6.484   6.962
  244   2HG1  ILE  37          HG11      ILE  37  69.262  -6.901   6.249
  245   1HG2  ILE  37          HG21      ILE  37  67.585  -3.938   8.051
  246   2HG2  ILE  37          HG23      ILE  37  68.629  -3.641   6.659
  247   3HG2  ILE  37          HG22      ILE  37  67.417  -4.922   6.596
  248   1HD1  ILE  37          HD13      ILE  37  69.182  -4.658   5.168
  249   2HD1  ILE  37          HD12      ILE  37  70.786  -4.312   5.812
  250   3HD1  ILE  37          HD11      ILE  37  70.569  -5.609   4.640
  251    H    SER  38           HN       SER  38  72.123  -6.193   8.347
  252    HA   SER  38           HA       SER  38  74.084  -4.179   7.658
  253   1HB   SER  38           HB2      SER  38  74.967  -6.184   8.558
  254   2HB   SER  38           HB1      SER  38  74.012  -7.191   7.472
  255    HG   SER  38           HG       SER  38  75.825  -5.338   6.402
  256    H    THR  39           HN       THR  39  74.769  -3.509   5.611
  257    HA   THR  39           HA       THR  39  72.928  -3.584   3.457
  258    HB   THR  39           HB       THR  39  74.694  -2.631   2.100
  259    HG1  THR  39           HG1      THR  39  76.840  -2.579   3.246
  260   1HG2  THR  39          HG21      THR  39  74.311  -1.783   4.900
  261   2HG2  THR  39          HG23      THR  39  75.751  -1.128   4.122
  262   3HG2  THR  39          HG22      THR  39  74.161  -0.852   3.410
  263    H    LYS  40           HN       LYS  40  75.171  -5.954   4.540
  264    HA   LYS  40           HA       LYS  40  75.716  -7.313   2.088
  265   1HB   LYS  40           HB2      LYS  40  75.504  -8.310   4.941
  266   2HB   LYS  40           HB1      LYS  40  76.022  -9.331   3.600
  267   1HG   LYS  40           HG2      LYS  40  77.840  -7.706   3.098
  268   2HG   LYS  40           HG1      LYS  40  77.352  -6.761   4.505
  269   1HD   LYS  40           HD2      LYS  40  79.144  -8.144   5.259
  270   2HD   LYS  40           HD1      LYS  40  77.673  -8.899   5.874
  271   1HE   LYS  40           HE2      LYS  40  77.712 -10.297   3.699
  272   2HE   LYS  40           HE1      LYS  40  79.384  -9.757   3.543
  273   1HZ   LYS  40           HZ3      LYS  40  79.191 -10.542   6.138
  274   2HZ   LYS  40           HZ2      LYS  40  78.254 -11.698   5.318
  275   3HZ   LYS  40           HZ1      LYS  40  79.875 -11.448   4.879
  276    H    ALA  41           HN       ALA  41  73.233  -8.039   4.568
  277    HA   ALA  41           HA       ALA  41  71.866  -9.955   2.897
  278   1HB   ALA  41           HB1      ALA  41  71.759  -9.670   5.474
  279   2HB   ALA  41           HB3      ALA  41  70.561  -8.419   5.142
  280   3HB   ALA  41           HB2      ALA  41  70.266 -10.081   4.630
  281    H    LEU  42           HN       LEU  42  72.072  -6.600   2.732
  282    HA   LEU  42           HA       LEU  42  69.404  -5.876   2.013
  283   1HB   LEU  42           HB2      LEU  42  71.718  -4.493   2.372
  284   2HB   LEU  42           HB1      LEU  42  71.624  -4.495   0.613
  285    HG   LEU  42           HG       LEU  42  69.446  -3.460   0.651
  286   1HD1  LEU  42          HD13      LEU  42  69.389  -4.568   3.322
  287   2HD1  LEU  42          HD12      LEU  42  69.003  -2.850   3.372
  288   3HD1  LEU  42          HD11      LEU  42  68.054  -3.938   2.360
  289   1HD2  LEU  42          HD21      LEU  42  71.568  -2.078   1.160
  290   2HD2  LEU  42          HD23      LEU  42  70.011  -1.336   1.529
  291   3HD2  LEU  42          HD22      LEU  42  70.981  -2.037   2.824
  292    H    GLY  43           HN       GLY  43  72.172  -6.899  -0.005
  293   1HA   GLY  43           HA2      GLY  43  71.095  -6.654  -2.546
  294   2HA   GLY  43           HA1      GLY  43  72.107  -8.023  -2.083
  295    H    THR  44           HN       THR  44  70.315  -9.090  -0.105
  296    HA   THR  44           HA       THR  44  68.548 -10.603  -1.852
  297    HB   THR  44           HB       THR  44  68.813 -10.544   1.170
  298    HG1  THR  44           HG1      THR  44  70.554 -11.580   0.636
  299   1HG2  THR  44          HG23      THR  44  66.593 -11.359   0.317
  300   2HG2  THR  44          HG22      THR  44  67.453 -12.605  -0.585
  301   3HG2  THR  44          HG21      THR  44  67.519 -12.588   1.178
  302    H    VAL  45           HN       VAL  45  68.120  -8.082   0.621
  303    HA   VAL  45           HA       VAL  45  65.303  -8.095   0.782
  304    HB   VAL  45           HB       VAL  45  67.128  -5.674   0.847
  305   1HG1  VAL  45          HG12      VAL  45  64.320  -6.200   1.847
  306   2HG1  VAL  45          HG11      VAL  45  65.300  -4.851   2.419
  307   3HG1  VAL  45          HG13      VAL  45  64.846  -4.951   0.718
  308   1HG2  VAL  45          HG22      VAL  45  67.219  -7.923   2.469
  309   2HG2  VAL  45          HG21      VAL  45  67.820  -6.323   2.906
  310   3HG2  VAL  45          HG23      VAL  45  66.195  -6.815   3.381
  311    H    MET  46           HN       MET  46  67.353  -6.128  -1.404
  312    HA   MET  46           HA       MET  46  65.135  -5.067  -2.889
  313   1HB   MET  46           HB2      MET  46  68.020  -5.449  -3.750
  314   2HB   MET  46           HB1      MET  46  66.838  -4.414  -4.552
  315   1HG   MET  46           HG2      MET  46  66.690  -3.613  -1.898
  316   2HG   MET  46           HG1      MET  46  68.413  -3.906  -2.139
  317   1HE   MET  46           HE2      MET  46  69.493  -3.474  -4.201
  318   2HE   MET  46           HE1      MET  46  68.583  -2.909  -5.600
  319   3HE   MET  46           HE3      MET  46  69.665  -1.806  -4.739
  320    H    ARG  47           HN       ARG  47  67.337  -7.810  -3.497
  321    HA   ARG  47           HA       ARG  47  66.446  -8.650  -5.994
  322   1HB   ARG  47           HB2      ARG  47  67.831  -9.834  -3.789
  323   2HB   ARG  47           HB1      ARG  47  66.620 -10.984  -4.353
  324   1HG   ARG  47           HG2      ARG  47  67.491 -10.394  -6.733
  325   2HG   ARG  47           HG1      ARG  47  68.900  -9.751  -5.887
  326   1HD   ARG  47           HD2      ARG  47  69.500 -11.989  -6.321
  327   2HD   ARG  47           HD1      ARG  47  68.933 -12.032  -4.650
  328    HE   ARG  47           HE       ARG  47  67.401 -13.620  -5.471
  329   1HH1  ARG  47          HH11      ARG  47  68.446 -11.820  -8.133
  330   2HH1  ARG  47          HH12      ARG  47  66.995 -12.030  -9.055
  331   1HH2  ARG  47          HH21      ARG  47  65.264 -13.570  -6.475
  332   2HH2  ARG  47          HH22      ARG  47  65.193 -13.022  -8.116
  333    H    MET  48           HN       MET  48  64.864  -9.134  -2.853
  334    HA   MET  48           HA       MET  48  62.722 -10.767  -3.918
  335   1HB   MET  48           HB2      MET  48  63.499  -9.653  -1.341
  336   2HB   MET  48           HB1      MET  48  61.761  -9.522  -1.605
  337   1HG   MET  48           HG2      MET  48  61.459 -11.813  -1.699
  338   2HG   MET  48           HG1      MET  48  63.089 -12.106  -2.307
  339   1HE   MET  48           HE1      MET  48  61.592 -10.001   0.254
  340   2HE   MET  48           HE3      MET  48  61.074 -11.335   1.294
  341   3HE   MET  48           HE2      MET  48  62.426 -10.313   1.774
  342    H    LEU  49           HN       LEU  49  63.146  -7.300  -3.303
  343    HA   LEU  49           HA       LEU  49  60.764  -6.805  -5.013
  344   1HB   LEU  49           HB2      LEU  49  60.072  -4.981  -3.400
  345   2HB   LEU  49           HB1      LEU  49  59.863  -6.621  -2.783
  346    HG   LEU  49           HG       LEU  49  62.516  -5.423  -2.261
  347   1HD1  LEU  49          HD11      LEU  49  60.778  -3.535  -1.985
  348   2HD1  LEU  49          HD13      LEU  49  60.162  -4.473  -0.624
  349   3HD1  LEU  49          HD12      LEU  49  61.822  -3.875  -0.605
  350   1HD2  LEU  49          HD22      LEU  49  60.612  -7.339  -1.111
  351   2HD2  LEU  49          HD21      LEU  49  62.369  -7.281  -0.965
  352   3HD2  LEU  49          HD23      LEU  49  61.361  -6.302   0.102
  353    H    GLY  50           HN       GLY  50  62.663  -6.335  -6.476
  354   1HA   GLY  50           HA2      GLY  50  63.076  -3.538  -6.758
  355   2HA   GLY  50           HA1      GLY  50  64.501  -4.217  -5.969
  356    H    GLN  51           HN       GLN  51  66.067  -4.929  -7.322
  357    HA   GLN  51           HA       GLN  51  65.288  -6.097  -9.940
  358   1HB   GLN  51           HB2      GLN  51  67.556  -4.131  -9.879
  359   2HB   GLN  51           HB1      GLN  51  66.544  -4.624 -11.238
  360   1HG   GLN  51           HG2      GLN  51  65.480  -3.050  -8.881
  361   2HG   GLN  51           HG1      GLN  51  66.092  -2.285 -10.347
  362   1HE2  GLN  51          HE22      GLN  51  62.362  -2.926 -10.627
  363   2HE2  GLN  51          HE21      GLN  51  63.301  -2.170  -9.433
  364    H    ASN  52           HN       ASN  52  67.958  -6.263 -10.925
  365    HA   ASN  52           HA       ASN  52  69.533  -7.606  -8.821
  366   1HB   ASN  52           HB2      ASN  52  69.725  -9.636 -10.448
  367   2HB   ASN  52           HB1      ASN  52  68.290  -9.510  -9.428
  368   1HD2  ASN  52          HD22      ASN  52  66.101  -8.740 -12.155
  369   2HD2  ASN  52          HD21      ASN  52  66.297  -8.601 -10.475
  370    HA   PRO  53           HA       PRO  53  71.926  -5.500 -12.190
  371   1HB   PRO  53           HB2      PRO  53  73.144  -3.667 -10.540
  372   2HB   PRO  53           HB1      PRO  53  71.600  -3.374 -11.357
  373   1HG   PRO  53           HG2      PRO  53  72.115  -3.985  -8.483
  374   2HG   PRO  53           HG1      PRO  53  70.769  -3.097  -9.218
  375   1HD   PRO  53           HD2      PRO  53  70.686  -5.777  -8.309
  376   2HD   PRO  53           HD1      PRO  53  69.473  -4.985  -9.339
  377    H    THR  54           HN       THR  54  74.447  -5.117 -12.071
  378    HA   THR  54           HA       THR  54  75.632  -7.548 -10.993
  379    HB   THR  54           HB       THR  54  76.407  -6.559 -13.126
  380    HG1  THR  54           HG1      THR  54  78.524  -6.899 -12.706
  381   1HG2  THR  54          HG21      THR  54  76.995  -4.241 -11.309
  382   2HG2  THR  54          HG23      THR  54  77.966  -4.486 -12.761
  383   3HG2  THR  54          HG22      THR  54  76.225  -4.242 -12.895
  384    H    LYS  55           HN       LYS  55  77.368  -7.595  -9.412
  385    HA   LYS  55           HA       LYS  55  76.884  -6.142  -7.046
  386   1HB   LYS  55           HB2      LYS  55  78.857  -8.022  -8.003
  387   2HB   LYS  55           HB1      LYS  55  79.644  -6.758  -7.057
  388   1HG   LYS  55           HG2      LYS  55  78.895  -7.713  -5.166
  389   2HG   LYS  55           HG1      LYS  55  77.234  -7.470  -5.708
  390   1HD   LYS  55           HD2      LYS  55  77.306  -9.588  -6.948
  391   2HD   LYS  55           HD1      LYS  55  78.983  -9.830  -6.461
  392   1HE   LYS  55           HE2      LYS  55  77.737 -11.118  -4.914
  393   2HE   LYS  55           HE1      LYS  55  78.117  -9.634  -4.039
  394   1HZ   LYS  55           HZ2      LYS  55  75.617  -9.916  -5.587
  395   2HZ   LYS  55           HZ1      LYS  55  75.727 -10.457  -3.980
  396   3HZ   LYS  55           HZ3      LYS  55  75.974  -8.818  -4.339
  397    H    GLU  56           HN       GLU  56  78.517  -5.158  -9.922
  398    HA   GLU  56           HA       GLU  56  80.307  -3.208  -8.886
  399   1HB   GLU  56           HB2      GLU  56  80.380  -3.844 -11.230
  400   2HB   GLU  56           HB1      GLU  56  78.740  -3.244 -11.481
  401   1HG   GLU  56           HG2      GLU  56  79.616  -0.969 -10.684
  402   2HG   GLU  56           HG1      GLU  56  81.233  -1.647 -10.880
  403    H    GLU  57           HN       GLU  57  76.857  -2.966  -9.741
  404    HA   GLU  57           HA       GLU  57  76.758  -0.148  -8.931
  405   1HB   GLU  57           HB2      GLU  57  74.456  -2.032  -9.518
  406   2HB   GLU  57           HB1      GLU  57  74.408  -0.269  -9.507
  407   1HG   GLU  57           HG2      GLU  57  76.045  -1.976 -11.405
  408   2HG   GLU  57           HG1      GLU  57  74.560  -1.120 -11.815
  409    H    LEU  58           HN       LEU  58  76.195  -3.269  -7.476
  410    HA   LEU  58           HA       LEU  58  74.514  -2.432  -5.311
  411   1HB   LEU  58           HB2      LEU  58  75.971  -4.811  -6.085
  412   2HB   LEU  58           HB1      LEU  58  76.177  -4.504  -4.359
  413    HG   LEU  58           HG       LEU  58  74.174  -5.887  -4.784
  414   1HD1  LEU  58          HD13      LEU  58  74.094  -3.197  -3.557
  415   2HD1  LEU  58          HD12      LEU  58  72.517  -3.911  -3.893
  416   3HD1  LEU  58          HD11      LEU  58  73.670  -4.763  -2.866
  417   1HD2  LEU  58          HD21      LEU  58  73.792  -4.790  -7.077
  418   2HD2  LEU  58          HD23      LEU  58  72.351  -5.109  -6.110
  419   3HD2  LEU  58          HD22      LEU  58  73.014  -3.476  -6.195
  420    H    ASP  59           HN       ASP  59  78.049  -3.062  -5.292
  421    HA   ASP  59           HA       ASP  59  78.600  -2.082  -2.724
  422   1HB   ASP  59           HB2      ASP  59  80.328  -3.164  -4.047
  423   2HB   ASP  59           HB1      ASP  59  80.277  -1.867  -5.243
  424    H    ALA  60           HN       ALA  60  78.557  -0.220  -5.782
  425    HA   ALA  60           HA       ALA  60  79.159   2.308  -4.634
  426   1HB   ALA  60           HB1      ALA  60  78.593   1.370  -7.179
  427   2HB   ALA  60           HB3      ALA  60  77.224   2.427  -6.833
  428   3HB   ALA  60           HB2      ALA  60  78.868   3.059  -6.751
  429    H    ILE  61           HN       ILE  61  76.123   0.533  -4.895
  430    HA   ILE  61           HA       ILE  61  74.385   2.684  -4.136
  431    HB   ILE  61           HB       ILE  61  74.195  -0.320  -4.078
  432   1HG1  ILE  61          HG12      ILE  61  72.641   1.886  -5.467
  433   2HG1  ILE  61          HG11      ILE  61  73.874   0.866  -6.206
  434   1HG2  ILE  61          HG22      ILE  61  72.471   1.643  -2.632
  435   2HG2  ILE  61          HG21      ILE  61  71.668   0.324  -3.481
  436   3HG2  ILE  61          HG23      ILE  61  72.853  -0.030  -2.223
  437   1HD1  ILE  61          HD12      ILE  61  72.358  -1.105  -5.358
  438   2HD1  ILE  61          HD11      ILE  61  71.103   0.132  -5.313
  439   3HD1  ILE  61          HD13      ILE  61  71.917  -0.242  -6.832
  440    H    ILE  62           HN       ILE  62  76.093   0.201  -2.240
  441    HA   ILE  62           HA       ILE  62  75.023   0.946   0.304
  442    HB   ILE  62           HB       ILE  62  77.745  -0.241  -0.320
  443   1HG1  ILE  62          HG12      ILE  62  75.180  -1.689   0.394
  444   2HG1  ILE  62          HG11      ILE  62  75.701  -1.438  -1.272
  445   1HG2  ILE  62          HG22      ILE  62  77.413   0.654   2.000
  446   2HG2  ILE  62          HG21      ILE  62  76.033  -0.429   2.177
  447   3HG2  ILE  62          HG23      ILE  62  77.652  -1.094   1.955
  448   1HD1  ILE  62          HD13      ILE  62  77.408  -2.776   0.842
  449   2HD1  ILE  62          HD12      ILE  62  76.409  -3.655  -0.314
  450   3HD1  ILE  62          HD11      ILE  62  77.752  -2.665  -0.883
  451    H    GLU  63           HN       GLU  63  78.045   1.929  -1.338
  452    HA   GLU  63           HA       GLU  63  78.874   3.728   0.744
  453   1HB   GLU  63           HB2      GLU  63  79.907   2.819  -1.722
  454   2HB   GLU  63           HB1      GLU  63  79.799   4.575  -1.858
  455   1HG   GLU  63           HG2      GLU  63  80.845   3.570   0.723
  456   2HG   GLU  63           HG1      GLU  63  81.883   3.285  -0.674
  457    H    GLU  64           HN       GLU  64  76.351   3.948  -1.523
  458    HA   GLU  64           HA       GLU  64  76.383   6.929  -1.419
  459   1HB   GLU  64           HB2      GLU  64  75.282   4.915  -3.308
  460   2HB   GLU  64           HB1      GLU  64  74.321   6.375  -3.070
  461   1HG   GLU  64           HG2      GLU  64  75.718   7.505  -4.419
  462   2HG   GLU  64           HG1      GLU  64  77.045   7.176  -3.304
  463    H    VAL  65           HN       VAL  65  74.843   4.178  -0.075
  464    HA   VAL  65           HA       VAL  65  72.424   5.724   0.679
  465    HB   VAL  65           HB       VAL  65  73.148   2.832   1.243
  466   1HG1  VAL  65          HG12      VAL  65  71.119   4.540   2.290
  467   2HG1  VAL  65          HG11      VAL  65  70.339   3.392   1.199
  468   3HG1  VAL  65          HG13      VAL  65  71.318   2.806   2.547
  469   1HG2  VAL  65          HG21      VAL  65  72.690   3.829  -1.213
  470   2HG2  VAL  65          HG23      VAL  65  72.110   2.239  -0.723
  471   3HG2  VAL  65          HG22      VAL  65  71.020   3.624  -0.686
  472    H    ASP  66           HN       ASP  66  75.426   4.537   2.005
  473    HA   ASP  66           HA       ASP  66  74.571   5.022   4.782
  474   1HB   ASP  66           HB2      ASP  66  76.681   3.567   3.484
  475   2HB   ASP  66           HB1      ASP  66  77.394   4.719   4.613
  476    H    GLU  67           HN       GLU  67  74.104   7.368   3.830
  477    HA   GLU  67           HA       GLU  67  76.342   9.132   3.433
  478   1HB   GLU  67           HB2      GLU  67  74.648  10.939   3.900
  479   2HB   GLU  67           HB1      GLU  67  74.145   9.796   2.652
  480   1HG   GLU  67           HG2      GLU  67  72.363   9.148   3.866
  481   2HG   GLU  67           HG1      GLU  67  73.373   8.849   5.283
  482    H    ASP  68           HN       ASP  68  74.872   7.772   6.256
  483    HA   ASP  68           HA       ASP  68  75.989   9.815   8.061
  484   1HB   ASP  68           HB2      ASP  68  75.042   8.397   9.853
  485   2HB   ASP  68           HB1      ASP  68  73.834   8.751   8.618
  486    H    GLY  69           HN       GLY  69  77.031   6.928   6.556
  487   1HA   GLY  69           HA2      GLY  69  79.031   5.717   6.762
  488   2HA   GLY  69           HA1      GLY  69  79.651   7.079   7.697
  489    H    SER  70           HN       SER  70  76.764   5.295   8.619
  490    HA   SER  70           HA       SER  70  77.918   4.741  11.241
  491   1HB   SER  70           HB2      SER  70  75.684   3.478  11.514
  492   2HB   SER  70           HB1      SER  70  75.600   5.222  11.274
  493    HG   SER  70           HG       SER  70  74.812   3.148   9.635
  494    H    GLY  71           HN       GLY  71  77.278   2.928   8.287
  495   1HA   GLY  71           HA2      GLY  71  78.610   0.972   7.717
  496   2HA   GLY  71           HA1      GLY  71  78.841   0.672   9.440
  497    H    THR  72           HN       THR  72  75.650   1.565   8.746
  498    HA   THR  72           HA       THR  72  74.758  -1.213   8.241
  499    HB   THR  72           HB       THR  72  73.024  -0.500  10.240
  500    HG1  THR  72           HG1      THR  72  74.395   1.302  10.706
  501   1HG2  THR  72          HG21      THR  72  75.481  -2.184  10.066
  502   2HG2  THR  72          HG23      THR  72  74.774  -1.935  11.662
  503   3HG2  THR  72          HG22      THR  72  73.812  -2.661  10.374
  504    H    ILE  73           HN       ILE  73  72.408  -1.275   7.725
  505    HA   ILE  73           HA       ILE  73  71.515   1.346   6.593
  506    HB   ILE  73           HB       ILE  73  70.896  -1.495   5.743
  507   1HG1  ILE  73          HG12      ILE  73  73.138  -0.354   5.148
  508   2HG1  ILE  73          HG11      ILE  73  72.199  -1.028   3.816
  509   1HG2  ILE  73          HG21      ILE  73  69.573   1.098   5.168
  510   2HG2  ILE  73          HG23      ILE  73  69.877   0.060   3.775
  511   3HG2  ILE  73          HG22      ILE  73  68.914  -0.537   5.126
  512   1HD1  ILE  73          HD13      ILE  73  71.577   1.783   4.529
  513   2HD1  ILE  73          HD12      ILE  73  73.168   1.508   3.818
  514   3HD1  ILE  73          HD11      ILE  73  71.715   1.028   2.940
  515    H    ASP  74           HN       ASP  74  69.418   2.045   7.036
  516    HA   ASP  74           HA       ASP  74  67.909   0.420   9.045
  517   1HB   ASP  74           HB2      ASP  74  68.009   3.436   8.715
  518   2HB   ASP  74           HB1      ASP  74  67.026   2.573   9.899
  519    H    PHE  75           HN       PHE  75  65.550   0.551   8.860
  520    HA   PHE  75           HA       PHE  75  64.464   0.081   6.374
  521   1HB   PHE  75           HB2      PHE  75  63.309  -0.043   8.656
  522   2HB   PHE  75           HB1      PHE  75  62.950   1.673   8.449
  523    HD1  PHE  75           HD2      PHE  75  63.067  -1.104   5.953
  524    HD2  PHE  75           HD1      PHE  75  60.655   1.824   7.962
  525    HE1  PHE  75           HE2      PHE  75  61.147  -1.682   4.489
  526    HE2  PHE  75           HE1      PHE  75  58.736   1.251   6.501
  527    HZ   PHE  75           HZ       PHE  75  58.981  -0.503   4.764
  528    H    GLU  76           HN       GLU  76  65.206   3.232   7.763
  529    HA   GLU  76           HA       GLU  76  63.762   4.753   5.763
  530   1HB   GLU  76           HB2      GLU  76  66.043   5.532   7.603
  531   2HB   GLU  76           HB1      GLU  76  65.122   6.666   6.614
  532   1HG   GLU  76           HG2      GLU  76  63.050   5.530   7.796
  533   2HG   GLU  76           HG1      GLU  76  64.246   5.109   9.021
  534    H    GLU  77           HN       GLU  77  67.190   3.838   6.160
  535    HA   GLU  77           HA       GLU  77  68.045   5.139   3.731
  536   1HB   GLU  77           HB2      GLU  77  69.281   2.933   5.400
  537   2HB   GLU  77           HB1      GLU  77  70.082   3.665   4.008
  538   1HG   GLU  77           HG2      GLU  77  70.020   5.856   5.055
  539   2HG   GLU  77           HG1      GLU  77  69.064   5.229   6.398
  540    H    PHE  78           HN       PHE  78  66.452   2.126   4.363
  541    HA   PHE  78           HA       PHE  78  67.345   0.711   2.023
  542   1HB   PHE  78           HB2      PHE  78  66.356  -0.777   3.472
  543   2HB   PHE  78           HB1      PHE  78  65.195   0.408   4.063
  544    HD1  PHE  78           HD2      PHE  78  63.217   1.014   2.648
  545    HD2  PHE  78           HD1      PHE  78  65.796  -2.284   1.704
  546    HE1  PHE  78           HE2      PHE  78  61.470   0.075   1.151
  547    HE2  PHE  78           HE1      PHE  78  64.056  -3.223   0.207
  548    HZ   PHE  78           HZ       PHE  78  61.891  -2.043  -0.069
  549    H    LEU  79           HN       LEU  79  64.442   2.681   2.710
  550    HA   LEU  79           HA       LEU  79  63.189   2.466   0.200
  551   1HB   LEU  79           HB2      LEU  79  63.354   4.939   1.954
  552   2HB   LEU  79           HB1      LEU  79  62.137   4.626   0.715
  553    HG   LEU  79           HG       LEU  79  62.604   2.795   3.082
  554   1HD1  LEU  79          HD12      LEU  79  60.776   5.169   2.727
  555   2HD1  LEU  79          HD11      LEU  79  60.357   3.850   3.823
  556   3HD1  LEU  79          HD13      LEU  79  61.829   4.785   4.090
  557   1HD2  LEU  79          HD23      LEU  79  61.497   1.935   0.951
  558   2HD2  LEU  79          HD22      LEU  79  60.529   1.785   2.418
  559   3HD2  LEU  79          HD21      LEU  79  60.194   3.081   1.269
  560    H    VAL  80           HN       VAL  80  65.996   4.348   1.170
  561    HA   VAL  80           HA       VAL  80  66.099   5.997  -1.203
  562    HB   VAL  80           HB       VAL  80  68.163   5.211   0.867
  563   1HG1  VAL  80          HG12      VAL  80  68.536   6.383  -1.785
  564   2HG1  VAL  80          HG11      VAL  80  69.127   7.437  -0.500
  565   3HG1  VAL  80          HG13      VAL  80  69.742   5.790  -0.643
  566   1HG2  VAL  80          HG23      VAL  80  66.284   6.782   1.467
  567   2HG2  VAL  80          HG22      VAL  80  67.889   7.502   1.609
  568   3HG2  VAL  80          HG21      VAL  80  66.873   7.878   0.216
  569    H    MET  81           HN       MET  81  67.443   2.848  -0.307
  570    HA   MET  81           HA       MET  81  69.176   2.510  -2.540
  571   1HB   MET  81           HB2      MET  81  67.629   0.483  -0.902
  572   2HB   MET  81           HB1      MET  81  68.849   0.047  -2.100
  573   1HG   MET  81           HG2      MET  81  70.075   2.016  -0.533
  574   2HG   MET  81           HG1      MET  81  69.212   1.002   0.623
  575   1HE   MET  81           HE1      MET  81  71.693   1.370   1.054
  576   2HE   MET  81           HE3      MET  81  72.093  -0.284   1.539
  577   3HE   MET  81           HE2      MET  81  73.027   0.518   0.280
  578    H    MET  82           HN       MET  82  65.701   1.932  -2.153
  579    HA   MET  82           HA       MET  82  65.322   0.594  -4.669
  580   1HB   MET  82           HB2      MET  82  63.245   2.313  -3.307
  581   2HB   MET  82           HB1      MET  82  62.995   0.864  -4.283
  582   1HG   MET  82           HG2      MET  82  64.755   0.296  -2.052
  583   2HG   MET  82           HG1      MET  82  63.233   0.984  -1.484
  584   1HE   MET  82           HE3      MET  82  65.141  -1.697  -3.176
  585   2HE   MET  82           HE2      MET  82  63.990  -2.895  -3.759
  586   3HE   MET  82           HE1      MET  82  64.167  -1.367  -4.615
  587    H    VAL  83           HN       VAL  83  64.331   3.930  -3.795
  588    HA   VAL  83           HA       VAL  83  64.001   4.751  -6.521
  589    HB   VAL  83           HB       VAL  83  64.718   6.688  -4.333
  590   1HG1  VAL  83          HG12      VAL  83  63.665   6.834  -6.963
  591   2HG1  VAL  83          HG11      VAL  83  62.347   7.255  -5.868
  592   3HG1  VAL  83          HG13      VAL  83  63.863   8.155  -5.810
  593   1HG2  VAL  83          HG22      VAL  83  62.475   4.755  -4.381
  594   2HG2  VAL  83          HG21      VAL  83  63.176   5.630  -3.021
  595   3HG2  VAL  83          HG23      VAL  83  62.011   6.429  -4.076
  596    H    ARG  84           HN       ARG  84  66.809   4.122  -4.735
  597    HA   ARG  84           HA       ARG  84  68.570   6.125  -5.803
  598   1HB   ARG  84           HB2      ARG  84  69.316   4.900  -3.889
  599   2HB   ARG  84           HB1      ARG  84  69.037   3.351  -4.687
  600   1HG   ARG  84           HG2      ARG  84  71.103   3.384  -5.569
  601   2HG   ARG  84           HG1      ARG  84  70.803   4.962  -6.297
  602   1HD   ARG  84           HD2      ARG  84  71.117   5.608  -3.640
  603   2HD   ARG  84           HD1      ARG  84  72.267   4.286  -3.838
  604    HE   ARG  84           HE       ARG  84  73.610   5.812  -5.012
  605   1HH1  ARG  84          HH21      ARG  84  72.804   6.315  -7.495
  606   2HH1  ARG  84          HH22      ARG  84  71.977   7.836  -7.523
  607   1HH2  ARG  84          HH11      ARG  84  71.446   7.911  -4.098
  608   2HH2  ARG  84          HH12      ARG  84  71.207   8.740  -5.600
  609    H    GLN  85           HN       GLN  85  67.502   2.959  -6.961
  610    HA   GLN  85           HA       GLN  85  68.610   3.649  -9.626
  611   1HB   GLN  85           HB2      GLN  85  69.509   1.314  -9.851
  612   2HB   GLN  85           HB1      GLN  85  70.363   2.281  -8.648
  613   1HG   GLN  85           HG2      GLN  85  70.002   0.415  -7.359
  614   2HG   GLN  85           HG1      GLN  85  68.463   1.223  -7.063
  615   1HE2  GLN  85          HE22      GLN  85  66.559  -1.177  -8.838
  616   2HE2  GLN  85          HE21      GLN  85  66.548   0.305  -8.010
  617    H    MET  86           HN       MET  86  65.917   3.285  -8.202
  618    HA   MET  86           HA       MET  86  64.620   0.948  -9.165
  619   1HB   MET  86           HB2      MET  86  63.861   3.405  -7.897
  620   2HB   MET  86           HB1      MET  86  62.772   3.116  -9.252
  621   1HG   MET  86           HG2      MET  86  63.432   0.807  -7.473
  622   2HG   MET  86           HG1      MET  86  62.315   2.028  -6.864
  623   1HE   MET  86           HE3      MET  86  60.704   3.158  -8.793
  624   2HE   MET  86           HE2      MET  86  59.389   2.070  -9.230
  625   3HE   MET  86           HE1      MET  86  59.862   2.237  -7.541
  626    H    LYS  87           HN       LYS  87  65.345   4.022 -10.742
  627    HA   LYS  87           HA       LYS  87  63.908   3.102 -13.176
  628   1HB   LYS  87           HB2      LYS  87  64.721   5.489 -13.957
  629   2HB   LYS  87           HB1      LYS  87  63.344   5.337 -12.865
  630   1HG   LYS  87           HG2      LYS  87  66.057   5.501 -11.634
  631   2HG   LYS  87           HG1      LYS  87  65.390   6.978 -12.328
  632   1HD   LYS  87           HD2      LYS  87  63.242   5.911 -10.934
  633   2HD   LYS  87           HD1      LYS  87  64.618   5.564  -9.887
  634   1HE   LYS  87           HE2      LYS  87  63.949   8.284 -11.052
  635   2HE   LYS  87           HE1      LYS  87  63.645   7.784  -9.387
  636   1HZ   LYS  87           HZ2      LYS  87  66.313   7.211 -10.023
  637   2HZ   LYS  87           HZ1      LYS  87  66.001   8.819 -10.472
  638   3HZ   LYS  87           HZ3      LYS  87  65.717   8.316  -8.878
  639    H    GLU  88           HN       GLU  88  66.683   5.201 -13.461
  640    HA   GLU  88           HA       GLU  88  68.249   2.919 -14.586
  641   1HB   GLU  88           HB2      GLU  88  67.732   5.644 -15.788
  642   2HB   GLU  88           HB1      GLU  88  69.090   4.638 -16.293
  643   1HG   GLU  88           HG2      GLU  88  66.331   3.454 -16.202
  644   2HG   GLU  88           HG1      GLU  88  66.799   4.459 -17.575
  645    H    ASP  89           HN       ASP  89  68.644   6.411 -13.854
  646    HA   ASP  89           HA       ASP  89  70.707   5.836 -11.875
  647   1HB   ASP  89           HB2      ASP  89  71.755   5.655 -14.281
  648   2HB   ASP  89           HB1      ASP  89  71.677   7.417 -14.239
  649    H    ALA  90           HN       ALA  90  70.430   7.410 -10.377
  650    HA   ALA  90           HA       ALA  90  70.272  10.216 -11.102
  651   1HB   ALA  90           HB3      ALA  90  67.903   9.217 -11.505
  652   2HB   ALA  90           HB2      ALA  90  67.800   9.151  -9.744
  653   3HB   ALA  90           HB1      ALA  90  68.031  10.699 -10.557
   
  No H/Q in entry =         653
  Start of MODEL   13
    1   1H    ALA   1           HT3      ALA   1  67.191  11.588  12.325
    2   2H    ALA   1           HT2      ALA   1  68.314  11.886  13.565
    3   3H    ALA   1           HT1      ALA   1  66.972  10.883  13.852
    4    HA   ALA   1           HA       ALA   1  65.507  12.605  14.014
    5   1HB   ALA   1           HB3      ALA   1  67.206  12.793  15.811
    6   2HB   ALA   1           HB2      ALA   1  68.159  13.865  14.783
    7   3HB   ALA   1           HB1      ALA   1  66.571  14.374  15.355
    8    H    SER   2           HN       SER   2  68.221  13.314  11.925
    9    HA   SER   2           HA       SER   2  66.702  15.640  10.816
   10   1HB   SER   2           HB2      SER   2  69.063  16.061   9.727
   11   2HB   SER   2           HB1      SER   2  68.779  16.524  11.402
   12    HG   SER   2           HG       SER   2  70.282  14.436  10.332
   13    H    MET   3           HN       MET   3  65.388  14.410   9.390
   14    HA   MET   3           HA       MET   3  66.143  12.288   7.734
   15   1HB   MET   3           HB2      MET   3  64.312  12.936   6.263
   16   2HB   MET   3           HB1      MET   3  63.823  13.217   7.936
   17   1HG   MET   3           HG2      MET   3  64.947  15.616   7.381
   18   2HG   MET   3           HG1      MET   3  64.375  15.174   5.772
   19   1HE   MET   3           HE2      MET   3  63.740  15.778   9.368
   20   2HE   MET   3           HE1      MET   3  61.997  15.877   9.600
   21   3HE   MET   3           HE3      MET   3  62.777  14.302   9.400
   22    H    THR   4           HN       THR   4  67.878  12.199   6.394
   23    HA   THR   4           HA       THR   4  69.246  14.513   5.393
   24    HB   THR   4           HB       THR   4  70.357  12.810   3.854
   25    HG1  THR   4           HG1      THR   4  69.768  10.716   4.084
   26   1HG2  THR   4          HG21      THR   4  70.755  13.359   6.487
   27   2HG2  THR   4          HG23      THR   4  70.475  11.620   6.559
   28   3HG2  THR   4          HG22      THR   4  71.773  12.262   5.553
   29    H    ASP   5           HN       ASP   5  69.579  14.766   2.905
   30    HA   ASP   5           HA       ASP   5  67.019  15.412   1.744
   31   1HB   ASP   5           HB2      ASP   5  68.488  15.726  -0.369
   32   2HB   ASP   5           HB1      ASP   5  68.805  16.771   1.016
   33    H    GLN   6           HN       GLN   6  69.375  12.803   1.163
   34    HA   GLN   6           HA       GLN   6  68.106  11.595  -1.057
   35   1HB   GLN   6           HB2      GLN   6  69.891  10.625   1.138
   36   2HB   GLN   6           HB1      GLN   6  69.076   9.416   0.145
   37   1HG   GLN   6           HG2      GLN   6  70.200  11.574  -1.467
   38   2HG   GLN   6           HG1      GLN   6  71.434  10.750  -0.511
   39   1HE2  GLN   6          HE22      GLN   6  71.463   7.977  -2.663
   40   2HE2  GLN   6          HE21      GLN   6  72.282   8.935  -1.526
   41    H    GLN   7           HN       GLN   7  67.367  11.413   2.390
   42    HA   GLN   7           HA       GLN   7  65.364   9.316   2.047
   43   1HB   GLN   7           HB2      GLN   7  65.905  11.216   4.352
   44   2HB   GLN   7           HB1      GLN   7  64.785   9.855   4.411
   45   1HG   GLN   7           HG2      GLN   7  66.634   8.301   3.915
   46   2HG   GLN   7           HG1      GLN   7  67.759   9.659   3.844
   47   1HE2  GLN   7          HE22      GLN   7  67.879   8.211   7.301
   48   2HE2  GLN   7          HE21      GLN   7  68.175   7.596   5.746
   49    H    ALA   8           HN       ALA   8  65.442  12.804   1.903
   50    HA   ALA   8           HA       ALA   8  62.599  13.212   2.268
   51   1HB   ALA   8           HB3      ALA   8  64.942  14.830   1.659
   52   2HB   ALA   8           HB2      ALA   8  63.555  15.312   0.682
   53   3HB   ALA   8           HB1      ALA   8  63.434  15.301   2.441
   54    H    GLU   9           HN       GLU   9  64.628  12.340  -0.446
   55    HA   GLU   9           HA       GLU   9  62.509  12.892  -2.411
   56   1HB   GLU   9           HB2      GLU   9  64.120  11.909  -4.032
   57   2HB   GLU   9           HB1      GLU   9  64.847  13.202  -3.077
   58   1HG   GLU   9           HG2      GLU   9  66.008  11.654  -1.681
   59   2HG   GLU   9           HG1      GLU   9  65.060  10.293  -2.281
   60    H    ALA  10           HN       ALA  10  63.872  10.120  -0.701
   61    HA   ALA  10           HA       ALA  10  62.506   8.111  -2.258
   62   1HB   ALA  10           HB3      ALA  10  64.493   7.746  -0.701
   63   2HB   ALA  10           HB2      ALA  10  63.351   7.859   0.638
   64   3HB   ALA  10           HB1      ALA  10  63.188   6.569  -0.554
   65    H    ARG  11           HN       ARG  11  61.804   9.463   0.989
   66    HA   ARG  11           HA       ARG  11  59.239   8.158   1.183
   67   1HB   ARG  11           HB2      ARG  11  60.882   9.829   2.828
   68   2HB   ARG  11           HB1      ARG  11  59.264  10.528   2.770
   69   1HG   ARG  11           HG2      ARG  11  58.404   8.868   4.034
   70   2HG   ARG  11           HG1      ARG  11  59.173   7.628   3.043
   71   1HD   ARG  11           HD2      ARG  11  60.466   7.251   4.870
   72   2HD   ARG  11           HD1      ARG  11  61.327   8.705   4.367
   73    HE   ARG  11           HE       ARG  11  59.059   8.810   6.316
   74   1HH1  ARG  11          HH21      ARG  11  60.472  11.277   5.138
   75   2HH1  ARG  11          HH22      ARG  11  61.542  11.683   6.439
   76   1HH2  ARG  11          HH11      ARG  11  61.186   8.625   8.035
   77   2HH2  ARG  11          HH12      ARG  11  61.945  10.181   8.079
   78    H    ALA  12           HN       ALA  12  60.318  11.150  -0.263
   79    HA   ALA  12           HA       ALA  12  57.680  12.364  -0.390
   80   1HB   ALA  12           HB1      ALA  12  60.318  12.930  -1.745
   81   2HB   ALA  12           HB3      ALA  12  58.855  13.828  -2.154
   82   3HB   ALA  12           HB2      ALA  12  59.495  13.885  -0.512
   83    H    PHE  13           HN       PHE  13  59.624  10.334  -2.545
   84    HA   PHE  13           HA       PHE  13  57.599  10.539  -4.679
   85   1HB   PHE  13           HB2      PHE  13  60.001  10.438  -5.265
   86   2HB   PHE  13           HB1      PHE  13  60.116   8.853  -4.501
   87    HD1  PHE  13           HD2      PHE  13  59.067   6.885  -5.504
   88    HD2  PHE  13           HD1      PHE  13  58.797  10.744  -7.371
   89    HE1  PHE  13           HE2      PHE  13  58.279   5.815  -7.598
   90    HE2  PHE  13           HE1      PHE  13  58.009   9.674  -9.466
   91    HZ   PHE  13           HZ       PHE  13  57.750   7.209  -9.580
   92    H    LEU  14           HN       LEU  14  58.300   8.539  -1.967
   93    HA   LEU  14           HA       LEU  14  56.778   6.249  -3.068
   94   1HB   LEU  14           HB2      LEU  14  58.206   6.665  -0.425
   95   2HB   LEU  14           HB1      LEU  14  57.349   5.187  -0.865
   96    HG   LEU  14           HG       LEU  14  59.645   6.397  -2.433
   97   1HD1  LEU  14          HD11      LEU  14  59.503   4.029  -0.545
   98   2HD1  LEU  14          HD13      LEU  14  60.862   4.351  -1.622
   99   3HD1  LEU  14          HD12      LEU  14  60.466   5.492  -0.338
  100   1HD2  LEU  14          HD21      LEU  14  57.762   4.119  -2.853
  101   2HD2  LEU  14          HD23      LEU  14  58.523   5.180  -4.038
  102   3HD2  LEU  14          HD22      LEU  14  59.448   3.868  -3.307
  103    H    SER  15           HN       SER  15  54.825   5.506  -2.088
  104    HA   SER  15           HA       SER  15  53.351   7.652  -0.637
  105   1HB   SER  15           HB2      SER  15  51.851   5.288  -1.561
  106   2HB   SER  15           HB1      SER  15  51.484   7.000  -1.760
  107    HG   SER  15           HG       SER  15  52.028   5.884  -3.734
  108    H    GLU  16           HN       GLU  16  51.623   6.643   0.927
  109    HA   GLU  16           HA       GLU  16  53.001   5.339   3.046
  110   1HB   GLU  16           HB2      GLU  16  50.541   6.557   2.754
  111   2HB   GLU  16           HB1      GLU  16  50.101   4.867   2.995
  112   1HG   GLU  16           HG2      GLU  16  52.013   5.119   4.897
  113   2HG   GLU  16           HG1      GLU  16  51.394   6.770   4.871
  114    H    GLU  17           HN       GLU  17  50.793   4.033   0.568
  115    HA   GLU  17           HA       GLU  17  50.905   1.327   1.556
  116   1HB   GLU  17           HB2      GLU  17  50.099   2.566  -1.074
  117   2HB   GLU  17           HB1      GLU  17  50.128   0.815  -0.858
  118   1HG   GLU  17           HG2      GLU  17  48.822   1.858   1.420
  119   2HG   GLU  17           HG1      GLU  17  48.142   2.712   0.034
  120    H    MET  18           HN       MET  18  52.812   3.151  -0.811
  121    HA   MET  18           HA       MET  18  54.285   0.892  -1.814
  122   1HB   MET  18           HB2      MET  18  54.108   3.506  -2.541
  123   2HB   MET  18           HB1      MET  18  55.663   3.515  -1.711
  124   1HG   MET  18           HG2      MET  18  56.139   2.993  -3.998
  125   2HG   MET  18           HG1      MET  18  56.281   1.476  -3.109
  126   1HE   MET  18           HE1      MET  18  54.570   3.731  -5.353
  127   2HE   MET  18           HE3      MET  18  55.100   2.513  -6.523
  128   3HE   MET  18           HE2      MET  18  53.381   2.809  -6.271
  129    H    ILE  19           HN       ILE  19  54.600   2.909   1.029
  130    HA   ILE  19           HA       ILE  19  57.288   1.888   1.645
  131    HB   ILE  19           HB       ILE  19  55.351   3.676   3.132
  132   1HG1  ILE  19          HG12      ILE  19  58.040   4.652   2.570
  133   2HG1  ILE  19          HG11      ILE  19  57.212   4.148   1.095
  134   1HG2  ILE  19          HG21      ILE  19  57.808   2.263   4.042
  135   2HG2  ILE  19          HG23      ILE  19  57.661   3.961   4.495
  136   3HG2  ILE  19          HG22      ILE  19  56.414   2.810   4.974
  137   1HD1  ILE  19          HD11      ILE  19  55.340   5.570   2.727
  138   2HD1  ILE  19          HD13      ILE  19  56.810   6.536   2.603
  139   3HD1  ILE  19          HD12      ILE  19  55.968   6.021   1.142
  140    H    ALA  20           HN       ALA  20  53.956   1.180   2.451
  141    HA   ALA  20           HA       ALA  20  54.483  -0.409   4.794
  142   1HB   ALA  20           HB1      ALA  20  52.226   0.523   4.044
  143   2HB   ALA  20           HB3      ALA  20  52.180  -0.791   2.869
  144   3HB   ALA  20           HB2      ALA  20  52.217  -1.151   4.595
  145    H    GLU  21           HN       GLU  21  54.666  -1.028   1.357
  146    HA   GLU  21           HA       GLU  21  54.685  -3.926   1.601
  147   1HB   GLU  21           HB2      GLU  21  55.074  -1.929  -0.556
  148   2HB   GLU  21           HB1      GLU  21  55.928  -3.457  -0.773
  149   1HG   GLU  21           HG2      GLU  21  53.998  -4.378  -1.472
  150   2HG   GLU  21           HG1      GLU  21  53.347  -4.136   0.151
  151    H    PHE  22           HN       PHE  22  57.289  -1.646   0.651
  152    HA   PHE  22           HA       PHE  22  59.436  -3.440   0.891
  153   1HB   PHE  22           HB2      PHE  22  59.551  -0.525   1.711
  154   2HB   PHE  22           HB1      PHE  22  60.872  -1.515   1.089
  155    HD1  PHE  22           HD1      PHE  22  58.832  -2.936  -0.938
  156    HD2  PHE  22           HD2      PHE  22  59.954   1.129  -0.115
  157    HE1  PHE  22           HE1      PHE  22  58.221  -2.297  -3.254
  158    HE2  PHE  22           HE2      PHE  22  59.343   1.767  -2.432
  159    HZ   PHE  22           HZ       PHE  22  58.477   0.053  -4.002
  160    H    LYS  23           HN       LYS  23  57.703  -1.683   3.412
  161    HA   LYS  23           HA       LYS  23  59.476  -2.016   5.573
  162   1HB   LYS  23           HB2      LYS  23  57.046  -0.936   5.386
  163   2HB   LYS  23           HB1      LYS  23  56.562  -2.503   6.036
  164   1HG   LYS  23           HG2      LYS  23  58.861  -1.098   7.333
  165   2HG   LYS  23           HG1      LYS  23  57.234  -0.493   7.651
  166   1HD   LYS  23           HD2      LYS  23  56.528  -2.544   8.591
  167   2HD   LYS  23           HD1      LYS  23  57.885  -3.430   7.895
  168   1HE   LYS  23           HE2      LYS  23  59.230  -1.600   9.377
  169   2HE   LYS  23           HE1      LYS  23  57.771  -1.772  10.352
  170   1HZ   LYS  23           HZ2      LYS  23  59.208  -4.144   9.345
  171   2HZ   LYS  23           HZ1      LYS  23  59.705  -3.369  10.774
  172   3HZ   LYS  23           HZ3      LYS  23  58.143  -4.022  10.663
  173    H    ALA  24           HN       ALA  24  56.949  -4.274   4.440
  174    HA   ALA  24           HA       ALA  24  57.344  -6.325   6.314
  175   1HB   ALA  24           HB3      ALA  24  55.628  -6.202   4.414
  176   2HB   ALA  24           HB2      ALA  24  56.896  -6.848   3.372
  177   3HB   ALA  24           HB1      ALA  24  56.314  -7.792   4.744
  178    H    ALA  25           HN       ALA  25  59.281  -5.476   3.489
  179    HA   ALA  25           HA       ALA  25  60.921  -7.857   3.551
  180   1HB   ALA  25           HB3      ALA  25  60.586  -6.014   1.675
  181   2HB   ALA  25           HB2      ALA  25  61.956  -5.254   2.486
  182   3HB   ALA  25           HB1      ALA  25  62.117  -6.878   1.817
  183    H    PHE  26           HN       PHE  26  61.199  -4.619   4.983
  184    HA   PHE  26           HA       PHE  26  63.838  -4.725   5.928
  185   1HB   PHE  26           HB2      PHE  26  62.094  -2.842   6.193
  186   2HB   PHE  26           HB1      PHE  26  61.562  -3.708   7.635
  187    HD1  PHE  26           HD1      PHE  26  64.858  -2.818   6.062
  188    HD2  PHE  26           HD2      PHE  26  62.455  -2.897   9.620
  189    HE1  PHE  26           HE1      PHE  26  66.732  -1.827   7.348
  190    HE2  PHE  26           HE2      PHE  26  64.328  -1.906  10.908
  191    HZ   PHE  26           HZ       PHE  26  66.467  -1.370   9.772
  192    H    ASP  27           HN       ASP  27  61.010  -5.556   7.956
  193    HA   ASP  27           HA       ASP  27  62.472  -6.907   9.964
  194   1HB   ASP  27           HB2      ASP  27  60.128  -6.235  10.250
  195   2HB   ASP  27           HB1      ASP  27  59.632  -7.414   9.035
  196    H    MET  28           HN       MET  28  61.782  -7.933   6.741
  197    HA   MET  28           HA       MET  28  61.805 -10.775   7.251
  198   1HB   MET  28           HB2      MET  28  60.895 -10.440   5.180
  199   2HB   MET  28           HB1      MET  28  61.851  -8.997   4.875
  200   1HG   MET  28           HG2      MET  28  62.559 -10.720   3.329
  201   2HG   MET  28           HG1      MET  28  63.846 -10.471   4.507
  202   1HE   MET  28           HE3      MET  28  65.003 -11.900   5.273
  203   2HE   MET  28           HE2      MET  28  64.684 -13.524   5.879
  204   3HE   MET  28           HE1      MET  28  64.934 -13.269   4.153
  205    H    PHE  29           HN       PHE  29  64.347  -8.533   6.030
  206    HA   PHE  29           HA       PHE  29  66.335 -10.680   6.454
  207   1HB   PHE  29           HB2      PHE  29  67.774  -8.377   5.844
  208   2HB   PHE  29           HB1      PHE  29  67.321  -9.644   4.713
  209    HD1  PHE  29           HD2      PHE  29  65.065  -9.458   3.536
  210    HD2  PHE  29           HD1      PHE  29  66.895  -6.192   5.633
  211    HE1  PHE  29           HE2      PHE  29  63.622  -7.860   2.304
  212    HE2  PHE  29           HE1      PHE  29  65.451  -4.592   4.409
  213    HZ   PHE  29           HZ       PHE  29  63.814  -5.425   2.742
  214    H    ASP  30           HN       ASP  30  64.796  -9.058   8.603
  215    HA   ASP  30           HA       ASP  30  67.069  -7.841  10.059
  216   1HB   ASP  30           HB2      ASP  30  64.668  -6.867   9.932
  217   2HB   ASP  30           HB1      ASP  30  64.252  -8.118  11.104
  218    H    ALA  31           HN       ALA  31  68.246  -9.824  10.469
  219    HA   ALA  31           HA       ALA  31  66.975 -12.009  11.918
  220   1HB   ALA  31           HB2      ALA  31  69.415 -11.599  10.532
  221   2HB   ALA  31           HB1      ALA  31  69.841 -12.010  12.193
  222   3HB   ALA  31           HB3      ALA  31  68.826 -13.100  11.248
  223    H    ASP  32           HN       ASP  32  68.744  -9.100  12.764
  224    HA   ASP  32           HA       ASP  32  69.173  -9.936  15.538
  225   1HB   ASP  32           HB2      ASP  32  69.699  -7.476  13.919
  226   2HB   ASP  32           HB1      ASP  32  69.620  -7.313  15.673
  227    H    GLY  33           HN       GLY  33  66.594  -8.570  13.734
  228   1HA   GLY  33           HA2      GLY  33  64.502  -7.738  14.391
  229   2HA   GLY  33           HA1      GLY  33  64.754  -8.637  15.888
  230    H    GLY  34           HN       GLY  34  67.027  -6.172  14.915
  231   1HA   GLY  34           HA2      GLY  34  66.206  -4.585  17.292
  232   2HA   GLY  34           HA1      GLY  34  67.763  -4.463  16.470
  233    H    GLY  35           HN       GLY  35  65.870  -4.602  13.918
  234   1HA   GLY  35           HA2      GLY  35  64.462  -2.982  12.791
  235   2HA   GLY  35           HA1      GLY  35  64.920  -1.786  14.005
  236    H    ASP  36           HN       ASP  36  67.447  -3.757  12.719
  237    HA   ASP  36           HA       ASP  36  68.154  -1.786  10.639
  238   1HB   ASP  36           HB2      ASP  36  70.421  -1.436  11.617
  239   2HB   ASP  36           HB1      ASP  36  69.138  -0.795  12.646
  240    H    ILE  37           HN       ILE  37  69.329  -2.746   9.004
  241    HA   ILE  37           HA       ILE  37  70.220  -5.561   9.491
  242    HB   ILE  37           HB       ILE  37  68.564  -5.907   7.926
  243   1HG1  ILE  37          HG12      ILE  37  70.911  -5.016   6.219
  244   2HG1  ILE  37          HG11      ILE  37  70.563  -6.654   6.771
  245   1HG2  ILE  37          HG21      ILE  37  67.906  -3.512   7.890
  246   2HG2  ILE  37          HG23      ILE  37  69.175  -3.202   6.704
  247   3HG2  ILE  37          HG22      ILE  37  67.819  -4.251   6.291
  248   1HD1  ILE  37          HD13      ILE  37  68.633  -5.085   5.051
  249   2HD1  ILE  37          HD12      ILE  37  69.890  -6.111   4.363
  250   3HD1  ILE  37          HD11      ILE  37  68.635  -6.816   5.377
  251    H    SER  38           HN       SER  38  71.997  -6.212   7.911
  252    HA   SER  38           HA       SER  38  74.067  -4.100   7.942
  253   1HB   SER  38           HB2      SER  38  75.599  -5.810   7.920
  254   2HB   SER  38           HB1      SER  38  74.228  -6.746   8.504
  255    HG   SER  38           HG       SER  38  75.064  -7.808   6.743
  256    H    THR  39           HN       THR  39  75.125  -3.394   5.997
  257    HA   THR  39           HA       THR  39  73.394  -3.281   3.703
  258    HB   THR  39           HB       THR  39  75.054  -1.953   2.668
  259    HG1  THR  39           HG1      THR  39  77.176  -2.143   3.114
  260   1HG2  THR  39          HG22      THR  39  74.618  -1.646   5.555
  261   2HG2  THR  39          HG21      THR  39  76.077  -0.841   4.978
  262   3HG2  THR  39          HG23      THR  39  74.512  -0.448   4.267
  263    H    LYS  40           HN       LYS  40  75.766  -5.552   4.740
  264    HA   LYS  40           HA       LYS  40  76.404  -6.578   2.088
  265   1HB   LYS  40           HB2      LYS  40  76.789  -7.716   4.871
  266   2HB   LYS  40           HB1      LYS  40  77.353  -8.516   3.403
  267   1HG   LYS  40           HG2      LYS  40  78.862  -6.748   2.893
  268   2HG   LYS  40           HG1      LYS  40  78.101  -5.662   4.057
  269   1HD   LYS  40           HD2      LYS  40  78.876  -7.059   5.912
  270   2HD   LYS  40           HD1      LYS  40  79.577  -8.213   4.778
  271   1HE   LYS  40           HE2      LYS  40  80.383  -5.308   4.715
  272   2HE   LYS  40           HE1      LYS  40  81.149  -6.435   5.835
  273   1HZ   LYS  40           HZ1      LYS  40  81.020  -7.628   3.300
  274   2HZ   LYS  40           HZ3      LYS  40  81.683  -6.079   3.119
  275   3HZ   LYS  40           HZ2      LYS  40  82.398  -7.187   4.191
  276    H    ALA  41           HN       ALA  41  73.702  -6.809   4.120
  277    HA   ALA  41           HA       ALA  41  72.916  -9.498   3.194
  278   1HB   ALA  41           HB2      ALA  41  71.923  -7.538   5.202
  279   2HB   ALA  41           HB1      ALA  41  70.721  -8.604   4.475
  280   3HB   ALA  41           HB3      ALA  41  72.104  -9.287   5.331
  281    H    LEU  42           HN       LEU  42  72.891  -6.531   1.758
  282    HA   LEU  42           HA       LEU  42  70.207  -6.307   0.786
  283   1HB   LEU  42           HB2      LEU  42  72.875  -5.318  -0.197
  284   2HB   LEU  42           HB1      LEU  42  71.458  -5.156  -1.229
  285    HG   LEU  42           HG       LEU  42  71.495  -3.120  -0.059
  286   1HD1  LEU  42          HD11      LEU  42  69.308  -4.420   0.184
  287   2HD1  LEU  42          HD13      LEU  42  69.828  -4.792   1.828
  288   3HD1  LEU  42          HD12      LEU  42  69.570  -3.117   1.342
  289   1HD2  LEU  42          HD23      LEU  42  72.442  -4.804   2.242
  290   2HD2  LEU  42          HD22      LEU  42  73.192  -3.376   1.527
  291   3HD2  LEU  42          HD21      LEU  42  71.753  -3.208   2.532
  292    H    GLY  43           HN       GLY  43  73.086  -7.842  -0.677
  293   1HA   GLY  43           HA2      GLY  43  72.088  -8.754  -3.073
  294   2HA   GLY  43           HA1      GLY  43  73.149  -9.751  -2.077
  295    H    THR  44           HN       THR  44  71.253  -9.976   0.134
  296    HA   THR  44           HA       THR  44  69.709 -12.227  -0.877
  297    HB   THR  44           HB       THR  44  69.875 -10.866   1.823
  298    HG1  THR  44           HG1      THR  44  71.122 -12.554   2.304
  299   1HG2  THR  44          HG23      THR  44  67.852 -12.691   0.767
  300   2HG2  THR  44          HG22      THR  44  68.667 -13.339   2.191
  301   3HG2  THR  44          HG21      THR  44  67.858 -11.774   2.274
  302    H    VAL  45           HN       VAL  45  68.892  -8.994   0.400
  303    HA   VAL  45           HA       VAL  45  66.075  -9.214   0.228
  304    HB   VAL  45           HB       VAL  45  67.763  -6.745  -0.276
  305   1HG1  VAL  45          HG13      VAL  45  64.958  -7.189  -0.367
  306   2HG1  VAL  45          HG12      VAL  45  65.294  -6.303   1.120
  307   3HG1  VAL  45          HG11      VAL  45  65.808  -5.646  -0.432
  308   1HG2  VAL  45          HG23      VAL  45  67.171  -8.337   2.135
  309   2HG2  VAL  45          HG22      VAL  45  68.453  -7.160   1.854
  310   3HG2  VAL  45          HG21      VAL  45  66.839  -6.613   2.308
  311    H    MET  46           HN       MET  46  68.298  -7.791  -2.203
  312    HA   MET  46           HA       MET  46  66.479  -7.216  -4.218
  313   1HB   MET  46           HB2      MET  46  69.180  -8.525  -4.654
  314   2HB   MET  46           HB1      MET  46  68.300  -7.526  -5.811
  315   1HG   MET  46           HG2      MET  46  69.479  -6.650  -3.161
  316   2HG   MET  46           HG1      MET  46  69.964  -6.121  -4.774
  317   1HE   MET  46           HE3      MET  46  70.053  -4.063  -4.125
  318   2HE   MET  46           HE2      MET  46  68.968  -3.345  -5.314
  319   3HE   MET  46           HE1      MET  46  68.787  -2.941  -3.608
  320    H    ARG  47           HN       ARG  47  68.149 -10.367  -3.813
  321    HA   ARG  47           HA       ARG  47  66.856 -11.762  -5.875
  322   1HB   ARG  47           HB2      ARG  47  68.652 -12.462  -3.974
  323   2HB   ARG  47           HB1      ARG  47  67.212 -13.249  -3.330
  324   1HG   ARG  47           HG2      ARG  47  66.848 -14.250  -5.624
  325   2HG   ARG  47           HG1      ARG  47  68.436 -13.627  -6.075
  326   1HD   ARG  47           HD2      ARG  47  69.546 -15.000  -4.488
  327   2HD   ARG  47           HD1      ARG  47  68.046 -15.362  -3.634
  328    HE   ARG  47           HE       ARG  47  68.479 -16.336  -6.424
  329   1HH1  ARG  47          HH11      ARG  47  66.161 -16.690  -4.241
  330   2HH1  ARG  47          HH12      ARG  47  66.375 -18.378  -3.916
  331   1HH2  ARG  47          HH21      ARG  47  69.446 -18.569  -5.516
  332   2HH2  ARG  47          HH22      ARG  47  68.235 -19.441  -4.637
  333    H    MET  48           HN       MET  48  65.707 -11.077  -2.591
  334    HA   MET  48           HA       MET  48  63.340 -12.707  -2.767
  335   1HB   MET  48           HB2      MET  48  64.345 -10.549  -0.974
  336   2HB   MET  48           HB1      MET  48  62.606 -10.849  -0.968
  337   1HG   MET  48           HG2      MET  48  63.057 -13.267  -0.569
  338   2HG   MET  48           HG1      MET  48  64.781 -12.907  -0.481
  339   1HE   MET  48           HE2      MET  48  65.978 -12.333   1.249
  340   2HE   MET  48           HE1      MET  48  65.523 -10.633   1.334
  341   3HE   MET  48           HE3      MET  48  65.523 -11.627   2.798
  342    H    LEU  49           HN       LEU  49  63.431  -9.132  -2.660
  343    HA   LEU  49           HA       LEU  49  60.894  -8.585  -3.592
  344   1HB   LEU  49           HB2      LEU  49  63.269  -7.069  -4.682
  345   2HB   LEU  49           HB1      LEU  49  61.669  -6.449  -4.276
  346    HG   LEU  49           HG       LEU  49  63.857  -7.338  -2.391
  347   1HD1  LEU  49          HD11      LEU  49  62.553  -4.807  -3.193
  348   2HD1  LEU  49          HD13      LEU  49  62.801  -5.001  -1.457
  349   3HD1  LEU  49          HD12      LEU  49  64.175  -5.087  -2.560
  350   1HD2  LEU  49          HD21      LEU  49  60.935  -6.803  -1.759
  351   2HD2  LEU  49          HD23      LEU  49  61.746  -8.363  -1.635
  352   3HD2  LEU  49          HD22      LEU  49  62.206  -7.041  -0.561
  353    H    GLY  50           HN       GLY  50  63.560  -9.887  -5.446
  354   1HA   GLY  50           HA2      GLY  50  62.891 -11.231  -7.444
  355   2HA   GLY  50           HA1      GLY  50  61.759  -9.936  -7.836
  356    H    GLN  51           HN       GLN  51  63.278  -7.674  -7.525
  357    HA   GLN  51           HA       GLN  51  64.876  -7.681  -9.923
  358   1HB   GLN  51           HB2      GLN  51  65.455  -5.365  -9.275
  359   2HB   GLN  51           HB1      GLN  51  63.722  -5.653  -9.119
  360   1HG   GLN  51           HG2      GLN  51  63.811  -5.727  -6.781
  361   2HG   GLN  51           HG1      GLN  51  65.534  -6.106  -6.761
  362   1HE2  GLN  51          HE22      GLN  51  64.726  -2.228  -7.847
  363   2HE2  GLN  51          HE21      GLN  51  63.889  -3.498  -8.601
  364    H    ASN  52           HN       ASN  52  67.129  -7.705 -10.148
  365    HA   ASN  52           HA       ASN  52  68.816  -7.826  -7.728
  366   1HB   ASN  52           HB2      ASN  52  68.086 -10.167  -8.077
  367   2HB   ASN  52           HB1      ASN  52  68.712 -10.107  -9.725
  368   1HD2  ASN  52          HD22      ASN  52  71.315 -11.492  -7.318
  369   2HD2  ASN  52          HD21      ASN  52  69.682 -11.885  -7.564
  370    HA   PRO  53           HA       PRO  53  70.986  -5.690 -11.083
  371   1HB   PRO  53           HB2      PRO  53  72.381  -4.041  -9.381
  372   2HB   PRO  53           HB1      PRO  53  70.737  -3.699  -9.948
  373   1HG   PRO  53           HG2      PRO  53  71.641  -4.651  -7.269
  374   2HG   PRO  53           HG1      PRO  53  70.196  -3.721  -7.700
  375   1HD   PRO  53           HD2      PRO  53  70.274  -6.494  -7.143
  376   2HD   PRO  53           HD1      PRO  53  68.925  -5.619  -7.898
  377    H    THR  54           HN       THR  54  73.544  -5.116 -11.071
  378    HA   THR  54           HA       THR  54  74.885  -7.670 -10.520
  379    HB   THR  54           HB       THR  54  76.870  -6.438 -11.557
  380    HG1  THR  54           HG1      THR  54  75.975  -4.346 -11.032
  381   1HG2  THR  54          HG23      THR  54  74.261  -6.651 -13.085
  382   2HG2  THR  54          HG22      THR  54  75.848  -6.479 -13.836
  383   3HG2  THR  54          HG21      THR  54  75.471  -7.920 -12.890
  384    H    LYS  55           HN       LYS  55  76.700  -7.900  -9.116
  385    HA   LYS  55           HA       LYS  55  76.564  -6.600  -6.620
  386   1HB   LYS  55           HB2      LYS  55  78.297  -8.512  -7.911
  387   2HB   LYS  55           HB1      LYS  55  79.267  -7.354  -7.000
  388   1HG   LYS  55           HG2      LYS  55  77.518  -7.746  -5.103
  389   2HG   LYS  55           HG1      LYS  55  77.118  -9.210  -6.000
  390   1HD   LYS  55           HD2      LYS  55  79.596  -9.773  -5.971
  391   2HD   LYS  55           HD1      LYS  55  79.802  -8.443  -4.829
  392   1HE   LYS  55           HE2      LYS  55  77.946  -9.580  -3.447
  393   2HE   LYS  55           HE1      LYS  55  78.226 -10.992  -4.466
  394   1HZ   LYS  55           HZ1      LYS  55  80.721 -10.127  -3.699
  395   2HZ   LYS  55           HZ3      LYS  55  79.775 -10.010  -2.297
  396   3HZ   LYS  55           HZ2      LYS  55  79.894 -11.493  -3.119
  397    H    GLU  56           HN       GLU  56  78.073  -5.580  -9.585
  398    HA   GLU  56           HA       GLU  56  79.957  -3.713  -8.520
  399   1HB   GLU  56           HB2      GLU  56  78.415  -3.689 -11.131
  400   2HB   GLU  56           HB1      GLU  56  79.760  -2.610 -10.763
  401   1HG   GLU  56           HG2      GLU  56  81.015  -4.857 -10.186
  402   2HG   GLU  56           HG1      GLU  56  79.784  -5.574 -11.227
  403    H    GLU  57           HN       GLU  57  76.605  -3.195  -9.675
  404    HA   GLU  57           HA       GLU  57  76.555  -0.437  -8.806
  405   1HB   GLU  57           HB2      GLU  57  74.339  -2.379  -9.516
  406   2HB   GLU  57           HB1      GLU  57  74.069  -0.673  -9.159
  407   1HG   GLU  57           HG2      GLU  57  76.218  -0.920 -11.061
  408   2HG   GLU  57           HG1      GLU  57  74.811  -1.812 -11.645
  409    H    LEU  58           HN       LEU  58  75.835  -3.505  -7.274
  410    HA   LEU  58           HA       LEU  58  74.250  -2.532  -5.106
  411   1HB   LEU  58           HB2      LEU  58  74.400  -4.914  -5.534
  412   2HB   LEU  58           HB1      LEU  58  76.144  -4.892  -5.271
  413    HG   LEU  58           HG       LEU  58  75.717  -4.101  -2.926
  414   1HD1  LEU  58          HD12      LEU  58  73.165  -3.607  -3.905
  415   2HD1  LEU  58          HD11      LEU  58  72.949  -5.051  -2.916
  416   3HD1  LEU  58          HD13      LEU  58  73.634  -3.590  -2.205
  417   1HD2  LEU  58          HD21      LEU  58  76.084  -6.510  -3.508
  418   2HD2  LEU  58          HD23      LEU  58  75.059  -6.297  -2.088
  419   3HD2  LEU  58          HD22      LEU  58  74.337  -6.707  -3.645
  420    H    ASP  59           HN       ASP  59  77.761  -3.262  -5.178
  421    HA   ASP  59           HA       ASP  59  78.339  -2.203  -2.610
  422   1HB   ASP  59           HB2      ASP  59  80.104  -2.309  -5.075
  423   2HB   ASP  59           HB1      ASP  59  80.677  -2.021  -3.430
  424    H    ALA  60           HN       ALA  60  78.500  -0.610  -5.809
  425    HA   ALA  60           HA       ALA  60  79.325   1.940  -4.804
  426   1HB   ALA  60           HB1      ALA  60  78.308   0.851  -7.339
  427   2HB   ALA  60           HB3      ALA  60  77.851   2.532  -7.060
  428   3HB   ALA  60           HB2      ALA  60  79.553   2.068  -7.058
  429    H    ILE  61           HN       ILE  61  76.246   0.332  -4.848
  430    HA   ILE  61           HA       ILE  61  74.670   2.762  -4.482
  431    HB   ILE  61           HB       ILE  61  74.087  -0.195  -4.298
  432   1HG1  ILE  61          HG12      ILE  61  72.710   1.912  -5.961
  433   2HG1  ILE  61          HG11      ILE  61  74.240   1.207  -6.482
  434   1HG2  ILE  61          HG21      ILE  61  72.337   2.131  -3.472
  435   2HG2  ILE  61          HG23      ILE  61  71.666   0.573  -3.955
  436   3HG2  ILE  61          HG22      ILE  61  72.721   0.680  -2.547
  437   1HD1  ILE  61          HD12      ILE  61  72.088  -0.665  -5.598
  438   2HD1  ILE  61          HD11      ILE  61  71.898   0.118  -7.167
  439   3HD1  ILE  61          HD13      ILE  61  73.317  -0.877  -6.845
  440    H    ILE  62           HN       ILE  62  76.203   0.358  -2.408
  441    HA   ILE  62           HA       ILE  62  74.892   1.062   0.034
  442    HB   ILE  62           HB       ILE  62  77.680  -0.026  -0.463
  443   1HG1  ILE  62          HG12      ILE  62  75.075  -1.365   0.337
  444   2HG1  ILE  62          HG11      ILE  62  75.830  -1.463  -1.254
  445   1HG2  ILE  62          HG21      ILE  62  76.553   1.041   1.915
  446   2HG2  ILE  62          HG23      ILE  62  76.550  -0.715   2.092
  447   3HG2  ILE  62          HG22      ILE  62  78.058   0.135   1.750
  448   1HD1  ILE  62          HD13      ILE  62  77.321  -2.270   1.242
  449   2HD1  ILE  62          HD12      ILE  62  76.278  -3.407   0.388
  450   3HD1  ILE  62          HD11      ILE  62  77.671  -2.702  -0.432
  451    H    GLU  63           HN       GLU  63  77.867   2.299  -1.491
  452    HA   GLU  63           HA       GLU  63  78.540   4.120   0.621
  453   1HB   GLU  63           HB2      GLU  63  79.997   5.189  -1.031
  454   2HB   GLU  63           HB1      GLU  63  80.114   3.436  -1.187
  455   1HG   GLU  63           HG2      GLU  63  79.394   3.532  -3.316
  456   2HG   GLU  63           HG1      GLU  63  77.947   4.411  -2.822
  457    H    GLU  64           HN       GLU  64  75.955   4.135  -1.568
  458    HA   GLU  64           HA       GLU  64  75.695   7.099  -1.467
  459   1HB   GLU  64           HB2      GLU  64  74.227   4.975  -3.054
  460   2HB   GLU  64           HB1      GLU  64  73.782   6.681  -3.067
  461   1HG   GLU  64           HG2      GLU  64  76.651   6.118  -3.537
  462   2HG   GLU  64           HG1      GLU  64  75.556   5.578  -4.812
  463    H    VAL  65           HN       VAL  65  74.220   4.124  -0.313
  464    HA   VAL  65           HA       VAL  65  71.842   5.465   0.732
  465    HB   VAL  65           HB       VAL  65  72.967   2.719   1.361
  466   1HG1  VAL  65          HG13      VAL  65  70.761   4.238   2.428
  467   2HG1  VAL  65          HG12      VAL  65  70.144   2.833   1.560
  468   3HG1  VAL  65          HG11      VAL  65  71.303   2.620   2.872
  469   1HG2  VAL  65          HG23      VAL  65  72.466   3.077  -1.053
  470   2HG2  VAL  65          HG22      VAL  65  71.367   1.914  -0.313
  471   3HG2  VAL  65          HG21      VAL  65  70.828   3.565  -0.619
  472    H    ASP  66           HN       ASP  66  75.027   4.590   1.929
  473    HA   ASP  66           HA       ASP  66  74.288   5.278   4.702
  474   1HB   ASP  66           HB2      ASP  66  76.568   3.972   3.350
  475   2HB   ASP  66           HB1      ASP  66  77.006   4.985   4.725
  476    H    GLU  67           HN       GLU  67  73.708   7.535   3.821
  477    HA   GLU  67           HA       GLU  67  75.799   9.315   2.969
  478   1HB   GLU  67           HB2      GLU  67  73.143   9.895   4.315
  479   2HB   GLU  67           HB1      GLU  67  74.177  11.113   3.569
  480   1HG   GLU  67           HG2      GLU  67  73.166   8.693   2.062
  481   2HG   GLU  67           HG1      GLU  67  72.293  10.224   2.099
  482    H    ASP  68           HN       ASP  68  75.080   7.933   6.004
  483    HA   ASP  68           HA       ASP  68  76.498  10.118   7.452
  484   1HB   ASP  68           HB2      ASP  68  75.764   8.685   9.487
  485   2HB   ASP  68           HB1      ASP  68  74.516   9.577   8.616
  486    H    GLY  69           HN       GLY  69  76.826   6.832   6.358
  487   1HA   GLY  69           HA2      GLY  69  78.768   5.496   6.298
  488   2HA   GLY  69           HA1      GLY  69  79.650   6.824   7.053
  489    H    SER  70           HN       SER  70  76.715   5.529   8.469
  490    HA   SER  70           HA       SER  70  78.101   4.983  10.963
  491   1HB   SER  70           HB2      SER  70  75.864   4.108  11.686
  492   2HB   SER  70           HB1      SER  70  75.792   5.740  11.026
  493    HG   SER  70           HG       SER  70  74.226   4.062  10.245
  494    H    GLY  71           HN       GLY  71  77.510   3.192   8.102
  495   1HA   GLY  71           HA2      GLY  71  78.352   1.035   7.582
  496   2HA   GLY  71           HA1      GLY  71  78.807   0.838   9.274
  497    H    THR  72           HN       THR  72  75.596   1.920   8.815
  498    HA   THR  72           HA       THR  72  74.521  -0.851   8.865
  499    HB   THR  72           HB       THR  72  72.934   0.213  10.747
  500    HG1  THR  72           HG1      THR  72  74.771   1.277  12.099
  501   1HG2  THR  72          HG22      THR  72  75.637  -1.095  11.030
  502   2HG2  THR  72          HG21      THR  72  74.624  -0.756  12.434
  503   3HG2  THR  72          HG23      THR  72  74.044  -1.836  11.166
  504    H    ILE  73           HN       ILE  73  72.360  -0.982   8.101
  505    HA   ILE  73           HA       ILE  73  71.401   1.513   6.769
  506    HB   ILE  73           HB       ILE  73  70.803  -1.397   6.153
  507   1HG1  ILE  73          HG12      ILE  73  73.120  -0.439   5.601
  508   2HG1  ILE  73          HG11      ILE  73  72.219  -1.125   4.249
  509   1HG2  ILE  73          HG23      ILE  73  68.911   0.143   5.669
  510   2HG2  ILE  73          HG22      ILE  73  69.990   1.128   4.679
  511   3HG2  ILE  73          HG21      ILE  73  69.615  -0.526   4.198
  512   1HD1  ILE  73          HD12      ILE  73  71.602   1.703   4.675
  513   2HD1  ILE  73          HD11      ILE  73  73.313   1.430   4.340
  514   3HD1  ILE  73          HD13      ILE  73  72.091   0.874   3.196
  515    H    ASP  74           HN       ASP  74  69.281   2.202   7.132
  516    HA   ASP  74           HA       ASP  74  67.698   0.610   9.111
  517   1HB   ASP  74           HB2      ASP  74  68.231   3.585   9.009
  518   2HB   ASP  74           HB1      ASP  74  66.861   2.913   9.894
  519    H    PHE  75           HN       PHE  75  65.330   1.074   8.972
  520    HA   PHE  75           HA       PHE  75  64.228   0.717   6.462
  521   1HB   PHE  75           HB2      PHE  75  63.065   0.718   8.767
  522   2HB   PHE  75           HB1      PHE  75  62.838   2.447   8.508
  523    HD1  PHE  75           HD2      PHE  75  62.772  -0.378   6.064
  524    HD2  PHE  75           HD1      PHE  75  60.552   2.729   8.027
  525    HE1  PHE  75           HE2      PHE  75  60.822  -0.850   4.605
  526    HE2  PHE  75           HE1      PHE  75  58.602   2.259   6.569
  527    HZ   PHE  75           HZ       PHE  75  58.736   0.468   4.859
  528    H    GLU  76           HN       GLU  76  64.974   3.832   8.014
  529    HA   GLU  76           HA       GLU  76  63.822   5.507   6.018
  530   1HB   GLU  76           HB2      GLU  76  65.870   5.820   8.154
  531   2HB   GLU  76           HB1      GLU  76  65.888   7.023   6.865
  532   1HG   GLU  76           HG2      GLU  76  63.720   7.767   7.348
  533   2HG   GLU  76           HG1      GLU  76  63.289   6.272   8.180
  534    H    GLU  77           HN       GLU  77  67.117   4.165   6.304
  535    HA   GLU  77           HA       GLU  77  68.038   5.395   3.847
  536   1HB   GLU  77           HB2      GLU  77  69.140   3.003   5.356
  537   2HB   GLU  77           HB1      GLU  77  69.987   3.909   4.102
  538   1HG   GLU  77           HG2      GLU  77  69.834   5.955   5.489
  539   2HG   GLU  77           HG1      GLU  77  69.024   5.027   6.751
  540    H    PHE  78           HN       PHE  78  66.131   2.626   4.568
  541    HA   PHE  78           HA       PHE  78  66.802   1.001   2.294
  542   1HB   PHE  78           HB2      PHE  78  65.150   0.736   4.504
  543   2HB   PHE  78           HB1      PHE  78  64.007   0.845   3.165
  544    HD1  PHE  78           HD1      PHE  78  66.882  -1.040   4.536
  545    HD2  PHE  78           HD2      PHE  78  63.866  -0.876   1.484
  546    HE1  PHE  78           HE1      PHE  78  67.400  -3.380   3.900
  547    HE2  PHE  78           HE2      PHE  78  64.381  -3.217   0.847
  548    HZ   PHE  78           HZ       PHE  78  66.149  -4.470   2.056
  549    H    LEU  79           HN       LEU  79  63.934   3.078   2.845
  550    HA   LEU  79           HA       LEU  79  62.764   3.005   0.348
  551   1HB   LEU  79           HB2      LEU  79  63.216   5.521   1.984
  552   2HB   LEU  79           HB1      LEU  79  61.971   5.296   0.754
  553    HG   LEU  79           HG       LEU  79  62.237   3.732   3.337
  554   1HD1  LEU  79          HD11      LEU  79  60.255   5.799   2.346
  555   2HD1  LEU  79          HD13      LEU  79  59.978   4.784   3.761
  556   3HD1  LEU  79          HD12      LEU  79  61.321   5.928   3.745
  557   1HD2  LEU  79          HD22      LEU  79  60.685   3.310   0.832
  558   2HD2  LEU  79          HD21      LEU  79  61.260   2.131   2.011
  559   3HD2  LEU  79          HD23      LEU  79  59.808   3.074   2.345
  560    H    VAL  80           HN       VAL  80  65.742   4.668   1.239
  561    HA   VAL  80           HA       VAL  80  66.009   6.135  -1.237
  562    HB   VAL  80           HB       VAL  80  68.017   5.290   0.868
  563   1HG1  VAL  80          HG11      VAL  80  68.356   6.658  -1.767
  564   2HG1  VAL  80          HG13      VAL  80  69.291   7.266  -0.400
  565   3HG1  VAL  80          HG12      VAL  80  69.463   5.587  -0.908
  566   1HG2  VAL  80          HG22      VAL  80  66.073   7.131   1.088
  567   2HG2  VAL  80          HG21      VAL  80  67.665   7.364   1.812
  568   3HG2  VAL  80          HG23      VAL  80  67.281   8.119   0.264
  569    H    MET  81           HN       MET  81  67.400   3.070  -0.052
  570    HA   MET  81           HA       MET  81  68.989   2.395  -2.255
  571   1HB   MET  81           HB2      MET  81  68.437   1.128   0.014
  572   2HB   MET  81           HB1      MET  81  67.310   0.252  -1.020
  573   1HG   MET  81           HG2      MET  81  69.070  -0.453  -2.489
  574   2HG   MET  81           HG1      MET  81  70.226   0.638  -1.726
  575   1HE   MET  81           HE1      MET  81  70.267   0.797   0.714
  576   2HE   MET  81           HE3      MET  81  69.180  -0.209   1.679
  577   3HE   MET  81           HE2      MET  81  70.905  -0.564   1.632
  578    H    MET  82           HN       MET  82  65.485   1.902  -1.848
  579    HA   MET  82           HA       MET  82  65.167   0.544  -4.382
  580   1HB   MET  82           HB2      MET  82  62.970   2.077  -3.001
  581   2HB   MET  82           HB1      MET  82  62.852   0.592  -3.941
  582   1HG   MET  82           HG2      MET  82  64.045   0.930  -1.179
  583   2HG   MET  82           HG1      MET  82  62.641  -0.035  -1.633
  584   1HE   MET  82           HE2      MET  82  62.656  -1.467  -3.486
  585   2HE   MET  82           HE1      MET  82  64.071  -1.833  -4.469
  586   3HE   MET  82           HE3      MET  82  63.533  -2.973  -3.227
  587    H    VAL  83           HN       VAL  83  64.256   3.855  -3.345
  588    HA   VAL  83           HA       VAL  83  63.496   4.788  -5.906
  589    HB   VAL  83           HB       VAL  83  64.867   6.502  -3.825
  590   1HG1  VAL  83          HG11      VAL  83  64.254   7.514  -6.023
  591   2HG1  VAL  83          HG13      VAL  83  62.578   7.039  -5.744
  592   3HG1  VAL  83          HG12      VAL  83  63.350   8.216  -4.681
  593   1HG2  VAL  83          HG23      VAL  83  62.628   4.801  -3.426
  594   2HG2  VAL  83          HG22      VAL  83  63.216   6.071  -2.353
  595   3HG2  VAL  83          HG21      VAL  83  61.996   6.442  -3.571
  596    H    ARG  84           HN       ARG  84  66.616   3.968  -4.741
  597    HA   ARG  84           HA       ARG  84  68.301   5.758  -6.121
  598   1HB   ARG  84           HB2      ARG  84  68.593   2.817  -5.479
  599   2HB   ARG  84           HB1      ARG  84  69.874   3.732  -6.275
  600   1HG   ARG  84           HG2      ARG  84  69.194   5.396  -4.191
  601   2HG   ARG  84           HG1      ARG  84  68.993   3.799  -3.470
  602   1HD   ARG  84           HD2      ARG  84  71.221   3.609  -3.270
  603   2HD   ARG  84           HD1      ARG  84  71.388   3.751  -5.020
  604    HE   ARG  84           HE       ARG  84  71.857   5.881  -3.072
  605   1HH1  ARG  84          HH21      ARG  84  70.463   7.720  -4.405
  606   2HH1  ARG  84          HH22      ARG  84  71.255   8.038  -5.913
  607   1HH2  ARG  84          HH11      ARG  84  73.137   5.126  -5.843
  608   2HH2  ARG  84          HH12      ARG  84  72.768   6.569  -6.728
  609    H    GLN  85           HN       GLN  85  66.954   2.656  -7.314
  610    HA   GLN  85           HA       GLN  85  66.942   3.795 -10.043
  611   1HB   GLN  85           HB2      GLN  85  68.221   2.007 -11.021
  612   2HB   GLN  85           HB1      GLN  85  69.177   2.651  -9.685
  613   1HG   GLN  85           HG2      GLN  85  67.416   0.604  -8.687
  614   2HG   GLN  85           HG1      GLN  85  68.321  -0.028 -10.064
  615   1HE2  GLN  85          HE22      GLN  85  70.538   1.380  -6.886
  616   2HE2  GLN  85          HE21      GLN  85  69.095   2.174  -7.297
  617    H    MET  86           HN       MET  86  64.826   3.080  -8.220
  618    HA   MET  86           HA       MET  86  63.755   0.551  -9.359
  619   1HB   MET  86           HB2      MET  86  62.127   0.614  -7.589
  620   2HB   MET  86           HB1      MET  86  63.684   1.013  -6.863
  621   1HG   MET  86           HG2      MET  86  62.787   2.933  -6.107
  622   2HG   MET  86           HG1      MET  86  62.594   3.455  -7.782
  623   1HE   MET  86           HE2      MET  86  60.730   4.937  -6.748
  624   2HE   MET  86           HE1      MET  86  59.220   4.354  -6.057
  625   3HE   MET  86           HE3      MET  86  60.733   4.186  -5.155
  626    H    LYS  87           HN       LYS  87  63.640   3.880  -9.912
  627    HA   LYS  87           HA       LYS  87  60.877   4.170 -10.684
  628   1HB   LYS  87           HB2      LYS  87  63.377   5.701 -11.454
  629   2HB   LYS  87           HB1      LYS  87  61.755   6.171 -11.965
  630   1HG   LYS  87           HG2      LYS  87  61.345   5.836  -9.298
  631   2HG   LYS  87           HG1      LYS  87  63.026   6.375  -9.298
  632   1HD   LYS  87           HD2      LYS  87  61.139   7.866 -11.053
  633   2HD   LYS  87           HD1      LYS  87  60.970   8.107  -9.315
  634   1HE   LYS  87           HE2      LYS  87  63.705   8.225  -9.672
  635   2HE   LYS  87           HE1      LYS  87  63.094   9.013 -11.126
  636   1HZ   LYS  87           HZ3      LYS  87  61.653  10.366  -9.639
  637   2HZ   LYS  87           HZ2      LYS  87  62.481   9.710  -8.308
  638   3HZ   LYS  87           HZ1      LYS  87  63.313  10.657  -9.447
  639    H    GLU  88           HN       GLU  88  63.854   3.623 -12.597
  640    HA   GLU  88           HA       GLU  88  62.181   2.217 -14.612
  641   1HB   GLU  88           HB2      GLU  88  63.733   3.463 -16.347
  642   2HB   GLU  88           HB1      GLU  88  62.280   4.257 -15.733
  643   1HG   GLU  88           HG2      GLU  88  63.473   5.713 -14.390
  644   2HG   GLU  88           HG1      GLU  88  64.815   4.587 -14.184
  645    H    ASP  89           HN       ASP  89  63.197   0.392 -15.354
  646    HA   ASP  89           HA       ASP  89  65.993  -0.055 -14.437
  647   1HB   ASP  89           HB2      ASP  89  63.726  -1.670 -14.339
  648   2HB   ASP  89           HB1      ASP  89  64.651  -2.330 -15.689
  649    H    ALA  90           HN       ALA  90  64.815   1.364 -16.989
  650    HA   ALA  90           HA       ALA  90  66.404  -0.198 -18.980
  651   1HB   ALA  90           HB3      ALA  90  63.905   0.359 -19.381
  652   2HB   ALA  90           HB2      ALA  90  64.461   2.011 -19.653
  653   3HB   ALA  90           HB1      ALA  90  65.039   0.705 -20.688
   
  No H/Q in entry =         653
  Start of MODEL   14
    1   1H    ALA   1           HT2      ALA   1  65.691  12.179  12.978
    2   2H    ALA   1           HT1      ALA   1  66.174  10.864  13.940
    3   3H    ALA   1           HT3      ALA   1  65.236  12.106  14.614
    4    HA   ALA   1           HA       ALA   1  67.035  13.244  15.168
    5   1HB   ALA   1           HB2      ALA   1  67.923  10.616  14.643
    6   2HB   ALA   1           HB1      ALA   1  69.124  11.685  13.918
    7   3HB   ALA   1           HB3      ALA   1  68.731  11.835  15.629
    8    H    SER   2           HN       SER   2  67.459  12.011  11.838
    9    HA   SER   2           HA       SER   2  68.158  14.800  11.037
   10   1HB   SER   2           HB2      SER   2  69.687  13.497   9.298
   11   2HB   SER   2           HB1      SER   2  70.288  13.896  10.905
   12    HG   SER   2           HG       SER   2  69.538  11.453   9.810
   13    H    MET   3           HN       MET   3  68.238  14.682   8.399
   14    HA   MET   3           HA       MET   3  66.218  12.904   7.261
   15   1HB   MET   3           HB2      MET   3  65.510  15.587   8.229
   16   2HB   MET   3           HB1      MET   3  65.082  15.314   6.540
   17   1HG   MET   3           HG2      MET   3  63.242  14.262   7.333
   18   2HG   MET   3           HG1      MET   3  64.331  12.944   7.767
   19   1HE   MET   3           HE2      MET   3  61.530  14.633   8.883
   20   2HE   MET   3           HE1      MET   3  61.811  15.454  10.416
   21   3HE   MET   3           HE3      MET   3  62.446  16.138   8.914
   22    H    THR   4           HN       THR   4  68.278  12.601   6.013
   23    HA   THR   4           HA       THR   4  69.514  14.621   4.468
   24    HB   THR   4           HB       THR   4  69.730  12.460   2.827
   25    HG1  THR   4           HG1      THR   4  69.362  10.653   3.893
   26   1HG2  THR   4          HG22      THR   4  71.165  13.419   5.248
   27   2HG2  THR   4          HG21      THR   4  71.598  11.816   4.652
   28   3HG2  THR   4          HG23      THR   4  71.751  13.221   3.596
   29    H    ASP   5           HN       ASP   5  69.171  15.296   2.279
   30    HA   ASP   5           HA       ASP   5  66.463  15.718   1.526
   31   1HB   ASP   5           HB2      ASP   5  68.719  15.666  -0.475
   32   2HB   ASP   5           HB1      ASP   5  67.314  16.732  -0.426
   33    H    GLN   6           HN       GLN   6  68.790  13.220   0.553
   34    HA   GLN   6           HA       GLN   6  67.306  12.039  -1.544
   35   1HB   GLN   6           HB2      GLN   6  69.053  10.666   0.523
   36   2HB   GLN   6           HB1      GLN   6  68.549   9.966  -1.016
   37   1HG   GLN   6           HG2      GLN   6  70.076  11.159  -2.195
   38   2HG   GLN   6           HG1      GLN   6  69.773  12.629  -1.268
   39   1HE2  GLN   6          HE22      GLN   6  72.263  10.003   0.668
   40   2HE2  GLN   6          HE21      GLN   6  70.781   9.451   0.049
   41    H    GLN   7           HN       GLN   7  66.947  11.763   1.954
   42    HA   GLN   7           HA       GLN   7  65.008   9.590   1.788
   43   1HB   GLN   7           HB2      GLN   7  65.424  11.481   4.113
   44   2HB   GLN   7           HB1      GLN   7  64.792   9.834   4.159
   45   1HG   GLN   7           HG2      GLN   7  67.508  10.222   2.988
   46   2HG   GLN   7           HG1      GLN   7  67.352  10.380   4.738
   47   1HE2  GLN   7          HE22      GLN   7  67.826   6.836   4.670
   48   2HE2  GLN   7          HE21      GLN   7  68.605   8.322   4.933
   49    H    ALA   8           HN       ALA   8  64.917  13.077   1.695
   50    HA   ALA   8           HA       ALA   8  62.116  13.361   2.357
   51   1HB   ALA   8           HB1      ALA   8  64.220  15.105   1.986
   52   2HB   ALA   8           HB3      ALA   8  63.247  15.382   0.541
   53   3HB   ALA   8           HB2      ALA   8  62.530  15.583   2.141
   54    H    GLU   9           HN       GLU   9  63.903  13.178  -0.728
   55    HA   GLU   9           HA       GLU   9  61.422  13.270  -2.280
   56   1HB   GLU   9           HB2      GLU   9  63.894  14.003  -2.936
   57   2HB   GLU   9           HB1      GLU   9  64.004  12.322  -3.461
   58   1HG   GLU   9           HG2      GLU   9  62.247  12.571  -5.021
   59   2HG   GLU   9           HG1      GLU   9  61.674  14.059  -4.269
   60    H    ALA  10           HN       ALA  10  63.441  10.829  -0.844
   61    HA   ALA  10           HA       ALA  10  62.660   8.621  -2.508
   62   1HB   ALA  10           HB1      ALA  10  63.581   8.719   0.379
   63   2HB   ALA  10           HB3      ALA  10  63.366   7.227  -0.536
   64   3HB   ALA  10           HB2      ALA  10  64.580   8.403  -1.041
   65    H    ARG  11           HN       ARG  11  61.510   9.532   0.767
   66    HA   ARG  11           HA       ARG  11  59.270   7.725   0.667
   67   1HB   ARG  11           HB2      ARG  11  58.493   8.909   2.675
   68   2HB   ARG  11           HB1      ARG  11  60.220   8.558   2.793
   69   1HG   ARG  11           HG2      ARG  11  60.659  10.856   1.862
   70   2HG   ARG  11           HG1      ARG  11  58.935  11.183   2.025
   71   1HD   ARG  11           HD2      ARG  11  59.638  10.126   4.502
   72   2HD   ARG  11           HD1      ARG  11  61.012  11.148   4.080
   73    HE   ARG  11           HE       ARG  11  59.322  13.007   3.754
   74   1HH1  ARG  11          HH11      ARG  11  57.248  10.617   4.326
   75   2HH1  ARG  11          HH12      ARG  11  56.609  11.199   5.828
   76   1HH2  ARG  11          HH21      ARG  11  59.080  13.596   6.252
   77   2HH2  ARG  11          HH22      ARG  11  57.649  12.885   6.919
   78    H    ALA  12           HN       ALA  12  59.709  11.126  -0.169
   79    HA   ALA  12           HA       ALA  12  56.954  11.806  -0.473
   80   1HB   ALA  12           HB2      ALA  12  59.542  12.882  -1.516
   81   2HB   ALA  12           HB1      ALA  12  58.052  13.420  -2.290
   82   3HB   ALA  12           HB3      ALA  12  58.295  13.687  -0.563
   83    H    PHE  13           HN       PHE  13  59.139   9.968  -2.486
   84    HA   PHE  13           HA       PHE  13  57.336  10.103  -4.813
   85   1HB   PHE  13           HB2      PHE  13  59.841  10.013  -5.051
   86   2HB   PHE  13           HB1      PHE  13  59.791   8.372  -4.404
   87    HD1  PHE  13           HD1      PHE  13  57.850  10.370  -6.926
   88    HD2  PHE  13           HD2      PHE  13  59.878   6.699  -6.009
   89    HE1  PHE  13           HE1      PHE  13  57.289   9.498  -9.180
   90    HE2  PHE  13           HE2      PHE  13  59.318   5.825  -8.262
   91    HZ   PHE  13           HZ       PHE  13  58.022   7.225  -9.847
   92    H    LEU  14           HN       LEU  14  58.003   8.012  -2.099
   93    HA   LEU  14           HA       LEU  14  56.420   5.808  -3.292
   94   1HB   LEU  14           HB2      LEU  14  57.679   5.933  -0.540
   95   2HB   LEU  14           HB1      LEU  14  57.136   4.494  -1.406
   96    HG   LEU  14           HG       LEU  14  59.228   6.295  -2.608
   97   1HD1  LEU  14          HD11      LEU  14  59.904   5.618  -0.264
   98   2HD1  LEU  14          HD13      LEU  14  59.806   3.938  -0.793
   99   3HD1  LEU  14          HD12      LEU  14  60.977   5.031  -1.534
  100   1HD2  LEU  14          HD21      LEU  14  57.888   3.902  -3.346
  101   2HD2  LEU  14          HD23      LEU  14  59.214   4.697  -4.195
  102   3HD2  LEU  14          HD22      LEU  14  59.559   3.460  -2.987
  103    H    SER  15           HN       SER  15  54.425   5.134  -2.414
  104    HA   SER  15           HA       SER  15  52.961   7.237  -0.960
  105   1HB   SER  15           HB2      SER  15  51.125   5.303  -1.235
  106   2HB   SER  15           HB1      SER  15  51.537   6.388  -2.559
  107    HG   SER  15           HG       SER  15  51.623   4.202  -3.203
  108    H    GLU  16           HN       GLU  16  51.704   6.687   1.002
  109    HA   GLU  16           HA       GLU  16  53.261   5.472   3.026
  110   1HB   GLU  16           HB2      GLU  16  50.673   6.696   2.817
  111   2HB   GLU  16           HB1      GLU  16  50.520   5.206   3.751
  112   1HG   GLU  16           HG2      GLU  16  52.493   5.958   5.128
  113   2HG   GLU  16           HG1      GLU  16  52.417   7.507   4.287
  114    H    GLU  17           HN       GLU  17  50.605   4.114   1.077
  115    HA   GLU  17           HA       GLU  17  50.620   1.552   2.402
  116   1HB   GLU  17           HB2      GLU  17  49.375   2.734  -0.010
  117   2HB   GLU  17           HB1      GLU  17  49.627   0.989  -0.071
  118   1HG   GLU  17           HG2      GLU  17  48.428   0.707   2.040
  119   2HG   GLU  17           HG1      GLU  17  48.244   2.455   2.195
  120    H    MET  18           HN       MET  18  52.604   2.982  -0.069
  121    HA   MET  18           HA       MET  18  53.584   0.473  -1.163
  122   1HB   MET  18           HB2      MET  18  54.011   3.320  -1.604
  123   2HB   MET  18           HB1      MET  18  55.533   2.428  -1.625
  124   1HG   MET  18           HG2      MET  18  54.604   0.854  -3.272
  125   2HG   MET  18           HG1      MET  18  53.067   1.717  -3.241
  126   1HE   MET  18           HE2      MET  18  54.101   0.993  -5.555
  127   2HE   MET  18           HE1      MET  18  54.349   2.348  -6.653
  128   3HE   MET  18           HE3      MET  18  55.738   1.484  -5.982
  129    H    ILE  19           HN       ILE  19  54.933   2.874   1.124
  130    HA   ILE  19           HA       ILE  19  57.310   1.358   1.677
  131    HB   ILE  19           HB       ILE  19  55.864   3.542   3.189
  132   1HG1  ILE  19          HG12      ILE  19  58.625   3.888   2.212
  133   2HG1  ILE  19          HG11      ILE  19  57.437   3.619   0.937
  134   1HG2  ILE  19          HG21      ILE  19  58.176   1.829   3.980
  135   2HG2  ILE  19          HG23      ILE  19  58.291   3.553   4.328
  136   3HG2  ILE  19          HG22      ILE  19  56.958   2.607   4.991
  137   1HD1  ILE  19          HD11      ILE  19  56.015   5.413   2.010
  138   2HD1  ILE  19          HD13      ILE  19  57.382   5.768   3.065
  139   3HD1  ILE  19          HD12      ILE  19  57.533   5.993   1.324
  140    H    ALA  20           HN       ALA  20  54.032   1.112   2.787
  141    HA   ALA  20           HA       ALA  20  54.559  -0.280   5.259
  142   1HB   ALA  20           HB1      ALA  20  52.132  -0.258   3.440
  143   2HB   ALA  20           HB3      ALA  20  52.169  -1.031   5.025
  144   3HB   ALA  20           HB2      ALA  20  52.374   0.716   4.890
  145    H    GLU  21           HN       GLU  21  54.140  -1.259   1.905
  146    HA   GLU  21           HA       GLU  21  54.065  -4.098   2.444
  147   1HB   GLU  21           HB2      GLU  21  53.190  -3.627   0.350
  148   2HB   GLU  21           HB1      GLU  21  54.353  -2.343   0.036
  149   1HG   GLU  21           HG2      GLU  21  55.896  -3.776  -0.843
  150   2HG   GLU  21           HG1      GLU  21  55.495  -5.067   0.290
  151    H    PHE  22           HN       PHE  22  56.647  -1.850   1.410
  152    HA   PHE  22           HA       PHE  22  58.709  -3.843   1.301
  153   1HB   PHE  22           HB2      PHE  22  58.792  -0.842   1.686
  154   2HB   PHE  22           HB1      PHE  22  60.247  -1.829   1.548
  155    HD1  PHE  22           HD1      PHE  22  59.442  -3.857  -0.429
  156    HD2  PHE  22           HD2      PHE  22  58.667   0.368  -0.336
  157    HE1  PHE  22           HE1      PHE  22  59.220  -3.843  -2.899
  158    HE2  PHE  22           HE2      PHE  22  58.446   0.382  -2.806
  159    HZ   PHE  22           HZ       PHE  22  58.721  -1.723  -4.087
  160    H    LYS  23           HN       LYS  23  57.328  -1.971   3.930
  161    HA   LYS  23           HA       LYS  23  59.374  -2.258   5.866
  162   1HB   LYS  23           HB2      LYS  23  57.506  -0.848   6.380
  163   2HB   LYS  23           HB1      LYS  23  56.362  -2.168   6.135
  164   1HG   LYS  23           HG2      LYS  23  56.662  -1.863   8.521
  165   2HG   LYS  23           HG1      LYS  23  57.444  -3.374   8.058
  166   1HD   LYS  23           HD2      LYS  23  59.404  -2.617   8.857
  167   2HD   LYS  23           HD1      LYS  23  59.339  -1.256   7.735
  168   1HE   LYS  23           HE2      LYS  23  57.708  -1.195  10.262
  169   2HE   LYS  23           HE1      LYS  23  59.420  -0.776  10.309
  170   1HZ   LYS  23           HZ1      LYS  23  57.563   0.443   8.356
  171   2HZ   LYS  23           HZ3      LYS  23  57.787   1.098   9.904
  172   3HZ   LYS  23           HZ2      LYS  23  59.099   0.988   8.831
  173    H    ALA  24           HN       ALA  24  57.377  -4.642   4.409
  174    HA   ALA  24           HA       ALA  24  57.496  -6.561   6.599
  175   1HB   ALA  24           HB2      ALA  24  55.717  -6.609   4.851
  176   2HB   ALA  24           HB1      ALA  24  56.939  -7.033   3.654
  177   3HB   ALA  24           HB3      ALA  24  56.576  -8.142   4.976
  178    H    ALA  25           HN       ALA  25  59.291  -6.056   3.563
  179    HA   ALA  25           HA       ALA  25  60.985  -8.372   3.909
  180   1HB   ALA  25           HB1      ALA  25  60.509  -6.859   1.787
  181   2HB   ALA  25           HB3      ALA  25  61.901  -5.958   2.385
  182   3HB   ALA  25           HB2      ALA  25  62.067  -7.665   1.976
  183    H    PHE  26           HN       PHE  26  61.301  -4.935   4.755
  184    HA   PHE  26           HA       PHE  26  63.990  -4.883   5.559
  185   1HB   PHE  26           HB2      PHE  26  62.323  -2.948   5.529
  186   2HB   PHE  26           HB1      PHE  26  61.767  -3.527   7.099
  187    HD1  PHE  26           HD1      PHE  26  65.153  -3.217   5.507
  188    HD2  PHE  26           HD2      PHE  26  62.611  -2.202   8.818
  189    HE1  PHE  26           HE1      PHE  26  67.049  -2.059   6.609
  190    HE2  PHE  26           HE2      PHE  26  64.508  -1.043   9.919
  191    HZ   PHE  26           HZ       PHE  26  66.727  -0.972   8.814
  192    H    ASP  27           HN       ASP  27  61.262  -5.305   7.847
  193    HA   ASP  27           HA       ASP  27  62.832  -6.223  10.009
  194   1HB   ASP  27           HB2      ASP  27  60.215  -5.668   9.729
  195   2HB   ASP  27           HB1      ASP  27  60.130  -7.428   9.657
  196    H    MET  28           HN       MET  28  62.010  -7.819   7.073
  197    HA   MET  28           HA       MET  28  62.112 -10.540   7.985
  198   1HB   MET  28           HB2      MET  28  61.808  -9.188   5.504
  199   2HB   MET  28           HB1      MET  28  63.163 -10.304   5.321
  200   1HG   MET  28           HG2      MET  28  61.828 -12.178   5.990
  201   2HG   MET  28           HG1      MET  28  60.516 -11.130   6.531
  202   1HE   MET  28           HE1      MET  28  62.854 -11.826   3.608
  203   2HE   MET  28           HE3      MET  28  61.941 -11.344   2.171
  204   3HE   MET  28           HE2      MET  28  62.495 -10.126   3.316
  205    H    PHE  29           HN       PHE  29  64.621  -8.338   6.724
  206    HA   PHE  29           HA       PHE  29  66.694 -10.383   7.200
  207   1HB   PHE  29           HB2      PHE  29  67.160  -7.504   6.407
  208   2HB   PHE  29           HB1      PHE  29  68.195  -8.900   6.104
  209    HD1  PHE  29           HD2      PHE  29  65.063  -7.192   5.138
  210    HD2  PHE  29           HD1      PHE  29  67.738 -10.444   4.295
  211    HE1  PHE  29           HE2      PHE  29  63.912  -7.578   2.975
  212    HE2  PHE  29           HE1      PHE  29  66.588 -10.831   2.133
  213    HZ   PHE  29           HZ       PHE  29  64.674  -9.398   1.473
  214    H    ASP  30           HN       ASP  30  65.050  -8.933   9.375
  215    HA   ASP  30           HA       ASP  30  67.377  -7.856  10.914
  216   1HB   ASP  30           HB2      ASP  30  64.576  -7.007  10.649
  217   2HB   ASP  30           HB1      ASP  30  65.115  -7.129  12.325
  218    H    ALA  31           HN       ALA  31  67.999 -10.025  11.566
  219    HA   ALA  31           HA       ALA  31  66.173 -11.812  12.899
  220   1HB   ALA  31           HB3      ALA  31  69.184 -11.596  12.793
  221   2HB   ALA  31           HB2      ALA  31  68.382 -12.807  13.796
  222   3HB   ALA  31           HB1      ALA  31  68.146 -12.811  12.048
  223    H    ASP  32           HN       ASP  32  68.498  -9.384  14.083
  224    HA   ASP  32           HA       ASP  32  67.680  -9.895  16.868
  225   1HB   ASP  32           HB2      ASP  32  69.345  -8.180  17.435
  226   2HB   ASP  32           HB1      ASP  32  70.046  -9.360  16.327
  227    H    GLY  33           HN       GLY  33  66.622  -7.986  14.265
  228   1HA   GLY  33           HA2      GLY  33  65.070  -6.233  14.126
  229   2HA   GLY  33           HA1      GLY  33  64.473  -6.814  15.681
  230    H    GLY  34           HN       GLY  34  67.538  -5.268  14.655
  231   1HA   GLY  34           HA2      GLY  34  67.422  -3.573  17.073
  232   2HA   GLY  34           HA1      GLY  34  68.787  -3.697  15.962
  233    H    GLY  35           HN       GLY  35  66.475  -3.403  13.813
  234   1HA   GLY  35           HA2      GLY  35  65.122  -1.466  13.115
  235   2HA   GLY  35           HA1      GLY  35  66.203  -0.439  14.059
  236    H    ASP  36           HN       ASP  36  67.950  -2.830  12.446
  237    HA   ASP  36           HA       ASP  36  68.187  -1.516   9.863
  238   1HB   ASP  36           HB2      ASP  36  70.698  -1.007  10.328
  239   2HB   ASP  36           HB1      ASP  36  69.494   0.138  10.916
  240    H    ILE  37           HN       ILE  37  69.171  -2.905   8.400
  241    HA   ILE  37           HA       ILE  37  70.213  -5.451   9.554
  242    HB   ILE  37           HB       ILE  37  68.554  -6.264   8.241
  243   1HG1  ILE  37          HG12      ILE  37  70.837  -6.730   7.030
  244   2HG1  ILE  37          HG11      ILE  37  69.328  -7.122   6.217
  245   1HG2  ILE  37          HG22      ILE  37  67.706  -3.964   7.779
  246   2HG2  ILE  37          HG21      ILE  37  68.786  -3.877   6.387
  247   3HG2  ILE  37          HG23      ILE  37  67.480  -5.064   6.419
  248   1HD1  ILE  37          HD11      ILE  37  69.415  -4.929   5.043
  249   2HD1  ILE  37          HD13      ILE  37  70.974  -4.606   5.799
  250   3HD1  ILE  37          HD12      ILE  37  70.805  -5.945   4.667
  251    H    SER  38           HN       SER  38  72.050  -6.425   8.483
  252    HA   SER  38           HA       SER  38  74.137  -4.520   7.900
  253   1HB   SER  38           HB2      SER  38  73.884  -7.454   8.098
  254   2HB   SER  38           HB1      SER  38  75.123  -6.903   6.974
  255    HG   SER  38           HG       SER  38  74.923  -6.605   9.738
  256    H    THR  39           HN       THR  39  74.890  -3.797   5.919
  257    HA   THR  39           HA       THR  39  73.215  -3.889   3.634
  258    HB   THR  39           HB       THR  39  75.151  -2.980   2.399
  259    HG1  THR  39           HG1      THR  39  76.491  -3.862   4.719
  260   1HG2  THR  39          HG22      THR  39  74.366  -1.977   5.090
  261   2HG2  THR  39          HG21      THR  39  75.759  -1.214   4.322
  262   3HG2  THR  39          HG23      THR  39  74.195  -1.213   3.512
  263    H    LYS  40           HN       LYS  40  75.589  -6.147   4.796
  264    HA   LYS  40           HA       LYS  40  76.246  -7.491   2.386
  265   1HB   LYS  40           HB2      LYS  40  76.177  -8.213   5.276
  266   2HB   LYS  40           HB1      LYS  40  76.224  -9.549   4.125
  267   1HG   LYS  40           HG2      LYS  40  78.103  -7.859   3.068
  268   2HG   LYS  40           HG1      LYS  40  78.309  -7.574   4.796
  269   1HD   LYS  40           HD2      LYS  40  79.653  -9.420   4.648
  270   2HD   LYS  40           HD1      LYS  40  78.116 -10.274   4.797
  271   1HE   LYS  40           HE2      LYS  40  78.853  -9.425   2.053
  272   2HE   LYS  40           HE1      LYS  40  79.855 -10.694   2.758
  273   1HZ   LYS  40           HZ3      LYS  40  76.901 -10.814   2.843
  274   2HZ   LYS  40           HZ2      LYS  40  77.781 -11.410   1.516
  275   3HZ   LYS  40           HZ1      LYS  40  78.015 -12.076   3.061
  276    H    ALA  41           HN       ALA  41  73.578  -8.113   4.682
  277    HA   ALA  41           HA       ALA  41  72.380 -10.171   3.043
  278   1HB   ALA  41           HB1      ALA  41  72.043  -9.594   5.594
  279   2HB   ALA  41           HB3      ALA  41  70.787  -8.518   4.980
  280   3HB   ALA  41           HB2      ALA  41  70.699 -10.250   4.660
  281    H    LEU  42           HN       LEU  42  72.388  -6.730   2.925
  282    HA   LEU  42           HA       LEU  42  69.870  -6.166   1.772
  283   1HB   LEU  42           HB2      LEU  42  72.131  -4.705   2.324
  284   2HB   LEU  42           HB1      LEU  42  72.137  -4.720   0.560
  285    HG   LEU  42           HG       LEU  42  69.889  -3.816   0.483
  286   1HD1  LEU  42          HD13      LEU  42  69.805  -4.845   3.181
  287   2HD1  LEU  42          HD12      LEU  42  69.349  -3.141   3.176
  288   3HD1  LEU  42          HD11      LEU  42  68.470  -4.292   2.168
  289   1HD2  LEU  42          HD21      LEU  42  72.116  -2.467   1.529
  290   2HD2  LEU  42          HD23      LEU  42  70.677  -1.730   0.825
  291   3HD2  LEU  42          HD22      LEU  42  70.770  -1.992   2.567
  292    H    GLY  43           HN       GLY  43  72.861  -7.344   0.254
  293   1HA   GLY  43           HA2      GLY  43  72.196  -7.164  -2.447
  294   2HA   GLY  43           HA1      GLY  43  73.117  -8.510  -1.776
  295    H    THR  44           HN       THR  44  71.158  -9.647  -0.112
  296    HA   THR  44           HA       THR  44  69.589 -11.102  -2.082
  297    HB   THR  44           HB       THR  44  69.695 -11.170   0.942
  298    HG1  THR  44           HG1      THR  44  71.208 -12.533   0.518
  299   1HG2  THR  44          HG23      THR  44  68.014 -12.799  -0.978
  300   2HG2  THR  44          HG22      THR  44  68.314 -13.262   0.697
  301   3HG2  THR  44          HG21      THR  44  67.438 -11.775   0.337
  302    H    VAL  45           HN       VAL  45  68.991  -8.476   0.177
  303    HA   VAL  45           HA       VAL  45  66.154  -8.557   0.239
  304    HB   VAL  45           HB       VAL  45  67.912  -6.084   0.223
  305   1HG1  VAL  45          HG12      VAL  45  65.057  -6.672   0.928
  306   2HG1  VAL  45          HG11      VAL  45  65.921  -5.441   1.849
  307   3HG1  VAL  45          HG13      VAL  45  65.737  -5.270   0.102
  308   1HG2  VAL  45          HG22      VAL  45  68.569  -7.864   1.894
  309   2HG2  VAL  45          HG21      VAL  45  68.055  -6.342   2.623
  310   3HG2  VAL  45          HG23      VAL  45  66.955  -7.720   2.591
  311    H    MET  46           HN       MET  46  68.374  -7.027  -2.088
  312    HA   MET  46           HA       MET  46  66.306  -5.831  -3.691
  313   1HB   MET  46           HB2      MET  46  69.212  -6.315  -3.918
  314   2HB   MET  46           HB1      MET  46  68.353  -6.241  -5.458
  315   1HG   MET  46           HG2      MET  46  67.482  -4.060  -4.965
  316   2HG   MET  46           HG1      MET  46  68.029  -4.154  -3.291
  317   1HE   MET  46           HE1      MET  46  68.202  -2.379  -5.898
  318   2HE   MET  46           HE3      MET  46  69.835  -1.750  -6.152
  319   3HE   MET  46           HE2      MET  46  69.281  -3.163  -7.049
  320    H    ARG  47           HN       ARG  47  67.850  -9.009  -3.694
  321    HA   ARG  47           HA       ARG  47  66.901  -9.935  -6.208
  322   1HB   ARG  47           HB2      ARG  47  68.480 -11.025  -4.342
  323   2HB   ARG  47           HB1      ARG  47  66.975 -11.838  -3.909
  324   1HG   ARG  47           HG2      ARG  47  66.880 -12.159  -6.583
  325   2HG   ARG  47           HG1      ARG  47  68.630 -12.098  -6.369
  326   1HD   ARG  47           HD2      ARG  47  68.007 -14.404  -6.157
  327   2HD   ARG  47           HD1      ARG  47  68.346 -13.828  -4.525
  328    HE   ARG  47           HE       ARG  47  66.148 -14.559  -4.093
  329   1HH1  ARG  47          HH11      ARG  47  66.011 -14.863  -7.288
  330   2HH1  ARG  47          HH12      ARG  47  64.484 -14.091  -7.546
  331   1HH2  ARG  47          HH21      ARG  47  64.325 -12.749  -4.352
  332   2HH2  ARG  47          HH22      ARG  47  63.528 -12.894  -5.884
  333    H    MET  48           HN       MET  48  65.408 -10.143  -2.969
  334    HA   MET  48           HA       MET  48  63.011 -11.438  -3.944
  335   1HB   MET  48           HB2      MET  48  63.814 -10.083  -1.384
  336   2HB   MET  48           HB1      MET  48  62.119 -10.486  -1.662
  337   1HG   MET  48           HG2      MET  48  63.015 -12.843  -2.298
  338   2HG   MET  48           HG1      MET  48  64.484 -12.342  -1.462
  339   1HE   MET  48           HE3      MET  48  64.895 -11.957   0.580
  340   2HE   MET  48           HE2      MET  48  63.938 -12.217   2.036
  341   3HE   MET  48           HE1      MET  48  64.516 -13.601   1.112
  342    H    LEU  49           HN       LEU  49  64.095  -8.132  -3.741
  343    HA   LEU  49           HA       LEU  49  61.712  -7.268  -5.225
  344   1HB   LEU  49           HB2      LEU  49  61.339  -5.369  -3.538
  345   2HB   LEU  49           HB1      LEU  49  60.790  -6.972  -3.047
  346    HG   LEU  49           HG       LEU  49  63.599  -6.419  -2.367
  347   1HD1  LEU  49          HD12      LEU  49  61.397  -4.593  -1.527
  348   2HD1  LEU  49          HD11      LEU  49  62.536  -5.101  -0.280
  349   3HD1  LEU  49          HD13      LEU  49  63.119  -4.264  -1.718
  350   1HD2  LEU  49          HD22      LEU  49  61.174  -7.349  -0.794
  351   2HD2  LEU  49          HD21      LEU  49  62.349  -8.397  -1.587
  352   3HD2  LEU  49          HD23      LEU  49  62.841  -7.398  -0.219
  353    H    GLY  50           HN       GLY  50  63.629  -6.995  -6.697
  354   1HA   GLY  50           HA2      GLY  50  64.378  -4.297  -6.993
  355   2HA   GLY  50           HA1      GLY  50  65.691  -5.081  -6.114
  356    H    GLN  51           HN       GLN  51  67.225  -6.068  -7.339
  357    HA   GLN  51           HA       GLN  51  66.470  -7.165  -9.990
  358   1HB   GLN  51           HB2      GLN  51  68.922  -5.427  -9.736
  359   2HB   GLN  51           HB1      GLN  51  68.076  -5.930 -11.200
  360   1HG   GLN  51           HG2      GLN  51  66.249  -4.462 -10.772
  361   2HG   GLN  51           HG1      GLN  51  66.770  -4.180  -9.111
  362   1HE2  GLN  51          HE22      GLN  51  68.288  -1.219 -10.325
  363   2HE2  GLN  51          HE21      GLN  51  67.080  -1.882  -9.332
  364    H    ASN  52           HN       ASN  52  69.274  -7.554 -10.718
  365    HA   ASN  52           HA       ASN  52  70.334  -9.226  -8.512
  366   1HB   ASN  52           HB2      ASN  52  68.879 -10.296 -10.729
  367   2HB   ASN  52           HB1      ASN  52  70.572 -10.757 -10.911
  368   1HD2  ASN  52          HD22      ASN  52  70.552 -12.953  -8.130
  369   2HD2  ASN  52          HD21      ASN  52  71.498 -12.185  -9.310
  370    HA   PRO  53           HA       PRO  53  73.470  -7.051 -11.196
  371   1HB   PRO  53           HB2      PRO  53  74.332  -5.273  -9.283
  372   2HB   PRO  53           HB1      PRO  53  73.028  -4.921 -10.429
  373   1HG   PRO  53           HG2      PRO  53  72.848  -5.571  -7.524
  374   2HG   PRO  53           HG1      PRO  53  71.739  -4.630  -8.535
  375   1HD   PRO  53           HD2      PRO  53  71.358  -7.311  -7.710
  376   2HD   PRO  53           HD1      PRO  53  70.442  -6.468  -8.978
  377    H    THR  54           HN       THR  54  75.907  -6.733 -10.462
  378    HA   THR  54           HA       THR  54  76.652  -9.184  -8.997
  379    HB   THR  54           HB       THR  54  77.797  -8.608 -11.124
  380    HG1  THR  54           HG1      THR  54  79.674  -8.267  -9.064
  381   1HG2  THR  54          HG23      THR  54  77.652  -6.119 -10.746
  382   2HG2  THR  54          HG22      THR  54  78.964  -6.280  -9.579
  383   3HG2  THR  54          HG21      THR  54  79.238  -6.680 -11.275
  384    H    LYS  55           HN       LYS  55  78.532  -8.960  -7.396
  385    HA   LYS  55           HA       LYS  55  77.780  -7.373  -5.192
  386   1HB   LYS  55           HB2      LYS  55  80.065  -9.042  -5.929
  387   2HB   LYS  55           HB1      LYS  55  80.529  -7.687  -4.899
  388   1HG   LYS  55           HG2      LYS  55  79.848  -9.019  -3.191
  389   2HG   LYS  55           HG1      LYS  55  78.223  -8.537  -3.680
  390   1HD   LYS  55           HD2      LYS  55  78.115 -10.498  -5.197
  391   2HD   LYS  55           HD1      LYS  55  79.714 -10.996  -4.643
  392   1HE   LYS  55           HE2      LYS  55  78.723 -12.093  -2.946
  393   2HE   LYS  55           HE1      LYS  55  78.205 -10.533  -2.305
  394   1HZ   LYS  55           HZ1      LYS  55  76.445 -10.989  -4.307
  395   2HZ   LYS  55           HZ3      LYS  55  76.683 -12.547  -3.679
  396   3HZ   LYS  55           HZ2      LYS  55  76.156 -11.293  -2.660
  397    H    GLU  56           HN       GLU  56  80.337  -6.724  -7.610
  398    HA   GLU  56           HA       GLU  56  81.238  -4.260  -6.578
  399   1HB   GLU  56           HB2      GLU  56  82.367  -5.374  -8.440
  400   2HB   GLU  56           HB1      GLU  56  80.961  -5.118  -9.474
  401   1HG   GLU  56           HG2      GLU  56  81.297  -2.592  -8.858
  402   2HG   GLU  56           HG1      GLU  56  82.934  -3.100  -8.439
  403    H    GLU  57           HN       GLU  57  78.307  -5.013  -8.351
  404    HA   GLU  57           HA       GLU  57  77.661  -2.245  -8.967
  405   1HB   GLU  57           HB2      GLU  57  76.397  -4.893  -9.303
  406   2HB   GLU  57           HB1      GLU  57  75.266  -3.563  -9.064
  407   1HG   GLU  57           HG2      GLU  57  77.438  -2.884 -10.908
  408   2HG   GLU  57           HG1      GLU  57  76.460  -4.240 -11.472
  409    H    LEU  58           HN       LEU  58  76.787  -4.530  -6.391
  410    HA   LEU  58           HA       LEU  58  74.859  -2.769  -5.148
  411   1HB   LEU  58           HB2      LEU  58  75.574  -5.411  -4.827
  412   2HB   LEU  58           HB1      LEU  58  76.237  -4.666  -3.371
  413    HG   LEU  58           HG       LEU  58  73.706  -3.497  -3.689
  414   1HD1  LEU  58          HD11      LEU  58  73.716  -6.445  -4.358
  415   2HD1  LEU  58          HD13      LEU  58  72.302  -5.647  -3.670
  416   3HD1  LEU  58          HD12      LEU  58  72.930  -5.133  -5.234
  417   1HD2  LEU  58          HD21      LEU  58  75.213  -4.814  -1.745
  418   2HD2  LEU  58          HD23      LEU  58  73.627  -4.084  -1.504
  419   3HD2  LEU  58          HD22      LEU  58  73.758  -5.800  -1.889
  420    H    ASP  59           HN       ASP  59  78.344  -3.146  -4.904
  421    HA   ASP  59           HA       ASP  59  78.759  -1.792  -2.433
  422   1HB   ASP  59           HB2      ASP  59  80.369  -2.719  -4.633
  423   2HB   ASP  59           HB1      ASP  59  80.878  -1.090  -4.185
  424    H    ALA  60           HN       ALA  60  78.736  -0.487  -5.771
  425    HA   ALA  60           HA       ALA  60  79.137   2.233  -5.039
  426   1HB   ALA  60           HB2      ALA  60  78.640   0.800  -7.417
  427   2HB   ALA  60           HB1      ALA  60  77.350   1.998  -7.304
  428   3HB   ALA  60           HB3      ALA  60  79.037   2.512  -7.274
  429    H    ILE  61           HN       ILE  61  76.328   0.181  -4.894
  430    HA   ILE  61           HA       ILE  61  74.361   2.292  -4.698
  431    HB   ILE  61           HB       ILE  61  74.394  -0.645  -3.992
  432   1HG1  ILE  61          HG12      ILE  61  72.567   0.829  -5.886
  433   2HG1  ILE  61          HG11      ILE  61  74.188   0.344  -6.384
  434   1HG2  ILE  61          HG23      ILE  61  72.145   1.342  -3.558
  435   2HG2  ILE  61          HG22      ILE  61  71.955  -0.410  -3.504
  436   3HG2  ILE  61          HG21      ILE  61  72.971   0.404  -2.315
  437   1HD1  ILE  61          HD12      ILE  61  73.181  -1.937  -5.159
  438   2HD1  ILE  61          HD11      ILE  61  71.789  -1.291  -6.028
  439   3HD1  ILE  61          HD13      ILE  61  73.279  -1.660  -6.899
  440    H    ILE  62           HN       ILE  62  75.715   0.108  -2.199
  441    HA   ILE  62           HA       ILE  62  74.645   1.552   0.017
  442    HB   ILE  62           HB       ILE  62  76.995  -0.331  -0.272
  443   1HG1  ILE  62          HG12      ILE  62  74.685  -0.978   1.445
  444   2HG1  ILE  62          HG11      ILE  62  74.283  -0.778  -0.262
  445   1HG2  ILE  62          HG22      ILE  62  76.190   1.376   2.007
  446   2HG2  ILE  62          HG21      ILE  62  76.443  -0.326   2.395
  447   3HG2  ILE  62          HG23      ILE  62  77.743   0.613   1.661
  448   1HD1  ILE  62          HD12      ILE  62  76.213  -2.332  -0.793
  449   2HD1  ILE  62          HD11      ILE  62  76.329  -2.662   0.935
  450   3HD1  ILE  62          HD13      ILE  62  74.866  -3.091   0.052
  451    H    GLU  63           HN       GLU  63  77.120   2.395  -2.152
  452    HA   GLU  63           HA       GLU  63  78.881   3.823  -0.391
  453   1HB   GLU  63           HB2      GLU  63  79.451   3.174  -2.735
  454   2HB   GLU  63           HB1      GLU  63  78.302   4.379  -3.315
  455   1HG   GLU  63           HG2      GLU  63  79.642   6.035  -1.807
  456   2HG   GLU  63           HG1      GLU  63  80.904   4.804  -1.864
  457    H    GLU  64           HN       GLU  64  75.885   4.738  -2.056
  458    HA   GLU  64           HA       GLU  64  76.146   7.465  -0.873
  459   1HB   GLU  64           HB2      GLU  64  75.167   6.484  -3.397
  460   2HB   GLU  64           HB1      GLU  64  73.874   7.340  -2.556
  461   1HG   GLU  64           HG2      GLU  64  76.661   8.485  -2.822
  462   2HG   GLU  64           HG1      GLU  64  75.402   8.778  -4.020
  463    H    VAL  65           HN       VAL  65  74.528   4.500  -0.407
  464    HA   VAL  65           HA       VAL  65  72.054   5.604   0.665
  465    HB   VAL  65           HB       VAL  65  73.278   2.865   1.120
  466   1HG1  VAL  65          HG13      VAL  65  70.994   4.151   2.223
  467   2HG1  VAL  65          HG12      VAL  65  70.405   2.962   1.060
  468   3HG1  VAL  65          HG11      VAL  65  71.459   2.457   2.382
  469   1HG2  VAL  65          HG22      VAL  65  72.839   3.637  -1.305
  470   2HG2  VAL  65          HG21      VAL  65  72.100   2.120  -0.796
  471   3HG2  VAL  65          HG23      VAL  65  71.131   3.592  -0.876
  472    H    ASP  66           HN       ASP  66  75.008   4.215   2.129
  473    HA   ASP  66           HA       ASP  66  74.124   4.920   4.822
  474   1HB   ASP  66           HB2      ASP  66  76.073   3.219   3.718
  475   2HB   ASP  66           HB1      ASP  66  76.980   4.460   4.584
  476    H    GLU  67           HN       GLU  67  73.750   7.239   4.398
  477    HA   GLU  67           HA       GLU  67  75.886   9.000   3.613
  478   1HB   GLU  67           HB2      GLU  67  74.394  10.751   4.777
  479   2HB   GLU  67           HB1      GLU  67  73.689   9.878   3.415
  480   1HG   GLU  67           HG2      GLU  67  73.314   8.458   5.937
  481   2HG   GLU  67           HG1      GLU  67  72.597  10.069   5.971
  482    H    ASP  68           HN       ASP  68  74.837   7.695   6.718
  483    HA   ASP  68           HA       ASP  68  76.688   9.431   8.205
  484   1HB   ASP  68           HB2      ASP  68  75.950   7.900  10.139
  485   2HB   ASP  68           HB1      ASP  68  74.702   8.905   9.401
  486    H    GLY  69           HN       GLY  69  77.228   6.920   6.223
  487   1HA   GLY  69           HA2      GLY  69  78.831   5.193   6.126
  488   2HA   GLY  69           HA1      GLY  69  79.854   6.391   6.921
  489    H    SER  70           HN       SER  70  76.947   4.991   8.349
  490    HA   SER  70           HA       SER  70  78.459   4.210  10.720
  491   1HB   SER  70           HB2      SER  70  76.183   3.257  11.406
  492   2HB   SER  70           HB1      SER  70  76.241   4.994  11.117
  493    HG   SER  70           HG       SER  70  74.526   3.551  10.070
  494    H    GLY  71           HN       GLY  71  77.670   2.721   7.744
  495   1HA   GLY  71           HA2      GLY  71  78.403   0.593   6.990
  496   2HA   GLY  71           HA1      GLY  71  78.898   0.213   8.640
  497    H    THR  72           HN       THR  72  75.691   1.430   7.949
  498    HA   THR  72           HA       THR  72  74.502  -1.261   7.940
  499    HB   THR  72           HB       THR  72  73.043  -0.078   9.980
  500    HG1  THR  72           HG1      THR  72  74.577   1.480  10.350
  501   1HG2  THR  72          HG21      THR  72  75.139  -2.195   9.772
  502   2HG2  THR  72          HG23      THR  72  74.628  -1.698  11.386
  503   3HG2  THR  72          HG22      THR  72  73.446  -2.334  10.244
  504    H    ILE  73           HN       ILE  73  72.213  -1.177   7.412
  505    HA   ILE  73           HA       ILE  73  71.396   1.477   6.298
  506    HB   ILE  73           HB       ILE  73  70.482  -1.261   5.382
  507   1HG1  ILE  73          HG12      ILE  73  72.965  -0.741   5.055
  508   2HG1  ILE  73          HG11      ILE  73  72.058  -1.108   3.589
  509   1HG2  ILE  73          HG23      ILE  73  70.167   1.544   4.284
  510   2HG2  ILE  73          HG22      ILE  73  69.789   0.090   3.360
  511   3HG2  ILE  73          HG21      ILE  73  68.887   0.460   4.830
  512   1HD1  ILE  73          HD12      ILE  73  71.901   1.721   4.195
  513   2HD1  ILE  73          HD11      ILE  73  73.582   1.202   4.093
  514   3HD1  ILE  73          HD13      ILE  73  72.492   0.932   2.733
  515    H    ASP  74           HN       ASP  74  69.495   2.318   7.022
  516    HA   ASP  74           HA       ASP  74  67.903   0.656   8.918
  517   1HB   ASP  74           HB2      ASP  74  67.885   3.666   8.527
  518   2HB   ASP  74           HB1      ASP  74  67.064   2.771   9.807
  519    H    PHE  75           HN       PHE  75  65.456   1.452   8.874
  520    HA   PHE  75           HA       PHE  75  64.276   0.585   6.480
  521   1HB   PHE  75           HB2      PHE  75  63.201   1.008   8.801
  522   2HB   PHE  75           HB1      PHE  75  62.963   2.660   8.232
  523    HD1  PHE  75           HD2      PHE  75  62.807  -0.595   6.403
  524    HD2  PHE  75           HD1      PHE  75  60.677   2.885   7.736
  525    HE1  PHE  75           HE2      PHE  75  60.814  -1.324   5.119
  526    HE2  PHE  75           HE1      PHE  75  58.682   2.157   6.454
  527    HZ   PHE  75           HZ       PHE  75  58.751   0.052   5.146
  528    H    GLU  76           HN       GLU  76  64.567   3.993   7.562
  529    HA   GLU  76           HA       GLU  76  63.617   5.180   5.183
  530   1HB   GLU  76           HB2      GLU  76  64.669   7.213   5.941
  531   2HB   GLU  76           HB1      GLU  76  64.103   6.352   7.374
  532   1HG   GLU  76           HG2      GLU  76  66.535   5.276   7.253
  533   2HG   GLU  76           HG1      GLU  76  66.898   6.775   6.398
  534    H    GLU  77           HN       GLU  77  66.769   3.809   5.916
  535    HA   GLU  77           HA       GLU  77  68.087   5.000   3.609
  536   1HB   GLU  77           HB2      GLU  77  68.862   2.607   5.303
  537   2HB   GLU  77           HB1      GLU  77  69.906   3.405   4.128
  538   1HG   GLU  77           HG2      GLU  77  69.609   5.545   5.420
  539   2HG   GLU  77           HG1      GLU  77  68.752   4.618   6.655
  540    H    PHE  78           HN       PHE  78  66.249   2.066   4.215
  541    HA   PHE  78           HA       PHE  78  67.100   0.653   1.860
  542   1HB   PHE  78           HB2      PHE  78  66.049  -0.820   3.278
  543   2HB   PHE  78           HB1      PHE  78  64.943   0.401   3.894
  544    HD1  PHE  78           HD2      PHE  78  62.962   1.082   2.537
  545    HD2  PHE  78           HD1      PHE  78  65.438  -2.253   1.457
  546    HE1  PHE  78           HE2      PHE  78  61.164   0.232   1.045
  547    HE2  PHE  78           HE1      PHE  78  63.647  -3.105  -0.034
  548    HZ   PHE  78           HZ       PHE  78  61.509  -1.861  -0.239
  549    H    LEU  79           HN       LEU  79  64.468   2.936   2.543
  550    HA   LEU  79           HA       LEU  79  63.159   2.729   0.013
  551   1HB   LEU  79           HB2      LEU  79  63.396   5.189   1.776
  552   2HB   LEU  79           HB1      LEU  79  62.159   4.889   0.556
  553    HG   LEU  79           HG       LEU  79  62.616   3.180   3.019
  554   1HD1  LEU  79          HD13      LEU  79  60.589   5.327   2.359
  555   2HD1  LEU  79          HD12      LEU  79  60.330   4.135   3.632
  556   3HD1  LEU  79          HD11      LEU  79  61.682   5.262   3.741
  557   1HD2  LEU  79          HD22      LEU  79  61.705   2.018   0.985
  558   2HD2  LEU  79          HD21      LEU  79  60.578   2.040   2.342
  559   3HD2  LEU  79          HD23      LEU  79  60.357   3.156   0.993
  560    H    VAL  80           HN       VAL  80  66.026   4.467   1.071
  561    HA   VAL  80           HA       VAL  80  66.255   6.174  -1.246
  562    HB   VAL  80           HB       VAL  80  68.287   5.168   0.765
  563   1HG1  VAL  80          HG11      VAL  80  68.590   6.939  -1.653
  564   2HG1  VAL  80          HG13      VAL  80  69.630   7.160  -0.245
  565   3HG1  VAL  80          HG12      VAL  80  69.630   5.624  -1.110
  566   1HG2  VAL  80          HG23      VAL  80  66.370   6.864   1.311
  567   2HG2  VAL  80          HG22      VAL  80  68.016   7.248   1.817
  568   3HG2  VAL  80          HG21      VAL  80  67.339   7.999   0.371
  569    H    MET  81           HN       MET  81  67.446   2.937  -0.434
  570    HA   MET  81           HA       MET  81  69.110   2.600  -2.735
  571   1HB   MET  81           HB2      MET  81  69.316   1.115  -0.825
  572   2HB   MET  81           HB1      MET  81  67.646   0.579  -1.014
  573   1HG   MET  81           HG2      MET  81  68.116  -0.635  -2.955
  574   2HG   MET  81           HG1      MET  81  69.579   0.288  -3.296
  575   1HE   MET  81           HE3      MET  81  71.200   0.652  -1.518
  576   2HE   MET  81           HE2      MET  81  70.941  -0.040   0.081
  577   3HE   MET  81           HE1      MET  81  72.171  -0.724  -0.979
  578    H    MET  82           HN       MET  82  65.656   2.197  -2.202
  579    HA   MET  82           HA       MET  82  65.145   0.729  -4.643
  580   1HB   MET  82           HB2      MET  82  63.385   2.316  -2.765
  581   2HB   MET  82           HB1      MET  82  62.751   1.521  -4.205
  582   1HG   MET  82           HG2      MET  82  64.323   0.104  -2.037
  583   2HG   MET  82           HG1      MET  82  62.564   0.114  -2.140
  584   1HE   MET  82           HE2      MET  82  65.611  -1.357  -2.694
  585   2HE   MET  82           HE1      MET  82  65.461  -2.631  -3.903
  586   3HE   MET  82           HE3      MET  82  65.876  -0.981  -4.395
  587    H    VAL  83           HN       VAL  83  64.144   4.070  -3.815
  588    HA   VAL  83           HA       VAL  83  63.520   4.875  -6.434
  589    HB   VAL  83           HB       VAL  83  64.800   6.745  -4.440
  590   1HG1  VAL  83          HG13      VAL  83  63.755   7.196  -6.910
  591   2HG1  VAL  83          HG12      VAL  83  62.309   7.384  -5.917
  592   3HG1  VAL  83          HG11      VAL  83  63.727   8.389  -5.611
  593   1HG2  VAL  83          HG22      VAL  83  62.240   5.213  -4.258
  594   2HG2  VAL  83          HG21      VAL  83  63.312   5.762  -2.970
  595   3HG2  VAL  83          HG23      VAL  83  62.218   6.902  -3.753
  596    H    ARG  84           HN       ARG  84  66.655   5.190  -4.737
  597    HA   ARG  84           HA       ARG  84  68.060   6.499  -6.810
  598   1HB   ARG  84           HB2      ARG  84  70.062   5.821  -5.721
  599   2HB   ARG  84           HB1      ARG  84  68.867   5.965  -4.433
  600   1HG   ARG  84           HG2      ARG  84  68.534   3.584  -4.363
  601   2HG   ARG  84           HG1      ARG  84  69.478   3.350  -5.835
  602   1HD   ARG  84           HD2      ARG  84  70.506   4.306  -3.152
  603   2HD   ARG  84           HD1      ARG  84  70.884   2.781  -3.950
  604    HE   ARG  84           HE       ARG  84  71.659   4.775  -5.757
  605   1HH1  ARG  84          HH11      ARG  84  72.085   5.199  -2.489
  606   2HH1  ARG  84          HH12      ARG  84  73.816   5.176  -2.515
  607   1HH2  ARG  84          HH21      ARG  84  74.019   4.173  -5.828
  608   2HH2  ARG  84          HH22      ARG  84  74.912   4.605  -4.408
  609    H    GLN  85           HN       GLN  85  67.322   3.063  -6.378
  610    HA   GLN  85           HA       GLN  85  68.531   2.576  -9.072
  611   1HB   GLN  85           HB2      GLN  85  68.543   1.010  -6.547
  612   2HB   GLN  85           HB1      GLN  85  68.321   0.084  -8.032
  613   1HG   GLN  85           HG2      GLN  85  70.573   2.047  -7.498
  614   2HG   GLN  85           HG1      GLN  85  70.716   0.288  -7.478
  615   1HE2  GLN  85          HE22      GLN  85  71.717   1.495 -10.880
  616   2HE2  GLN  85          HE21      GLN  85  72.286   1.771  -9.304
  617    H    MET  86           HN       MET  86  65.800   3.532  -8.476
  618    HA   MET  86           HA       MET  86  64.103   1.177  -9.043
  619   1HB   MET  86           HB2      MET  86  63.678   3.952  -8.118
  620   2HB   MET  86           HB1      MET  86  62.436   3.339  -9.209
  621   1HG   MET  86           HG2      MET  86  63.074   1.263  -7.352
  622   2HG   MET  86           HG1      MET  86  62.788   2.745  -6.438
  623   1HE   MET  86           HE1      MET  86  61.164   2.912  -5.427
  624   2HE   MET  86           HE3      MET  86  59.594   3.395  -6.084
  625   3HE   MET  86           HE2      MET  86  59.836   1.757  -5.482
  626    H    LYS  87           HN       LYS  87  65.147   4.198 -10.602
  627    HA   LYS  87           HA       LYS  87  64.681   2.954 -13.232
  628   1HB   LYS  87           HB2      LYS  87  63.378   5.000 -13.992
  629   2HB   LYS  87           HB1      LYS  87  62.509   3.925 -12.897
  630   1HG   LYS  87           HG2      LYS  87  63.346   5.413 -10.994
  631   2HG   LYS  87           HG1      LYS  87  63.835   6.562 -12.241
  632   1HD   LYS  87           HD2      LYS  87  61.562   7.050 -11.341
  633   2HD   LYS  87           HD1      LYS  87  61.541   6.696 -13.069
  634   1HE   LYS  87           HE2      LYS  87  61.238   4.345 -11.297
  635   2HE   LYS  87           HE1      LYS  87  59.895   5.487 -11.268
  636   1HZ   LYS  87           HZ2      LYS  87  60.954   4.823 -13.891
  637   2HZ   LYS  87           HZ1      LYS  87  60.138   3.571 -13.084
  638   3HZ   LYS  87           HZ3      LYS  87  59.346   5.039 -13.388
  639    H    GLU  88           HN       GLU  88  67.019   3.869 -11.738
  640    HA   GLU  88           HA       GLU  88  67.832   6.318 -13.207
  641   1HB   GLU  88           HB2      GLU  88  68.761   4.897 -10.761
  642   2HB   GLU  88           HB1      GLU  88  69.996   5.724 -11.712
  643   1HG   GLU  88           HG2      GLU  88  67.676   7.416 -11.489
  644   2HG   GLU  88           HG1      GLU  88  68.167   6.883  -9.881
  645    H    ASP  89           HN       ASP  89  69.033   6.136 -15.036
  646    HA   ASP  89           HA       ASP  89  70.346   3.505 -15.577
  647   1HB   ASP  89           HB2      ASP  89  68.553   4.247 -17.176
  648   2HB   ASP  89           HB1      ASP  89  69.555   5.643 -17.576
  649    H    ALA  90           HN       ALA  90  72.488   3.649 -15.090
  650    HA   ALA  90           HA       ALA  90  74.169   5.573 -16.448
  651   1HB   ALA  90           HB3      ALA  90  73.108   6.802 -14.389
  652   2HB   ALA  90           HB2      ALA  90  74.258   5.845 -13.454
  653   3HB   ALA  90           HB1      ALA  90  74.839   6.965 -14.687
   
  No H/Q in entry =         653
  Start of MODEL   15
    1   1H    ALA   1           HT3      ALA   1  67.161  14.903  16.137
    2   2H    ALA   1           HT2      ALA   1  66.830  16.494  16.627
    3   3H    ALA   1           HT1      ALA   1  65.580  15.346  16.557
    4    HA   ALA   1           HA       ALA   1  65.218  15.684  14.402
    5   1HB   ALA   1           HB2      ALA   1  67.191  17.941  14.881
    6   2HB   ALA   1           HB1      ALA   1  66.064  17.846  13.528
    7   3HB   ALA   1           HB3      ALA   1  65.453  18.006  15.175
    8    H    SER   2           HN       SER   2  65.894  14.691  12.555
    9    HA   SER   2           HA       SER   2  68.515  14.911  11.444
   10   1HB   SER   2           HB2      SER   2  69.014  12.353  11.877
   11   2HB   SER   2           HB1      SER   2  69.477  13.559  13.077
   12    HG   SER   2           HG       SER   2  67.132  11.952  13.039
   13    H    MET   3           HN       MET   3  68.167  14.526   9.313
   14    HA   MET   3           HA       MET   3  66.689  12.193   8.396
   15   1HB   MET   3           HB2      MET   3  65.006  14.152   9.072
   16   2HB   MET   3           HB1      MET   3  65.448  14.752   7.473
   17   1HG   MET   3           HG2      MET   3  63.994  13.287   6.577
   18   2HG   MET   3           HG1      MET   3  65.011  11.977   7.171
   19   1HE   MET   3           HE1      MET   3  65.198  11.347   9.340
   20   2HE   MET   3           HE3      MET   3  64.048  11.496  10.674
   21   3HE   MET   3           HE2      MET   3  63.833  10.240   9.458
   22    H    THR   4           HN       THR   4  68.498  11.770   7.098
   23    HA   THR   4           HA       THR   4  70.025  13.559   5.594
   24    HB   THR   4           HB       THR   4  70.500  11.657   4.076
   25    HG1  THR   4           HG1      THR   4  68.916  10.334   3.780
   26   1HG2  THR   4          HG23      THR   4  70.291  11.040   7.032
   27   2HG2  THR   4          HG22      THR   4  71.143  10.003   5.888
   28   3HG2  THR   4          HG21      THR   4  71.694  11.658   6.160
   29    H    ASP   5           HN       ASP   5  69.772  14.590   3.610
   30    HA   ASP   5           HA       ASP   5  67.135  15.210   2.718
   31   1HB   ASP   5           HB2      ASP   5  68.403  16.041   0.627
   32   2HB   ASP   5           HB1      ASP   5  68.823  16.782   2.173
   33    H    GLN   6           HN       GLN   6  69.268  12.574   1.968
   34    HA   GLN   6           HA       GLN   6  68.234  11.831  -0.585
   35   1HB   GLN   6           HB2      GLN   6  69.506  10.257   1.658
   36   2HB   GLN   6           HB1      GLN   6  68.984   9.483   0.161
   37   1HG   GLN   6           HG2      GLN   6  70.572  11.946  -0.211
   38   2HG   GLN   6           HG1      GLN   6  71.453  10.603   0.518
   39   1HE2  GLN   6          HE22      GLN   6  70.550   8.482  -2.435
   40   2HE2  GLN   6          HE21      GLN   6  70.234   8.402  -0.768
   41    H    GLN   7           HN       GLN   7  67.058  11.247   2.693
   42    HA   GLN   7           HA       GLN   7  65.024   9.338   1.875
   43   1HB   GLN   7           HB2      GLN   7  65.325  11.006   4.390
   44   2HB   GLN   7           HB1      GLN   7  64.115   9.740   4.172
   45   1HG   GLN   7           HG2      GLN   7  65.674   8.039   4.264
   46   2HG   GLN   7           HG1      GLN   7  66.967   9.048   3.614
   47   1HE2  GLN   7          HE22      GLN   7  67.926   8.777   7.118
   48   2HE2  GLN   7          HE21      GLN   7  68.016   7.891   5.672
   49    H    ALA   8           HN       ALA   8  65.304  12.765   1.786
   50    HA   ALA   8           HA       ALA   8  62.492  13.407   1.979
   51   1HB   ALA   8           HB1      ALA   8  64.897  14.865   0.874
   52   2HB   ALA   8           HB3      ALA   8  63.273  15.546   0.775
   53   3HB   ALA   8           HB2      ALA   8  63.994  15.210   2.350
   54    H    GLU   9           HN       GLU   9  64.674  12.658  -0.722
   55    HA   GLU   9           HA       GLU   9  62.520  13.081  -2.683
   56   1HB   GLU   9           HB2      GLU   9  65.429  12.372  -2.799
   57   2HB   GLU   9           HB1      GLU   9  64.408  11.968  -4.180
   58   1HG   GLU   9           HG2      GLU   9  64.883  14.107  -4.824
   59   2HG   GLU   9           HG1      GLU   9  63.588  14.515  -3.699
   60    H    ALA  10           HN       ALA  10  64.228  10.365  -1.172
   61    HA   ALA  10           HA       ALA  10  63.078   8.302  -2.793
   62   1HB   ALA  10           HB3      ALA  10  64.131   8.284   0.047
   63   2HB   ALA  10           HB2      ALA  10  63.621   6.826  -0.806
   64   3HB   ALA  10           HB1      ALA  10  64.980   7.775  -1.411
   65    H    ARG  11           HN       ARG  11  62.139   9.412   0.487
   66    HA   ARG  11           HA       ARG  11  59.721   7.860   0.545
   67   1HB   ARG  11           HB2      ARG  11  60.895   8.850   2.553
   68   2HB   ARG  11           HB1      ARG  11  60.272  10.425   2.061
   69   1HG   ARG  11           HG2      ARG  11  58.022   9.769   2.400
   70   2HG   ARG  11           HG1      ARG  11  58.441   8.056   2.436
   71   1HD   ARG  11           HD2      ARG  11  59.176   8.139   4.613
   72   2HD   ARG  11           HD1      ARG  11  59.736   9.805   4.470
   73    HE   ARG  11           HE       ARG  11  57.039   8.957   5.242
   74   1HH1  ARG  11          HH11      ARG  11  56.576  10.899   3.056
   75   2HH1  ARG  11          HH12      ARG  11  56.608  12.420   3.882
   76   1HH2  ARG  11          HH21      ARG  11  58.158  11.153   6.713
   77   2HH2  ARG  11          HH22      ARG  11  57.504  12.565   5.951
   78    H    ALA  12           HN       ALA  12  60.487  11.091  -0.640
   79    HA   ALA  12           HA       ALA  12  57.815  12.063  -0.898
   80   1HB   ALA  12           HB3      ALA  12  60.465  12.736  -2.068
   81   2HB   ALA  12           HB2      ALA  12  59.048  13.291  -2.960
   82   3HB   ALA  12           HB1      ALA  12  59.283  13.783  -1.283
   83    H    PHE  13           HN       PHE  13  59.730   9.883  -2.882
   84    HA   PHE  13           HA       PHE  13  57.755   9.943  -5.069
   85   1HB   PHE  13           HB2      PHE  13  60.261   9.674  -5.419
   86   2HB   PHE  13           HB1      PHE  13  60.097   8.056  -4.736
   87    HD1  PHE  13           HD1      PHE  13  58.271  10.203  -7.221
   88    HD2  PHE  13           HD2      PHE  13  59.877   6.335  -6.276
   89    HE1  PHE  13           HE1      PHE  13  57.510   9.350  -9.422
   90    HE2  PHE  13           HE2      PHE  13  59.116   5.480  -8.477
   91    HZ   PHE  13           HZ       PHE  13  57.933   6.988 -10.050
   92    H    LEU  14           HN       LEU  14  58.636   7.917  -2.331
   93    HA   LEU  14           HA       LEU  14  56.742   5.813  -3.207
   94   1HB   LEU  14           HB2      LEU  14  58.390   5.902  -0.666
   95   2HB   LEU  14           HB1      LEU  14  57.637   4.489  -1.410
   96    HG   LEU  14           HG       LEU  14  59.683   6.138  -2.894
   97   1HD1  LEU  14          HD13      LEU  14  60.119   3.883  -0.923
   98   2HD1  LEU  14          HD12      LEU  14  61.301   4.301  -2.164
   99   3HD1  LEU  14          HD11      LEU  14  60.868   5.479  -0.924
  100   1HD2  LEU  14          HD22      LEU  14  58.376   3.445  -3.155
  101   2HD2  LEU  14          HD21      LEU  14  58.637   4.681  -4.387
  102   3HD2  LEU  14          HD23      LEU  14  59.987   3.691  -3.833
  103    H    SER  15           HN       SER  15  54.728   5.577  -2.314
  104    HA   SER  15           HA       SER  15  53.882   7.623  -0.338
  105   1HB   SER  15           HB2      SER  15  51.630   7.086  -0.985
  106   2HB   SER  15           HB1      SER  15  52.573   7.176  -2.470
  107    HG   SER  15           HG       SER  15  52.717   4.922  -2.447
  108    H    GLU  16           HN       GLU  16  52.153   6.679   1.290
  109    HA   GLU  16           HA       GLU  16  53.485   4.872   3.030
  110   1HB   GLU  16           HB2      GLU  16  51.863   6.276   4.025
  111   2HB   GLU  16           HB1      GLU  16  50.635   5.850   2.834
  112   1HG   GLU  16           HG2      GLU  16  50.233   3.761   3.803
  113   2HG   GLU  16           HG1      GLU  16  51.794   3.729   4.618
  114    H    GLU  17           HN       GLU  17  51.411   4.326   0.289
  115    HA   GLU  17           HA       GLU  17  50.598   1.641   0.958
  116   1HB   GLU  17           HB2      GLU  17  50.573   3.368  -1.464
  117   2HB   GLU  17           HB1      GLU  17  50.519   1.626  -1.741
  118   1HG   GLU  17           HG2      GLU  17  48.739   2.109   0.390
  119   2HG   GLU  17           HG1      GLU  17  48.421   3.379  -0.792
  120    H    MET  18           HN       MET  18  53.183   2.887  -1.188
  121    HA   MET  18           HA       MET  18  54.284   0.265  -1.689
  122   1HB   MET  18           HB2      MET  18  54.613   2.373  -3.100
  123   2HB   MET  18           HB1      MET  18  55.786   2.882  -1.883
  124   1HG   MET  18           HG2      MET  18  57.324   1.312  -2.514
  125   2HG   MET  18           HG1      MET  18  56.090   0.107  -2.886
  126   1HE   MET  18           HE3      MET  18  58.207  -0.127  -4.566
  127   2HE   MET  18           HE2      MET  18  56.730  -0.781  -5.268
  128   3HE   MET  18           HE1      MET  18  57.803   0.206  -6.254
  129    H    ILE  19           HN       ILE  19  55.568   2.988   0.266
  130    HA   ILE  19           HA       ILE  19  57.738   1.742   1.453
  131    HB   ILE  19           HB       ILE  19  55.715   3.641   2.664
  132   1HG1  ILE  19          HG12      ILE  19  58.481   4.511   2.282
  133   2HG1  ILE  19          HG11      ILE  19  57.734   3.979   0.774
  134   1HG2  ILE  19          HG23      ILE  19  58.366   2.703   3.806
  135   2HG2  ILE  19          HG22      ILE  19  57.388   4.018   4.457
  136   3HG2  ILE  19          HG21      ILE  19  56.772   2.365   4.482
  137   1HD1  ILE  19          HD12      ILE  19  55.723   5.460   1.976
  138   2HD1  ILE  19          HD11      ILE  19  57.182   6.364   2.383
  139   3HD1  ILE  19          HD13      ILE  19  56.792   6.033   0.695
  140    H    ALA  20           HN       ALA  20  54.327   1.449   2.448
  141    HA   ALA  20           HA       ALA  20  54.609  -0.084   4.764
  142   1HB   ALA  20           HB2      ALA  20  52.557  -0.072   2.568
  143   2HB   ALA  20           HB1      ALA  20  52.443  -1.262   3.864
  144   3HB   ALA  20           HB3      ALA  20  52.397   0.460   4.241
  145    H    GLU  21           HN       GLU  21  54.490  -1.305   1.401
  146    HA   GLU  21           HA       GLU  21  54.883  -4.051   2.085
  147   1HB   GLU  21           HB2      GLU  21  55.788  -2.662  -0.453
  148   2HB   GLU  21           HB1      GLU  21  55.434  -4.378  -0.253
  149   1HG   GLU  21           HG2      GLU  21  53.080  -3.542   0.526
  150   2HG   GLU  21           HG1      GLU  21  53.528  -2.052  -0.308
  151    H    PHE  22           HN       PHE  22  57.261  -1.621   0.949
  152    HA   PHE  22           HA       PHE  22  59.572  -3.200   1.128
  153   1HB   PHE  22           HB2      PHE  22  59.145  -0.254   1.655
  154   2HB   PHE  22           HB1      PHE  22  60.746  -0.991   1.669
  155    HD1  PHE  22           HD1      PHE  22  60.506  -3.008  -0.477
  156    HD2  PHE  22           HD2      PHE  22  59.094   1.046  -0.313
  157    HE1  PHE  22           HE1      PHE  22  60.590  -2.879  -2.952
  158    HE2  PHE  22           HE2      PHE  22  59.178   1.174  -2.789
  159    HZ   PHE  22           HZ       PHE  22  59.925  -0.788  -4.108
  160    H    LYS  23           HN       LYS  23  57.568  -2.012   3.691
  161    HA   LYS  23           HA       LYS  23  59.504  -2.014   5.806
  162   1HB   LYS  23           HB2      LYS  23  57.322  -0.971   6.117
  163   2HB   LYS  23           HB1      LYS  23  56.516  -2.521   5.872
  164   1HG   LYS  23           HG2      LYS  23  56.642  -2.112   8.254
  165   2HG   LYS  23           HG1      LYS  23  57.768  -3.412   7.860
  166   1HD   LYS  23           HD2      LYS  23  59.210  -2.118   9.088
  167   2HD   LYS  23           HD1      LYS  23  59.414  -1.300   7.537
  168   1HE   LYS  23           HE2      LYS  23  58.827   0.569   8.689
  169   2HE   LYS  23           HE1      LYS  23  57.184  -0.049   8.524
  170   1HZ   LYS  23           HZ3      LYS  23  57.494  -1.230  10.639
  171   2HZ   LYS  23           HZ2      LYS  23  59.026  -0.516  10.805
  172   3HZ   LYS  23           HZ1      LYS  23  57.631   0.451  10.815
  173    H    ALA  24           HN       ALA  24  57.191  -4.528   4.757
  174    HA   ALA  24           HA       ALA  24  57.968  -6.526   6.600
  175   1HB   ALA  24           HB1      ALA  24  56.699  -6.509   3.899
  176   2HB   ALA  24           HB3      ALA  24  57.309  -8.050   4.504
  177   3HB   ALA  24           HB2      ALA  24  56.092  -7.162   5.422
  178    H    ALA  25           HN       ALA  25  59.561  -5.380   3.700
  179    HA   ALA  25           HA       ALA  25  61.341  -7.673   3.462
  180   1HB   ALA  25           HB3      ALA  25  60.646  -5.709   1.744
  181   2HB   ALA  25           HB2      ALA  25  62.163  -5.042   2.350
  182   3HB   ALA  25           HB1      ALA  25  62.141  -6.630   1.585
  183    H    PHE  26           HN       PHE  26  61.710  -4.333   4.688
  184    HA   PHE  26           HA       PHE  26  64.420  -4.560   5.483
  185   1HB   PHE  26           HB2      PHE  26  63.430  -2.388   5.450
  186   2HB   PHE  26           HB1      PHE  26  62.120  -2.890   6.519
  187    HD1  PHE  26           HD1      PHE  26  65.788  -3.537   6.745
  188    HD2  PHE  26           HD2      PHE  26  62.362  -1.621   8.470
  189    HE1  PHE  26           HE1      PHE  26  67.150  -2.888   8.719
  190    HE2  PHE  26           HE2      PHE  26  63.717  -0.970  10.449
  191    HZ   PHE  26           HZ       PHE  26  66.111  -1.606  10.570
  192    H    ASP  27           HN       ASP  27  61.583  -4.682   7.672
  193    HA   ASP  27           HA       ASP  27  62.968  -5.743   9.895
  194   1HB   ASP  27           HB2      ASP  27  60.095  -5.781   9.019
  195   2HB   ASP  27           HB1      ASP  27  60.584  -6.725  10.427
  196    H    MET  28           HN       MET  28  62.130  -7.274   6.932
  197    HA   MET  28           HA       MET  28  61.947  -9.978   7.940
  198   1HB   MET  28           HB2      MET  28  61.005  -9.906   5.846
  199   2HB   MET  28           HB1      MET  28  62.088  -8.635   5.289
  200   1HG   MET  28           HG2      MET  28  62.547 -10.719   4.087
  201   2HG   MET  28           HG1      MET  28  63.918 -10.295   5.110
  202   1HE   MET  28           HE1      MET  28  65.067 -11.638   6.132
  203   2HE   MET  28           HE3      MET  28  64.710 -13.175   6.932
  204   3HE   MET  28           HE2      MET  28  64.829 -13.100   5.177
  205    H    PHE  29           HN       PHE  29  64.569  -8.164   6.293
  206    HA   PHE  29           HA       PHE  29  66.487 -10.303   6.841
  207   1HB   PHE  29           HB2      PHE  29  66.782  -7.502   5.725
  208   2HB   PHE  29           HB1      PHE  29  68.143  -8.603   5.942
  209    HD1  PHE  29           HD2      PHE  29  64.924  -8.101   4.172
  210    HD2  PHE  29           HD1      PHE  29  68.489 -10.475   4.472
  211    HE1  PHE  29           HE2      PHE  29  64.364  -9.211   2.026
  212    HE2  PHE  29           HE1      PHE  29  67.931 -11.586   2.327
  213    HZ   PHE  29           HZ       PHE  29  65.868 -10.954   1.103
  214    H    ASP  30           HN       ASP  30  65.091  -7.998   8.768
  215    HA   ASP  30           HA       ASP  30  67.558  -7.657  10.419
  216   1HB   ASP  30           HB2      ASP  30  66.104  -5.642   9.565
  217   2HB   ASP  30           HB1      ASP  30  65.019  -6.113  10.873
  218    H    ALA  31           HN       ALA  31  66.468 -10.139  10.644
  219    HA   ALA  31           HA       ALA  31  64.404 -10.294  12.679
  220   1HB   ALA  31           HB3      ALA  31  65.845 -12.121  11.000
  221   2HB   ALA  31           HB2      ALA  31  65.961 -12.677  12.669
  222   3HB   ALA  31           HB1      ALA  31  64.380 -12.416  11.935
  223    H    ASP  32           HN       ASP  32  67.654  -9.429  12.811
  224    HA   ASP  32           HA       ASP  32  68.353 -10.664  15.343
  225   1HB   ASP  32           HB2      ASP  32  69.552  -8.162  14.130
  226   2HB   ASP  32           HB1      ASP  32  70.309  -9.264  15.279
  227    H    GLY  33           HN       GLY  33  66.812  -7.653  14.363
  228   1HA   GLY  33           HA2      GLY  33  65.369  -6.359  15.769
  229   2HA   GLY  33           HA1      GLY  33  66.017  -7.207  17.173
  230    H    GLY  34           HN       GLY  34  68.500  -6.217  15.107
  231   1HA   GLY  34           HA2      GLY  34  69.518  -4.328  17.046
  232   2HA   GLY  34           HA1      GLY  34  70.211  -4.640  15.454
  233    H    GLY  35           HN       GLY  35  67.312  -4.062  14.431
  234   1HA   GLY  35           HA2      GLY  35  65.989  -2.064  14.090
  235   2HA   GLY  35           HA1      GLY  35  67.305  -1.111  14.776
  236    H    ASP  36           HN       ASP  36  68.754  -3.289  12.772
  237    HA   ASP  36           HA       ASP  36  68.237  -2.053  10.194
  238   1HB   ASP  36           HB2      ASP  36  70.749  -1.279  10.094
  239   2HB   ASP  36           HB1      ASP  36  69.544  -0.220  10.826
  240    H    ILE  37           HN       ILE  37  69.360  -3.187   8.500
  241    HA   ILE  37           HA       ILE  37  70.596  -5.728   9.452
  242    HB   ILE  37           HB       ILE  37  68.934  -6.532   8.130
  243   1HG1  ILE  37          HG12      ILE  37  71.212  -6.833   6.862
  244   2HG1  ILE  37          HG11      ILE  37  69.708  -7.247   6.053
  245   1HG2  ILE  37          HG23      ILE  37  67.941  -4.292   7.806
  246   2HG2  ILE  37          HG22      ILE  37  69.035  -4.014   6.452
  247   3HG2  ILE  37          HG21      ILE  37  67.812  -5.280   6.351
  248   1HD1  ILE  37          HD12      ILE  37  69.686  -4.974   5.012
  249   2HD1  ILE  37          HD11      ILE  37  71.262  -4.659   5.737
  250   3HD1  ILE  37          HD13      ILE  37  71.085  -5.934   4.534
  251    H    SER  38           HN       SER  38  72.441  -6.534   8.253
  252    HA   SER  38           HA       SER  38  74.374  -4.433   7.701
  253   1HB   SER  38           HB2      SER  38  74.762  -7.338   6.999
  254   2HB   SER  38           HB1      SER  38  75.967  -6.161   7.520
  255    HG   SER  38           HG       SER  38  75.498  -6.622   9.513
  256    H    THR  39           HN       THR  39  75.133  -3.748   5.698
  257    HA   THR  39           HA       THR  39  73.434  -3.920   3.435
  258    HB   THR  39           HB       THR  39  75.296  -2.938   2.176
  259    HG1  THR  39           HG1      THR  39  76.723  -4.004   4.331
  260   1HG2  THR  39          HG21      THR  39  74.667  -2.001   4.941
  261   2HG2  THR  39          HG23      THR  39  75.960  -1.182   4.066
  262   3HG2  THR  39          HG22      THR  39  74.331  -1.230   3.392
  263    H    LYS  40           HN       LYS  40  75.793  -6.138   4.649
  264    HA   LYS  40           HA       LYS  40  76.489  -7.492   2.232
  265   1HB   LYS  40           HB2      LYS  40  76.373  -8.315   5.128
  266   2HB   LYS  40           HB1      LYS  40  76.753  -9.497   3.877
  267   1HG   LYS  40           HG2      LYS  40  78.771  -8.508   3.356
  268   2HG   LYS  40           HG1      LYS  40  78.217  -6.896   3.811
  269   1HD   LYS  40           HD2      LYS  40  79.133  -7.132   5.849
  270   2HD   LYS  40           HD1      LYS  40  78.156  -8.574   6.137
  271   1HE   LYS  40           HE2      LYS  40  80.202  -9.326   4.324
  272   2HE   LYS  40           HE1      LYS  40  80.978  -8.398   5.607
  273   1HZ   LYS  40           HZ2      LYS  40  79.089 -10.086   6.780
  274   2HZ   LYS  40           HZ1      LYS  40  80.009 -11.026   5.704
  275   3HZ   LYS  40           HZ3      LYS  40  80.781 -10.144   6.929
  276    H    ALA  41           HN       ALA  41  73.838  -8.043   4.556
  277    HA   ALA  41           HA       ALA  41  72.712 -10.243   3.037
  278   1HB   ALA  41           HB2      ALA  41  71.982  -8.666   5.438
  279   2HB   ALA  41           HB1      ALA  41  70.625  -9.342   4.537
  280   3HB   ALA  41           HB3      ALA  41  71.885 -10.405   5.162
  281    H    LEU  42           HN       LEU  42  72.570  -6.801   2.804
  282    HA   LEU  42           HA       LEU  42  70.041  -6.392   1.619
  283   1HB   LEU  42           HB2      LEU  42  72.370  -4.870   2.021
  284   2HB   LEU  42           HB1      LEU  42  72.098  -4.837   0.279
  285    HG   LEU  42           HG       LEU  42  69.868  -3.981   0.559
  286   1HD1  LEU  42          HD12      LEU  42  70.063  -5.269   3.096
  287   2HD1  LEU  42          HD11      LEU  42  69.727  -3.563   3.391
  288   3HD1  LEU  42          HD13      LEU  42  68.644  -4.511   2.372
  289   1HD2  LEU  42          HD22      LEU  42  71.766  -2.363   0.814
  290   2HD2  LEU  42          HD21      LEU  42  70.307  -1.860   1.669
  291   3HD2  LEU  42          HD23      LEU  42  71.653  -2.567   2.564
  292    H    GLY  43           HN       GLY  43  72.980  -7.781   0.269
  293   1HA   GLY  43           HA2      GLY  43  72.379  -7.627  -2.487
  294   2HA   GLY  43           HA1      GLY  43  73.288  -8.950  -1.749
  295    H    THR  44           HN       THR  44  71.355 -10.030  -0.065
  296    HA   THR  44           HA       THR  44  69.734 -11.522  -1.965
  297    HB   THR  44           HB       THR  44  69.988 -11.517   1.048
  298    HG1  THR  44           HG1      THR  44  70.334 -13.715  -0.637
  299   1HG2  THR  44          HG22      THR  44  68.134 -13.210  -0.652
  300   2HG2  THR  44          HG21      THR  44  68.442 -13.448   1.067
  301   3HG2  THR  44          HG23      THR  44  67.633 -11.983   0.513
  302    H    VAL  45           HN       VAL  45  69.312  -8.708   0.005
  303    HA   VAL  45           HA       VAL  45  66.432  -8.774   0.187
  304    HB   VAL  45           HB       VAL  45  68.479  -6.559   0.428
  305   1HG1  VAL  45          HG11      VAL  45  66.328  -5.647  -0.430
  306   2HG1  VAL  45          HG13      VAL  45  65.494  -6.392   0.932
  307   3HG1  VAL  45          HG12      VAL  45  66.673  -5.111   1.215
  308   1HG2  VAL  45          HG21      VAL  45  67.560  -8.587   2.160
  309   2HG2  VAL  45          HG23      VAL  45  68.553  -7.194   2.589
  310   3HG2  VAL  45          HG22      VAL  45  66.796  -7.100   2.720
  311    H    MET  46           HN       MET  46  68.722  -7.535  -2.199
  312    HA   MET  46           HA       MET  46  66.818  -6.011  -3.721
  313   1HB   MET  46           HB2      MET  46  69.531  -7.180  -4.275
  314   2HB   MET  46           HB1      MET  46  68.584  -6.508  -5.602
  315   1HG   MET  46           HG2      MET  46  68.440  -4.679  -3.414
  316   2HG   MET  46           HG1      MET  46  70.135  -5.103  -3.654
  317   1HE   MET  46           HE3      MET  46  68.220  -2.552  -3.956
  318   2HE   MET  46           HE2      MET  46  68.151  -1.859  -5.574
  319   3HE   MET  46           HE1      MET  46  67.033  -3.143  -5.125
  320    H    ARG  47           HN       ARG  47  67.846  -9.400  -3.820
  321    HA   ARG  47           HA       ARG  47  66.249  -9.960  -6.210
  322   1HB   ARG  47           HB2      ARG  47  66.895 -12.316  -5.773
  323   2HB   ARG  47           HB1      ARG  47  68.295 -11.245  -5.774
  324   1HG   ARG  47           HG2      ARG  47  68.545 -11.346  -3.451
  325   2HG   ARG  47           HG1      ARG  47  66.865 -11.821  -3.194
  326   1HD   ARG  47           HD2      ARG  47  68.090 -13.813  -2.830
  327   2HD   ARG  47           HD1      ARG  47  67.477 -13.979  -4.475
  328    HE   ARG  47           HE       ARG  47  69.708 -13.951  -5.218
  329   1HH1  ARG  47          HH21      ARG  47  70.591 -11.314  -4.509
  330   2HH1  ARG  47          HH22      ARG  47  71.764 -11.568  -3.260
  331   1HH2  ARG  47          HH11      ARG  47  70.716 -14.802  -2.569
  332   2HH2  ARG  47          HH12      ARG  47  71.836 -13.543  -2.163
  333    H    MET  48           HN       MET  48  65.831 -10.129  -2.732
  334    HA   MET  48           HA       MET  48  63.584 -11.903  -2.681
  335   1HB   MET  48           HB2      MET  48  65.031 -10.301  -0.814
  336   2HB   MET  48           HB1      MET  48  63.317  -9.919  -0.635
  337   1HG   MET  48           HG2      MET  48  64.233 -12.781  -0.827
  338   2HG   MET  48           HG1      MET  48  64.280 -11.927   0.714
  339   1HE   MET  48           HE3      MET  48  62.586 -10.408   1.375
  340   2HE   MET  48           HE2      MET  48  60.842 -10.624   1.250
  341   3HE   MET  48           HE1      MET  48  61.784 -11.703   2.276
  342    H    LEU  49           HN       LEU  49  63.673  -8.321  -2.591
  343    HA   LEU  49           HA       LEU  49  60.876  -7.919  -2.768
  344   1HB   LEU  49           HB2      LEU  49  62.967  -6.145  -4.054
  345   2HB   LEU  49           HB1      LEU  49  61.383  -5.667  -3.442
  346    HG   LEU  49           HG       LEU  49  63.754  -6.629  -1.820
  347   1HD1  LEU  49          HD11      LEU  49  62.838  -4.061  -2.645
  348   2HD1  LEU  49          HD13      LEU  49  62.524  -4.204  -0.915
  349   3HD1  LEU  49          HD12      LEU  49  64.157  -4.437  -1.537
  350   1HD2  LEU  49          HD23      LEU  49  60.897  -6.776  -1.289
  351   2HD2  LEU  49          HD22      LEU  49  62.240  -7.419  -0.343
  352   3HD2  LEU  49          HD21      LEU  49  61.715  -5.751  -0.109
  353    H    GLY  50           HN       GLY  50  63.086  -7.316  -5.510
  354   1HA   GLY  50           HA2      GLY  50  62.021  -9.111  -7.374
  355   2HA   GLY  50           HA1      GLY  50  60.975  -7.691  -7.446
  356    H    GLN  51           HN       GLN  51  64.502  -8.015  -6.981
  357    HA   GLN  51           HA       GLN  51  64.950  -6.647  -9.569
  358   1HB   GLN  51           HB2      GLN  51  64.810  -5.128  -7.292
  359   2HB   GLN  51           HB1      GLN  51  66.531  -5.505  -7.352
  360   1HG   GLN  51           HG2      GLN  51  66.686  -4.645  -9.626
  361   2HG   GLN  51           HG1      GLN  51  64.943  -4.375  -9.676
  362   1HE2  GLN  51          HE22      GLN  51  67.351  -1.677  -7.808
  363   2HE2  GLN  51          HE21      GLN  51  67.992  -3.110  -8.455
  364    H    ASN  52           HN       ASN  52  67.041  -7.057 -10.408
  365    HA   ASN  52           HA       ASN  52  68.903  -8.646  -8.730
  366   1HB   ASN  52           HB2      ASN  52  69.165 -10.160 -10.852
  367   2HB   ASN  52           HB1      ASN  52  67.820 -10.458  -9.750
  368   1HD2  ASN  52          HD22      ASN  52  65.758 -10.277 -12.632
  369   2HD2  ASN  52          HD21      ASN  52  66.389 -11.280 -11.416
  370    HA   PRO  53           HA       PRO  53  70.888  -5.543 -11.556
  371   1HB   PRO  53           HB2      PRO  53  71.994  -4.021  -9.552
  372   2HB   PRO  53           HB1      PRO  53  70.389  -3.719 -10.238
  373   1HG   PRO  53           HG2      PRO  53  71.109  -4.918  -7.604
  374   2HG   PRO  53           HG1      PRO  53  69.645  -4.039  -8.073
  375   1HD   PRO  53           HD2      PRO  53  69.881  -6.848  -7.821
  376   2HD   PRO  53           HD1      PRO  53  68.542  -5.978  -8.601
  377    H    THR  54           HN       THR  54  73.322  -5.053 -11.597
  378    HA   THR  54           HA       THR  54  74.788  -7.482 -10.866
  379    HB   THR  54           HB       THR  54  75.256  -6.419 -13.018
  380    HG1  THR  54           HG1      THR  54  77.515  -6.194 -12.742
  381   1HG2  THR  54          HG22      THR  54  75.475  -4.026 -11.284
  382   2HG2  THR  54          HG21      THR  54  76.651  -4.133 -12.594
  383   3HG2  THR  54          HG23      THR  54  74.925  -4.162 -12.955
  384    H    LYS  55           HN       LYS  55  76.595  -7.536  -9.425
  385    HA   LYS  55           HA       LYS  55  76.340  -6.114  -7.006
  386   1HB   LYS  55           HB2      LYS  55  78.242  -7.955  -8.186
  387   2HB   LYS  55           HB1      LYS  55  79.081  -6.709  -7.262
  388   1HG   LYS  55           HG2      LYS  55  78.596  -7.996  -5.457
  389   2HG   LYS  55           HG1      LYS  55  76.974  -7.320  -5.604
  390   1HD   LYS  55           HD2      LYS  55  76.391  -9.534  -5.709
  391   2HD   LYS  55           HD1      LYS  55  76.784  -9.312  -7.415
  392   1HE   LYS  55           HE2      LYS  55  78.977 -10.228  -7.123
  393   2HE   LYS  55           HE1      LYS  55  78.835 -10.176  -5.365
  394   1HZ   LYS  55           HZ1      LYS  55  76.964 -11.763  -5.575
  395   2HZ   LYS  55           HZ3      LYS  55  77.302 -11.899  -7.232
  396   3HZ   LYS  55           HZ2      LYS  55  78.455 -12.399  -6.086
  397    H    GLU  56           HN       GLU  56  77.814  -5.154 -10.003
  398    HA   GLU  56           HA       GLU  56  79.609  -3.155  -9.090
  399   1HB   GLU  56           HB2      GLU  56  79.308  -3.980 -11.478
  400   2HB   GLU  56           HB1      GLU  56  77.887  -2.937 -11.570
  401   1HG   GLU  56           HG2      GLU  56  80.281  -1.602 -10.496
  402   2HG   GLU  56           HG1      GLU  56  80.446  -2.137 -12.168
  403    H    GLU  57           HN       GLU  57  76.116  -2.971  -9.772
  404    HA   GLU  57           HA       GLU  57  76.032  -0.154  -8.931
  405   1HB   GLU  57           HB2      GLU  57  74.563  -1.294 -10.749
  406   2HB   GLU  57           HB1      GLU  57  73.621  -1.904  -9.388
  407   1HG   GLU  57           HG2      GLU  57  72.609   0.171 -10.086
  408   2HG   GLU  57           HG1      GLU  57  73.443   0.480  -8.562
  409    H    LEU  58           HN       LEU  58  75.605  -3.289  -7.508
  410    HA   LEU  58           HA       LEU  58  73.915  -2.493  -5.310
  411   1HB   LEU  58           HB2      LEU  58  75.153  -4.885  -6.220
  412   2HB   LEU  58           HB1      LEU  58  75.682  -4.632  -4.558
  413    HG   LEU  58           HG       LEU  58  72.819  -4.096  -5.010
  414   1HD1  LEU  58          HD12      LEU  58  73.241  -6.047  -6.532
  415   2HD1  LEU  58          HD11      LEU  58  73.858  -6.943  -5.143
  416   3HD1  LEU  58          HD13      LEU  58  72.170  -6.432  -5.184
  417   1HD2  LEU  58          HD22      LEU  58  74.278  -4.317  -2.828
  418   2HD2  LEU  58          HD21      LEU  58  72.635  -4.957  -2.846
  419   3HD2  LEU  58          HD23      LEU  58  74.007  -6.045  -3.054
  420    H    ASP  59           HN       ASP  59  77.384  -3.388  -5.171
  421    HA   ASP  59           HA       ASP  59  77.981  -2.369  -2.661
  422   1HB   ASP  59           HB2      ASP  59  79.581  -2.552  -5.197
  423   2HB   ASP  59           HB1      ASP  59  80.280  -1.754  -3.787
  424    H    ALA  60           HN       ALA  60  78.078  -0.524  -5.727
  425    HA   ALA  60           HA       ALA  60  78.803   1.974  -4.600
  426   1HB   ALA  60           HB2      ALA  60  77.395   1.104  -7.090
  427   2HB   ALA  60           HB1      ALA  60  77.300   2.808  -6.647
  428   3HB   ALA  60           HB3      ALA  60  78.872   2.052  -6.910
  429    H    ILE  61           HN       ILE  61  75.619   0.457  -4.999
  430    HA   ILE  61           HA       ILE  61  74.019   2.653  -4.183
  431    HB   ILE  61           HB       ILE  61  73.687  -0.337  -4.079
  432   1HG1  ILE  61          HG12      ILE  61  72.008   1.805  -5.403
  433   2HG1  ILE  61          HG11      ILE  61  73.421   1.089  -6.176
  434   1HG2  ILE  61          HG21      ILE  61  72.578   0.546  -2.043
  435   2HG2  ILE  61          HG23      ILE  61  71.679   1.689  -3.042
  436   3HG2  ILE  61          HG22      ILE  61  71.404  -0.044  -3.218
  437   1HD1  ILE  61          HD11      ILE  61  71.973  -1.104  -5.229
  438   2HD1  ILE  61          HD13      ILE  61  70.743  -0.009  -5.860
  439   3HD1  ILE  61          HD12      ILE  61  72.057  -0.554  -6.902
  440    H    ILE  62           HN       ILE  62  75.269  -0.049  -2.182
  441    HA   ILE  62           HA       ILE  62  74.392   0.818   0.323
  442    HB   ILE  62           HB       ILE  62  77.049  -0.457  -0.398
  443   1HG1  ILE  62          HG12      ILE  62  74.581  -1.761   0.766
  444   2HG1  ILE  62          HG11      ILE  62  74.824  -1.618  -0.976
  445   1HG2  ILE  62          HG22      ILE  62  75.800   0.310   2.193
  446   2HG2  ILE  62          HG21      ILE  62  76.553  -1.283   2.119
  447   3HG2  ILE  62          HG23      ILE  62  77.504   0.160   1.766
  448   1HD1  ILE  62          HD12      ILE  62  76.908  -2.827   0.850
  449   2HD1  ILE  62          HD11      ILE  62  75.644  -3.793   0.092
  450   3HD1  ILE  62          HD13      ILE  62  76.813  -2.932  -0.908
  451    H    GLU  63           HN       GLU  63  77.147   1.989  -1.567
  452    HA   GLU  63           HA       GLU  63  78.261   3.645   0.503
  453   1HB   GLU  63           HB2      GLU  63  79.003   2.938  -2.063
  454   2HB   GLU  63           HB1      GLU  63  78.598   4.646  -2.238
  455   1HG   GLU  63           HG2      GLU  63  80.284   5.336  -0.824
  456   2HG   GLU  63           HG1      GLU  63  80.240   3.849   0.125
  457    H    GLU  64           HN       GLU  64  75.846   4.244  -2.038
  458    HA   GLU  64           HA       GLU  64  75.564   7.053  -1.205
  459   1HB   GLU  64           HB2      GLU  64  73.961   5.417  -3.193
  460   2HB   GLU  64           HB1      GLU  64  73.857   7.165  -2.977
  461   1HG   GLU  64           HG2      GLU  64  76.600   6.605  -3.298
  462   2HG   GLU  64           HG1      GLU  64  75.773   5.637  -4.518
  463    H    VAL  65           HN       VAL  65  74.483   4.156   0.014
  464    HA   VAL  65           HA       VAL  65  71.812   5.197   0.789
  465    HB   VAL  65           HB       VAL  65  73.057   2.510   1.441
  466   1HG1  VAL  65          HG11      VAL  65  70.758   3.783   2.397
  467   2HG1  VAL  65          HG13      VAL  65  70.161   2.690   1.148
  468   3HG1  VAL  65          HG12      VAL  65  71.111   2.057   2.494
  469   1HG2  VAL  65          HG23      VAL  65  72.399   3.475  -1.089
  470   2HG2  VAL  65          HG22      VAL  65  72.538   1.776  -0.636
  471   3HG2  VAL  65          HG21      VAL  65  70.964   2.575  -0.601
  472    H    ASP  66           HN       ASP  66  74.984   4.499   2.120
  473    HA   ASP  66           HA       ASP  66  74.055   4.957   4.883
  474   1HB   ASP  66           HB2      ASP  66  76.350   3.739   3.628
  475   2HB   ASP  66           HB1      ASP  66  76.883   4.966   4.775
  476    H    GLU  67           HN       GLU  67  73.297   7.192   4.334
  477    HA   GLU  67           HA       GLU  67  75.125   9.243   3.510
  478   1HB   GLU  67           HB2      GLU  67  72.396   9.109   4.633
  479   2HB   GLU  67           HB1      GLU  67  73.274  10.594   5.000
  480   1HG   GLU  67           HG2      GLU  67  73.369   9.561   2.194
  481   2HG   GLU  67           HG1      GLU  67  71.887  10.346   2.741
  482    H    ASP  68           HN       ASP  68  74.160   8.036   6.710
  483    HA   ASP  68           HA       ASP  68  75.835  10.007   8.087
  484   1HB   ASP  68           HB2      ASP  68  75.248   8.581  10.113
  485   2HB   ASP  68           HB1      ASP  68  73.872   9.286   9.264
  486    H    GLY  69           HN       GLY  69  76.266   6.901   6.670
  487   1HA   GLY  69           HA2      GLY  69  78.204   5.583   6.486
  488   2HA   GLY  69           HA1      GLY  69  79.093   6.907   7.241
  489    H    SER  70           HN       SER  70  76.301   5.419   8.762
  490    HA   SER  70           HA       SER  70  77.781   4.891  11.182
  491   1HB   SER  70           HB2      SER  70  75.557   3.422  11.541
  492   2HB   SER  70           HB1      SER  70  75.560   5.177  11.701
  493    HG   SER  70           HG       SER  70  73.900   4.385  10.304
  494    H    GLY  71           HN       GLY  71  76.880   2.953   8.383
  495   1HA   GLY  71           HA2      GLY  71  78.318   1.046   7.782
  496   2HA   GLY  71           HA1      GLY  71  78.552   0.746   9.504
  497    H    THR  72           HN       THR  72  75.356   1.591   9.003
  498    HA   THR  72           HA       THR  72  74.496  -1.195   8.421
  499    HB   THR  72           HB       THR  72  72.837  -0.943  10.365
  500    HG1  THR  72           HG1      THR  72  73.033   1.156  10.900
  501   1HG2  THR  72          HG22      THR  72  75.674  -1.631  10.368
  502   2HG2  THR  72          HG21      THR  72  75.097  -1.164  11.968
  503   3HG2  THR  72          HG23      THR  72  74.315  -2.484  11.098
  504    H    ILE  73           HN       ILE  73  72.305  -1.312   7.643
  505    HA   ILE  73           HA       ILE  73  71.334   1.293   6.579
  506    HB   ILE  73           HB       ILE  73  70.512  -1.528   5.822
  507   1HG1  ILE  73          HG12      ILE  73  72.938  -0.873   5.366
  508   2HG1  ILE  73          HG11      ILE  73  71.994  -1.328   3.946
  509   1HG2  ILE  73          HG23      ILE  73  68.850   0.288   5.364
  510   2HG2  ILE  73          HG22      ILE  73  70.075   1.117   4.404
  511   3HG2  ILE  73          HG21      ILE  73  69.475  -0.460   3.895
  512   1HD1  ILE  73          HD11      ILE  73  71.665   1.490   4.468
  513   2HD1  ILE  73          HD13      ILE  73  73.382   1.098   4.371
  514   3HD1  ILE  73          HD12      ILE  73  72.309   0.702   3.028
  515    H    ASP  74           HN       ASP  74  69.316   2.084   7.132
  516    HA   ASP  74           HA       ASP  74  67.730   0.436   9.065
  517   1HB   ASP  74           HB2      ASP  74  67.872   3.464   8.973
  518   2HB   ASP  74           HB1      ASP  74  67.108   2.469  10.214
  519    H    PHE  75           HN       PHE  75  65.353   1.271   9.108
  520    HA   PHE  75           HA       PHE  75  64.089   0.789   6.679
  521   1HB   PHE  75           HB2      PHE  75  63.065   1.056   9.030
  522   2HB   PHE  75           HB1      PHE  75  62.982   2.779   8.662
  523    HD1  PHE  75           HD2      PHE  75  62.514  -0.172   6.417
  524    HD2  PHE  75           HD1      PHE  75  60.703   3.236   8.298
  525    HE1  PHE  75           HE2      PHE  75  60.441  -0.553   5.107
  526    HE2  PHE  75           HE1      PHE  75  58.629   2.857   6.991
  527    HZ   PHE  75           HZ       PHE  75  58.497   0.963   5.395
  528    H    GLU  76           HN       GLU  76  65.016   3.977   8.001
  529    HA   GLU  76           HA       GLU  76  63.980   5.547   5.871
  530   1HB   GLU  76           HB2      GLU  76  66.052   5.912   7.978
  531   2HB   GLU  76           HB1      GLU  76  66.119   7.014   6.603
  532   1HG   GLU  76           HG2      GLU  76  64.084   7.982   7.100
  533   2HG   GLU  76           HG1      GLU  76  63.451   6.517   7.852
  534    H    GLU  77           HN       GLU  77  67.102   3.884   6.216
  535    HA   GLU  77           HA       GLU  77  68.134   4.943   3.704
  536   1HB   GLU  77           HB2      GLU  77  69.080   2.561   5.328
  537   2HB   GLU  77           HB1      GLU  77  69.990   3.387   4.060
  538   1HG   GLU  77           HG2      GLU  77  69.509   5.520   5.557
  539   2HG   GLU  77           HG1      GLU  77  69.334   4.314   6.832
  540    H    PHE  78           HN       PHE  78  66.007   2.402   4.578
  541    HA   PHE  78           HA       PHE  78  66.564   0.564   2.437
  542   1HB   PHE  78           HB2      PHE  78  64.873   0.598   4.632
  543   2HB   PHE  78           HB1      PHE  78  63.756   0.714   3.271
  544    HD1  PHE  78           HD1      PHE  78  66.613  -1.260   4.629
  545    HD2  PHE  78           HD2      PHE  78  63.299  -1.163   1.897
  546    HE1  PHE  78           HE1      PHE  78  66.921  -3.678   4.170
  547    HE2  PHE  78           HE2      PHE  78  63.607  -3.582   1.440
  548    HZ   PHE  78           HZ       PHE  78  65.417  -4.839   2.577
  549    H    LEU  79           HN       LEU  79  63.860   2.883   2.784
  550    HA   LEU  79           HA       LEU  79  62.807   2.703   0.210
  551   1HB   LEU  79           HB2      LEU  79  63.149   5.288   1.760
  552   2HB   LEU  79           HB1      LEU  79  61.937   4.955   0.523
  553    HG   LEU  79           HG       LEU  79  62.185   3.535   3.192
  554   1HD1  LEU  79          HD11      LEU  79  60.255   5.589   2.095
  555   2HD1  LEU  79          HD13      LEU  79  59.894   4.599   3.509
  556   3HD1  LEU  79          HD12      LEU  79  61.260   5.714   3.540
  557   1HD2  LEU  79          HD23      LEU  79  61.389   2.059   1.366
  558   2HD2  LEU  79          HD22      LEU  79  60.101   2.406   2.519
  559   3HD2  LEU  79          HD21      LEU  79  60.143   3.240   0.966
  560    H    VAL  80           HN       VAL  80  65.815   4.166   1.210
  561    HA   VAL  80           HA       VAL  80  66.222   5.787  -1.144
  562    HB   VAL  80           HB       VAL  80  68.184   4.603   0.839
  563   1HG1  VAL  80          HG11      VAL  80  68.559   6.612  -1.398
  564   2HG1  VAL  80          HG13      VAL  80  69.718   6.386  -0.087
  565   3HG1  VAL  80          HG12      VAL  80  69.382   5.064  -1.205
  566   1HG2  VAL  80          HG22      VAL  80  66.415   6.329   1.568
  567   2HG2  VAL  80          HG21      VAL  80  68.097   6.717   1.920
  568   3HG2  VAL  80          HG23      VAL  80  67.287   7.473   0.548
  569    H    MET  81           HN       MET  81  67.357   2.523  -0.229
  570    HA   MET  81           HA       MET  81  68.865   2.000  -2.566
  571   1HB   MET  81           HB2      MET  81  68.957   0.552  -0.593
  572   2HB   MET  81           HB1      MET  81  67.273   0.083  -0.837
  573   1HG   MET  81           HG2      MET  81  67.756  -1.210  -2.696
  574   2HG   MET  81           HG1      MET  81  69.197  -0.278  -3.097
  575   1HE   MET  81           HE2      MET  81  70.712   0.225  -1.225
  576   2HE   MET  81           HE1      MET  81  70.831  -0.688   0.277
  577   3HE   MET  81           HE3      MET  81  71.878  -1.088  -1.090
  578    H    MET  82           HN       MET  82  65.392   1.811  -1.974
  579    HA   MET  82           HA       MET  82  64.776   0.375  -4.410
  580   1HB   MET  82           HB2      MET  82  63.122   2.071  -2.530
  581   2HB   MET  82           HB1      MET  82  62.437   1.307  -3.963
  582   1HG   MET  82           HG2      MET  82  63.976  -0.231  -1.862
  583   2HG   MET  82           HG1      MET  82  62.223  -0.038  -1.816
  584   1HE   MET  82           HE1      MET  82  64.841  -2.237  -2.466
  585   2HE   MET  82           HE3      MET  82  64.673  -3.008  -4.049
  586   3HE   MET  82           HE2      MET  82  65.289  -1.363  -3.928
  587    H    VAL  83           HN       VAL  83  64.192   3.806  -3.540
  588    HA   VAL  83           HA       VAL  83  63.604   4.615  -6.219
  589    HB   VAL  83           HB       VAL  83  64.774   6.379  -4.057
  590   1HG1  VAL  83          HG12      VAL  83  63.454   6.764  -6.664
  591   2HG1  VAL  83          HG11      VAL  83  62.786   7.750  -5.364
  592   3HG1  VAL  83          HG13      VAL  83  64.500   7.859  -5.761
  593   1HG2  VAL  83          HG23      VAL  83  62.084   5.088  -4.330
  594   2HG2  VAL  83          HG22      VAL  83  63.013   5.434  -2.873
  595   3HG2  VAL  83          HG21      VAL  83  62.162   6.735  -3.706
  596    H    ARG  84           HN       ARG  84  66.549   3.699  -4.815
  597    HA   ARG  84           HA       ARG  84  68.347   5.477  -6.163
  598   1HB   ARG  84           HB2      ARG  84  68.773   3.804  -4.208
  599   2HB   ARG  84           HB1      ARG  84  69.046   2.629  -5.497
  600   1HG   ARG  84           HG2      ARG  84  71.082   3.481  -5.916
  601   2HG   ARG  84           HG1      ARG  84  70.405   5.100  -6.104
  602   1HD   ARG  84           HD2      ARG  84  70.424   4.302  -3.313
  603   2HD   ARG  84           HD1      ARG  84  72.043   4.212  -4.006
  604    HE   ARG  84           HE       ARG  84  70.610   6.640  -3.427
  605   1HH1  ARG  84          HH11      ARG  84  72.608   5.109  -5.790
  606   2HH1  ARG  84          HH12      ARG  84  73.350   6.585  -6.307
  607   1HH2  ARG  84          HH21      ARG  84  71.604   8.567  -4.063
  608   2HH2  ARG  84          HH22      ARG  84  72.782   8.540  -5.330
  609    H    GLN  85           HN       GLN  85  66.792   2.444  -7.151
  610    HA   GLN  85           HA       GLN  85  68.088   2.816  -9.824
  611   1HB   GLN  85           HB2      GLN  85  67.818   0.426  -8.105
  612   2HB   GLN  85           HB1      GLN  85  67.435   0.171  -9.808
  613   1HG   GLN  85           HG2      GLN  85  69.903   1.721  -9.127
  614   2HG   GLN  85           HG1      GLN  85  69.936  -0.032  -8.935
  615   1HE2  GLN  85          HE22      GLN  85  70.180   1.539 -12.632
  616   2HE2  GLN  85          HE21      GLN  85  70.258   2.491 -11.228
  617    H    MET  86           HN       MET  86  65.142   2.711  -8.127
  618    HA   MET  86           HA       MET  86  63.605   1.760 -10.463
  619   1HB   MET  86           HB2      MET  86  61.776   1.578  -9.043
  620   2HB   MET  86           HB1      MET  86  63.093   1.359  -7.894
  621   1HG   MET  86           HG2      MET  86  62.892   4.052  -7.828
  622   2HG   MET  86           HG1      MET  86  61.222   3.646  -8.219
  623   1HE   MET  86           HE3      MET  86  59.660   2.696  -7.033
  624   2HE   MET  86           HE2      MET  86  59.613   2.403  -5.297
  625   3HE   MET  86           HE1      MET  86  59.801   4.048  -5.901
  626    H    LYS  87           HN       LYS  87  64.747   4.715  -9.147
  627    HA   LYS  87           HA       LYS  87  62.794   6.586  -9.869
  628   1HB   LYS  87           HB2      LYS  87  65.699   6.605  -9.487
  629   2HB   LYS  87           HB1      LYS  87  65.154   7.812 -10.652
  630   1HG   LYS  87           HG2      LYS  87  63.277   7.977  -8.601
  631   2HG   LYS  87           HG1      LYS  87  64.808   7.755  -7.755
  632   1HD   LYS  87           HD2      LYS  87  65.593   9.563  -9.593
  633   2HD   LYS  87           HD1      LYS  87  63.894  10.020  -9.455
  634   1HE   LYS  87           HE2      LYS  87  64.136  10.218  -7.012
  635   2HE   LYS  87           HE1      LYS  87  65.831   9.744  -7.136
  636   1HZ   LYS  87           HZ1      LYS  87  65.220  11.874  -8.917
  637   2HZ   LYS  87           HZ3      LYS  87  64.815  12.289  -7.322
  638   3HZ   LYS  87           HZ2      LYS  87  66.398  11.797  -7.695
  639    H    GLU  88           HN       GLU  88  65.183   4.976 -11.952
  640    HA   GLU  88           HA       GLU  88  63.980   6.327 -14.314
  641   1HB   GLU  88           HB2      GLU  88  66.596   5.090 -13.696
  642   2HB   GLU  88           HB1      GLU  88  65.987   4.778 -15.322
  643   1HG   GLU  88           HG2      GLU  88  65.541   7.544 -14.637
  644   2HG   GLU  88           HG1      GLU  88  67.240   7.135 -14.388
  645    H    ASP  89           HN       ASP  89  65.449   3.149 -14.481
  646    HA   ASP  89           HA       ASP  89  64.552   1.070 -15.100
  647   1HB   ASP  89           HB2      ASP  89  62.757   2.134 -13.223
  648   2HB   ASP  89           HB1      ASP  89  61.748   1.615 -14.573
  649    H    ALA  90           HN       ALA  90  64.941   1.587 -17.343
  650    HA   ALA  90           HA       ALA  90  62.414   2.002 -18.859
  651   1HB   ALA  90           HB3      ALA  90  64.119   4.080 -18.582
  652   2HB   ALA  90           HB2      ALA  90  64.852   3.288 -19.976
  653   3HB   ALA  90           HB1      ALA  90  63.171   3.815 -20.044
   
  No H/Q in entry =         653
  Start of MODEL   16
    1   1H    ALA   1           HT2      ALA   1  64.010  12.987  12.782
    2   2H    ALA   1           HT1      ALA   1  62.842  13.672  13.810
    3   3H    ALA   1           HT3      ALA   1  62.639  13.749  12.128
    4    HA   ALA   1           HA       ALA   1  63.537  15.770  12.248
    5   1HB   ALA   1           HB1      ALA   1  63.857  14.873  14.998
    6   2HB   ALA   1           HB3      ALA   1  65.204  15.894  14.497
    7   3HB   ALA   1           HB2      ALA   1  63.551  16.497  14.385
    8    H    SER   2           HN       SER   2  64.838  13.397  11.099
    9    HA   SER   2           HA       SER   2  67.549  14.556  10.830
   10   1HB   SER   2           HB2      SER   2  68.441  12.119  10.998
   11   2HB   SER   2           HB1      SER   2  68.084  12.979  12.493
   12    HG   SER   2           HG       SER   2  66.045  11.944  12.498
   13    H    MET   3           HN       MET   3  64.970  13.986   9.229
   14    HA   MET   3           HA       MET   3  65.819  12.078   7.189
   15   1HB   MET   3           HB2      MET   3  63.808  13.063   5.947
   16   2HB   MET   3           HB1      MET   3  63.459  12.292   7.495
   17   1HG   MET   3           HG2      MET   3  62.723  14.229   8.386
   18   2HG   MET   3           HG1      MET   3  64.158  15.097   7.837
   19   1HE   MET   3           HE2      MET   3  64.296  16.641   6.491
   20   2HE   MET   3           HE1      MET   3  63.236  17.212   5.205
   21   3HE   MET   3           HE3      MET   3  62.802  17.481   6.899
   22    H    THR   4           HN       THR   4  67.424  12.605   5.790
   23    HA   THR   4           HA       THR   4  68.193  15.357   5.278
   24    HB   THR   4           HB       THR   4  69.437  13.926   3.313
   25    HG1  THR   4           HG1      THR   4  69.295  12.137   5.473
   26   1HG2  THR   4          HG23      THR   4  70.139  15.194   5.638
   27   2HG2  THR   4          HG22      THR   4  70.639  13.536   5.973
   28   3HG2  THR   4          HG21      THR   4  71.276  14.383   4.562
   29    H    ASP   5           HN       ASP   5  68.517  15.879   2.753
   30    HA   ASP   5           HA       ASP   5  65.857  16.174   1.676
   31   1HB   ASP   5           HB2      ASP   5  68.587  16.637   0.441
   32   2HB   ASP   5           HB1      ASP   5  67.065  17.081  -0.332
   33    H    GLN   6           HN       GLN   6  68.631  14.107   0.805
   34    HA   GLN   6           HA       GLN   6  67.516  12.889  -1.490
   35   1HB   GLN   6           HB2      GLN   6  69.043  11.003  -1.008
   36   2HB   GLN   6           HB1      GLN   6  69.859  12.552  -0.789
   37   1HG   GLN   6           HG2      GLN   6  69.269  12.400   1.672
   38   2HG   GLN   6           HG1      GLN   6  68.742  10.743   1.367
   39   1HE2  GLN   6          HE22      GLN   6  72.056   9.481   0.959
   40   2HE2  GLN   6          HE21      GLN   6  70.414   9.177   0.653
   41    H    GLN   7           HN       GLN   7  67.108  12.110   1.949
   42    HA   GLN   7           HA       GLN   7  65.427   9.790   1.391
   43   1HB   GLN   7           HB2      GLN   7  65.635  11.316   3.996
   44   2HB   GLN   7           HB1      GLN   7  65.171   9.629   3.769
   45   1HG   GLN   7           HG2      GLN   7  67.423   9.090   2.967
   46   2HG   GLN   7           HG1      GLN   7  67.898  10.783   3.109
   47   1HE2  GLN   7          HE22      GLN   7  69.058   9.216   6.240
   48   2HE2  GLN   7          HE21      GLN   7  69.476   9.185   4.595
   49    H    ALA   8           HN       ALA   8  64.956  13.208   1.685
   50    HA   ALA   8           HA       ALA   8  62.161  13.131   2.431
   51   1HB   ALA   8           HB3      ALA   8  64.015  15.116   2.282
   52   2HB   ALA   8           HB2      ALA   8  63.120  15.405   0.791
   53   3HB   ALA   8           HB1      ALA   8  62.278  15.411   2.341
   54    H    GLU   9           HN       GLU   9  63.883  13.355  -0.680
   55    HA   GLU   9           HA       GLU   9  61.418  13.460  -2.224
   56   1HB   GLU   9           HB2      GLU   9  64.283  13.578  -2.742
   57   2HB   GLU   9           HB1      GLU   9  63.453  12.561  -3.920
   58   1HG   GLU   9           HG2      GLU   9  61.727  14.678  -3.732
   59   2HG   GLU   9           HG1      GLU   9  63.284  15.476  -3.507
   60    H    ALA  10           HN       ALA  10  63.488  10.937  -0.968
   61    HA   ALA  10           HA       ALA  10  62.616   8.819  -2.699
   62   1HB   ALA  10           HB3      ALA  10  64.429   9.067  -0.603
   63   2HB   ALA  10           HB2      ALA  10  63.196   7.981   0.042
   64   3HB   ALA  10           HB1      ALA  10  64.036   7.573  -1.456
   65    H    ARG  11           HN       ARG  11  61.576   9.668   0.627
   66    HA   ARG  11           HA       ARG  11  59.374   7.816   0.629
   67   1HB   ARG  11           HB2      ARG  11  60.405   9.952   2.369
   68   2HB   ARG  11           HB1      ARG  11  58.649   9.783   2.419
   69   1HG   ARG  11           HG2      ARG  11  58.798   7.473   3.036
   70   2HG   ARG  11           HG1      ARG  11  60.527   7.426   2.691
   71   1HD   ARG  11           HD2      ARG  11  61.075   8.338   4.698
   72   2HD   ARG  11           HD1      ARG  11  59.749   9.498   4.634
   73    HE   ARG  11           HE       ARG  11  58.684   6.883   5.101
   74   1HH1  ARG  11          HH11      ARG  11  57.779   9.169   6.698
   75   2HH1  ARG  11          HH12      ARG  11  58.493   8.883   8.249
   76   1HH2  ARG  11          HH21      ARG  11  60.806   6.591   7.055
   77   2HH2  ARG  11          HH22      ARG  11  60.208   7.423   8.451
   78    H    ALA  12           HN       ALA  12  59.802  11.006  -0.673
   79    HA   ALA  12           HA       ALA  12  56.983  11.687  -0.803
   80   1HB   ALA  12           HB1      ALA  12  59.362  13.054  -1.211
   81   2HB   ALA  12           HB3      ALA  12  58.693  12.920  -2.837
   82   3HB   ALA  12           HB2      ALA  12  57.749  13.680  -1.555
   83    H    PHE  13           HN       PHE  13  59.275  10.061  -2.943
   84    HA   PHE  13           HA       PHE  13  57.296   9.918  -5.121
   85   1HB   PHE  13           HB2      PHE  13  59.687  10.184  -5.667
   86   2HB   PHE  13           HB1      PHE  13  60.047   8.666  -4.845
   87    HD1  PHE  13           HD2      PHE  13  59.131   6.512  -5.735
   88    HD2  PHE  13           HD1      PHE  13  58.752  10.217  -7.874
   89    HE1  PHE  13           HE2      PHE  13  58.598   5.259  -7.808
   90    HE2  PHE  13           HE1      PHE  13  58.218   8.965  -9.947
   91    HZ   PHE  13           HZ       PHE  13  58.141   6.486  -9.914
   92    H    LEU  14           HN       LEU  14  58.206   8.080  -2.364
   93    HA   LEU  14           HA       LEU  14  57.092   5.571  -3.480
   94   1HB   LEU  14           HB2      LEU  14  58.347   6.211  -0.793
   95   2HB   LEU  14           HB1      LEU  14  57.767   4.615  -1.268
   96    HG   LEU  14           HG       LEU  14  59.891   6.198  -2.744
   97   1HD1  LEU  14          HD11      LEU  14  60.106   4.756  -0.347
   98   2HD1  LEU  14          HD13      LEU  14  60.690   3.651  -1.590
   99   3HD1  LEU  14          HD12      LEU  14  61.433   5.239  -1.403
  100   1HD2  LEU  14          HD21      LEU  14  58.604   3.495  -3.143
  101   2HD2  LEU  14          HD23      LEU  14  58.832   4.787  -4.323
  102   3HD2  LEU  14          HD22      LEU  14  60.216   3.840  -3.773
  103    H    SER  15           HN       SER  15  55.035   4.898  -3.025
  104    HA   SER  15           HA       SER  15  53.275   6.696  -1.528
  105   1HB   SER  15           HB2      SER  15  52.971   4.401  -3.345
  106   2HB   SER  15           HB1      SER  15  51.791   4.433  -2.038
  107    HG   SER  15           HG       SER  15  51.279   6.562  -2.647
  108    H    GLU  16           HN       GLU  16  52.137   6.111   0.403
  109    HA   GLU  16           HA       GLU  16  53.652   4.718   2.361
  110   1HB   GLU  16           HB2      GLU  16  51.407   4.689   3.625
  111   2HB   GLU  16           HB1      GLU  16  52.046   6.267   3.166
  112   1HG   GLU  16           HG2      GLU  16  50.523   6.500   1.379
  113   2HG   GLU  16           HG1      GLU  16  50.156   4.775   1.352
  114    H    GLU  17           HN       GLU  17  51.331   3.572   0.015
  115    HA   GLU  17           HA       GLU  17  50.736   1.061   1.305
  116   1HB   GLU  17           HB2      GLU  17  50.422   2.183  -1.453
  117   2HB   GLU  17           HB1      GLU  17  50.287   0.438  -1.240
  118   1HG   GLU  17           HG2      GLU  17  48.679   1.029   0.719
  119   2HG   GLU  17           HG1      GLU  17  48.581   2.616  -0.049
  120    H    MET  18           HN       MET  18  52.890   1.805  -1.466
  121    HA   MET  18           HA       MET  18  54.114  -0.800  -1.456
  122   1HB   MET  18           HB2      MET  18  54.416   1.713  -2.909
  123   2HB   MET  18           HB1      MET  18  55.975   0.955  -2.579
  124   1HG   MET  18           HG2      MET  18  54.746  -1.236  -3.377
  125   2HG   MET  18           HG1      MET  18  53.661  -0.095  -4.174
  126   1HE   MET  18           HE3      MET  18  53.884   0.993  -5.997
  127   2HE   MET  18           HE2      MET  18  55.111   2.204  -5.637
  128   3HE   MET  18           HE1      MET  18  55.267   1.205  -7.079
  129    H    ILE  19           HN       ILE  19  54.545   1.994   0.510
  130    HA   ILE  19           HA       ILE  19  57.299   1.372   1.281
  131    HB   ILE  19           HB       ILE  19  55.221   3.301   2.333
  132   1HG1  ILE  19          HG12      ILE  19  57.897   3.636   0.941
  133   2HG1  ILE  19          HG11      ILE  19  56.312   3.894   0.212
  134   1HG2  ILE  19          HG21      ILE  19  57.611   2.247   3.642
  135   2HG2  ILE  19          HG23      ILE  19  57.680   3.997   3.441
  136   3HG2  ILE  19          HG22      ILE  19  56.328   3.260   4.304
  137   1HD1  ILE  19          HD13      ILE  19  55.872   5.644   1.966
  138   2HD1  ILE  19          HD12      ILE  19  57.546   5.462   2.490
  139   3HD1  ILE  19          HD11      ILE  19  57.190   6.052   0.867
  140    H    ALA  20           HN       ALA  20  54.051   0.770   2.539
  141    HA   ALA  20           HA       ALA  20  54.890  -0.257   5.094
  142   1HB   ALA  20           HB2      ALA  20  52.447   0.234   3.811
  143   2HB   ALA  20           HB1      ALA  20  52.472  -1.510   4.072
  144   3HB   ALA  20           HB3      ALA  20  52.665  -0.410   5.439
  145    H    GLU  21           HN       GLU  21  54.649  -1.653   1.883
  146    HA   GLU  21           HA       GLU  21  54.861  -4.409   2.787
  147   1HB   GLU  21           HB2      GLU  21  55.326  -4.884   0.381
  148   2HB   GLU  21           HB1      GLU  21  53.869  -3.917   0.610
  149   1HG   GLU  21           HG2      GLU  21  54.934  -1.931  -0.097
  150   2HG   GLU  21           HG1      GLU  21  56.545  -2.611   0.130
  151    H    PHE  22           HN       PHE  22  57.120  -1.865   1.892
  152    HA   PHE  22           HA       PHE  22  59.443  -3.510   1.573
  153   1HB   PHE  22           HB2      PHE  22  59.023  -0.612   2.307
  154   2HB   PHE  22           HB1      PHE  22  60.638  -1.317   2.274
  155    HD1  PHE  22           HD1      PHE  22  58.385  -2.907  -0.020
  156    HD2  PHE  22           HD2      PHE  22  60.979   0.486   0.444
  157    HE1  PHE  22           HE1      PHE  22  58.458  -2.627  -2.482
  158    HE2  PHE  22           HE2      PHE  22  61.052   0.765  -2.018
  159    HZ   PHE  22           HZ       PHE  22  59.792  -0.792  -3.482
  160    H    LYS  23           HN       LYS  23  58.023  -1.915   4.420
  161    HA   LYS  23           HA       LYS  23  60.042  -2.450   6.302
  162   1HB   LYS  23           HB2      LYS  23  57.548  -1.372   6.445
  163   2HB   LYS  23           HB1      LYS  23  57.268  -2.924   7.233
  164   1HG   LYS  23           HG2      LYS  23  59.427  -0.928   7.974
  165   2HG   LYS  23           HG1      LYS  23  57.946  -1.229   8.884
  166   1HD   LYS  23           HD2      LYS  23  58.713  -3.688   8.976
  167   2HD   LYS  23           HD1      LYS  23  60.290  -3.085   8.462
  168   1HE   LYS  23           HE2      LYS  23  60.482  -3.026  10.795
  169   2HE   LYS  23           HE1      LYS  23  59.985  -1.376  10.425
  170   1HZ   LYS  23           HZ2      LYS  23  57.928  -3.414  10.912
  171   2HZ   LYS  23           HZ1      LYS  23  58.751  -2.747  12.239
  172   3HZ   LYS  23           HZ3      LYS  23  57.877  -1.738  11.193
  173    H    ALA  24           HN       ALA  24  57.885  -4.647   4.697
  174    HA   ALA  24           HA       ALA  24  57.960  -6.811   6.566
  175   1HB   ALA  24           HB2      ALA  24  56.903  -6.353   3.986
  176   2HB   ALA  24           HB1      ALA  24  57.960  -7.757   3.837
  177   3HB   ALA  24           HB3      ALA  24  56.643  -7.765   5.008
  178    H    ALA  25           HN       ALA  25  59.847  -6.452   3.535
  179    HA   ALA  25           HA       ALA  25  61.666  -8.556   4.080
  180   1HB   ALA  25           HB1      ALA  25  61.316  -6.643   2.057
  181   2HB   ALA  25           HB3      ALA  25  62.943  -6.355   2.677
  182   3HB   ALA  25           HB2      ALA  25  62.500  -7.951   2.074
  183    H    PHE  26           HN       PHE  26  61.764  -5.127   4.991
  184    HA   PHE  26           HA       PHE  26  64.384  -4.964   5.994
  185   1HB   PHE  26           HB2      PHE  26  62.580  -3.128   5.864
  186   2HB   PHE  26           HB1      PHE  26  62.022  -3.737   7.423
  187    HD1  PHE  26           HD1      PHE  26  64.943  -2.298   5.630
  188    HD2  PHE  26           HD2      PHE  26  63.221  -3.285   9.438
  189    HE1  PHE  26           HE1      PHE  26  66.740  -1.027   6.772
  190    HE2  PHE  26           HE2      PHE  26  65.017  -2.014  10.582
  191    HZ   PHE  26           HZ       PHE  26  66.777  -0.884   9.247
  192    H    ASP  27           HN       ASP  27  61.480  -5.649   7.985
  193    HA   ASP  27           HA       ASP  27  62.881  -6.450  10.306
  194   1HB   ASP  27           HB2      ASP  27  60.470  -6.038  10.330
  195   2HB   ASP  27           HB1      ASP  27  60.200  -7.417   9.265
  196    H    MET  28           HN       MET  28  62.488  -8.083   7.288
  197    HA   MET  28           HA       MET  28  62.792 -10.788   8.190
  198   1HB   MET  28           HB2      MET  28  62.558  -9.451   5.706
  199   2HB   MET  28           HB1      MET  28  64.056 -10.381   5.632
  200   1HG   MET  28           HG2      MET  28  62.964 -12.378   5.685
  201   2HG   MET  28           HG1      MET  28  61.774 -11.806   6.852
  202   1HE   MET  28           HE2      MET  28  63.077 -11.804   3.333
  203   2HE   MET  28           HE1      MET  28  61.792 -11.163   2.314
  204   3HE   MET  28           HE3      MET  28  62.718 -10.079   3.362
  205    H    PHE  29           HN       PHE  29  65.268  -8.707   6.633
  206    HA   PHE  29           HA       PHE  29  67.399 -10.414   7.681
  207   1HB   PHE  29           HB2      PHE  29  67.683  -7.699   6.370
  208   2HB   PHE  29           HB1      PHE  29  68.899  -8.972   6.477
  209    HD1  PHE  29           HD1      PHE  29  68.085 -11.335   5.513
  210    HD2  PHE  29           HD2      PHE  29  66.478  -7.515   4.389
  211    HE1  PHE  29           HE1      PHE  29  67.251 -12.312   3.392
  212    HE2  PHE  29           HE2      PHE  29  65.643  -8.491   2.267
  213    HZ   PHE  29           HZ       PHE  29  66.029 -10.890   1.769
  214    H    ASP  30           HN       ASP  30  65.547  -7.949   9.000
  215    HA   ASP  30           HA       ASP  30  67.720  -6.789  10.626
  216   1HB   ASP  30           HB2      ASP  30  65.902  -5.325   9.844
  217   2HB   ASP  30           HB1      ASP  30  64.721  -6.328  10.688
  218    H    ALA  31           HN       ALA  31  68.118  -9.115  11.456
  219    HA   ALA  31           HA       ALA  31  66.174 -10.174  13.356
  220   1HB   ALA  31           HB3      ALA  31  68.386 -11.202  12.009
  221   2HB   ALA  31           HB2      ALA  31  68.912 -11.133  13.691
  222   3HB   ALA  31           HB1      ALA  31  67.457 -12.032  13.257
  223    H    ASP  32           HN       ASP  32  68.303  -7.597  13.476
  224    HA   ASP  32           HA       ASP  32  69.328  -7.886  16.161
  225   1HB   ASP  32           HB2      ASP  32  69.854  -6.174  14.108
  226   2HB   ASP  32           HB1      ASP  32  68.857  -5.147  15.138
  227    H    GLY  33           HN       GLY  33  66.388  -6.487  14.779
  228   1HA   GLY  33           HA2      GLY  33  64.320  -6.208  15.932
  229   2HA   GLY  33           HA1      GLY  33  65.154  -6.537  17.453
  230    H    GLY  34           HN       GLY  34  67.225  -4.458  16.290
  231   1HA   GLY  34           HA2      GLY  34  66.043  -2.191  17.727
  232   2HA   GLY  34           HA1      GLY  34  67.660  -2.242  17.021
  233    H    GLY  35           HN       GLY  35  66.260  -3.274  14.460
  234   1HA   GLY  35           HA2      GLY  35  64.831  -2.242  12.764
  235   2HA   GLY  35           HA1      GLY  35  65.058  -0.692  13.576
  236    H    ASP  36           HN       ASP  36  67.242  -3.219  12.271
  237    HA   ASP  36           HA       ASP  36  68.356  -1.377  10.312
  238   1HB   ASP  36           HB2      ASP  36  70.718  -1.671  11.407
  239   2HB   ASP  36           HB1      ASP  36  69.640  -0.415  12.019
  240    H    ILE  37           HN       ILE  37  69.137  -2.601   8.651
  241    HA   ILE  37           HA       ILE  37  69.630  -5.492   9.212
  242    HB   ILE  37           HB       ILE  37  67.930  -5.498   7.639
  243   1HG1  ILE  37          HG12      ILE  37  70.447  -5.265   5.965
  244   2HG1  ILE  37          HG11      ILE  37  69.753  -6.748   6.621
  245   1HG2  ILE  37          HG21      ILE  37  69.209  -3.041   6.410
  246   2HG2  ILE  37          HG23      ILE  37  67.739  -3.818   5.818
  247   3HG2  ILE  37          HG22      ILE  37  67.760  -3.071   7.417
  248   1HD1  ILE  37          HD13      ILE  37  67.638  -6.164   5.300
  249   2HD1  ILE  37          HD12      ILE  37  68.618  -4.955   4.469
  250   3HD1  ILE  37          HD11      ILE  37  69.036  -6.665   4.348
  251    H    SER  38           HN       SER  38  71.286  -6.462   7.649
  252    HA   SER  38           HA       SER  38  73.724  -4.819   7.801
  253   1HB   SER  38           HB2      SER  38  73.328  -7.643   6.770
  254   2HB   SER  38           HB1      SER  38  74.877  -6.866   7.083
  255    HG   SER  38           HG       SER  38  73.157  -8.073   8.796
  256    H    THR  39           HN       THR  39  74.782  -3.927   6.041
  257    HA   THR  39           HA       THR  39  73.345  -3.361   3.659
  258    HB   THR  39           HB       THR  39  75.799  -2.926   2.778
  259    HG1  THR  39           HG1      THR  39  77.184  -3.655   4.168
  260   1HG2  THR  39          HG22      THR  39  74.123  -1.216   3.499
  261   2HG2  THR  39          HG21      THR  39  74.705  -1.399   5.154
  262   3HG2  THR  39          HG23      THR  39  75.782  -0.773   3.905
  263    H    LYS  40           HN       LYS  40  75.207  -6.142   4.575
  264    HA   LYS  40           HA       LYS  40  75.694  -7.092   1.870
  265   1HB   LYS  40           HB2      LYS  40  75.730  -8.530   4.540
  266   2HB   LYS  40           HB1      LYS  40  76.272  -9.235   3.017
  267   1HG   LYS  40           HG2      LYS  40  77.790  -7.125   2.848
  268   2HG   LYS  40           HG1      LYS  40  77.487  -6.966   4.580
  269   1HD   LYS  40           HD2      LYS  40  78.168  -9.461   4.721
  270   2HD   LYS  40           HD1      LYS  40  78.851  -9.220   3.112
  271   1HE   LYS  40           HE2      LYS  40  79.588  -7.070   4.942
  272   2HE   LYS  40           HE1      LYS  40  80.116  -8.647   5.527
  273   1HZ   LYS  40           HZ2      LYS  40  80.592  -8.506   2.769
  274   2HZ   LYS  40           HZ1      LYS  40  81.238  -7.109   3.488
  275   3HZ   LYS  40           HZ3      LYS  40  81.724  -8.640   4.029
  276    H    ALA  41           HN       ALA  41  73.181  -7.573   4.310
  277    HA   ALA  41           HA       ALA  41  71.831  -9.706   2.902
  278   1HB   ALA  41           HB1      ALA  41  71.264  -7.943   5.224
  279   2HB   ALA  41           HB3      ALA  41  69.853  -8.588   4.385
  280   3HB   ALA  41           HB2      ALA  41  71.057  -9.687   5.059
  281    H    LEU  42           HN       LEU  42  72.166  -6.407   2.247
  282    HA   LEU  42           HA       LEU  42  69.583  -5.757   1.218
  283   1HB   LEU  42           HB2      LEU  42  72.308  -4.660   1.041
  284   2HB   LEU  42           HB1      LEU  42  71.296  -4.317  -0.364
  285    HG   LEU  42           HG       LEU  42  69.619  -3.274   0.976
  286   1HD1  LEU  42          HD13      LEU  42  71.159  -4.403   3.332
  287   2HD1  LEU  42          HD12      LEU  42  69.863  -3.218   3.489
  288   3HD1  LEU  42          HD11      LEU  42  69.518  -4.818   2.835
  289   1HD2  LEU  42          HD21      LEU  42  71.881  -2.087   0.603
  290   2HD2  LEU  42          HD23      LEU  42  70.803  -1.417   1.828
  291   3HD2  LEU  42          HD22      LEU  42  72.179  -2.411   2.310
  292    H    GLY  43           HN       GLY  43  72.423  -7.259  -0.331
  293   1HA   GLY  43           HA2      GLY  43  71.504  -7.294  -2.989
  294   2HA   GLY  43           HA1      GLY  43  72.496  -8.577  -2.285
  295    H    THR  44           HN       THR  44  70.598  -9.304  -0.241
  296    HA   THR  44           HA       THR  44  68.924 -11.108  -1.792
  297    HB   THR  44           HB       THR  44  69.070 -10.542   1.183
  298    HG1  THR  44           HG1      THR  44  70.361 -12.235  -0.602
  299   1HG2  THR  44          HG21      THR  44  66.882 -11.539   0.170
  300   2HG2  THR  44          HG23      THR  44  67.854 -12.993  -0.068
  301   3HG2  THR  44          HG22      THR  44  67.619 -12.346   1.555
  302    H    VAL  45           HN       VAL  45  68.438  -8.062  -0.059
  303    HA   VAL  45           HA       VAL  45  65.566  -8.213   0.022
  304    HB   VAL  45           HB       VAL  45  67.245  -5.698  -0.119
  305   1HG1  VAL  45          HG12      VAL  45  64.435  -6.282   0.226
  306   2HG1  VAL  45          HG11      VAL  45  65.070  -5.498   1.673
  307   3HG1  VAL  45          HG13      VAL  45  65.233  -4.714   0.101
  308   1HG2  VAL  45          HG22      VAL  45  67.654  -7.703   1.687
  309   2HG2  VAL  45          HG21      VAL  45  67.901  -5.995   2.052
  310   3HG2  VAL  45          HG23      VAL  45  66.388  -6.782   2.502
  311    H    MET  46           HN       MET  46  67.814  -6.755  -2.333
  312    HA   MET  46           HA       MET  46  65.747  -5.687  -4.021
  313   1HB   MET  46           HB2      MET  46  68.617  -6.455  -4.624
  314   2HB   MET  46           HB1      MET  46  67.569  -5.587  -5.745
  315   1HG   MET  46           HG2      MET  46  67.206  -3.986  -3.671
  316   2HG   MET  46           HG1      MET  46  68.753  -4.659  -3.154
  317   1HE   MET  46           HE3      MET  46  67.512  -1.998  -3.851
  318   2HE   MET  46           HE2      MET  46  68.751  -1.038  -4.654
  319   3HE   MET  46           HE1      MET  46  67.375  -1.636  -5.577
  320    H    ARG  47           HN       ARG  47  67.788  -8.617  -4.456
  321    HA   ARG  47           HA       ARG  47  66.625  -9.636  -6.760
  322   1HB   ARG  47           HB2      ARG  47  67.326 -11.823  -6.066
  323   2HB   ARG  47           HB1      ARG  47  68.498 -10.686  -5.402
  324   1HG   ARG  47           HG2      ARG  47  67.413 -10.754  -3.231
  325   2HG   ARG  47           HG1      ARG  47  66.118 -11.766  -3.869
  326   1HD   ARG  47           HD2      ARG  47  69.042 -12.510  -3.606
  327   2HD   ARG  47           HD1      ARG  47  67.688 -13.202  -2.714
  328    HE   ARG  47           HE       ARG  47  68.127 -13.592  -5.646
  329   1HH1  ARG  47          HH11      ARG  47  67.973 -15.123  -2.684
  330   2HH1  ARG  47          HH12      ARG  47  66.860 -16.357  -3.172
  331   1HH2  ARG  47          HH21      ARG  47  66.194 -14.909  -6.252
  332   2HH2  ARG  47          HH22      ARG  47  65.852 -16.238  -5.193
  333    H    MET  48           HN       MET  48  65.323  -9.806  -3.460
  334    HA   MET  48           HA       MET  48  63.046 -11.440  -4.205
  335   1HB   MET  48           HB2      MET  48  63.917  -9.911  -1.799
  336   2HB   MET  48           HB1      MET  48  62.191 -10.238  -1.953
  337   1HG   MET  48           HG2      MET  48  62.941 -12.676  -2.485
  338   2HG   MET  48           HG1      MET  48  64.468 -12.197  -1.748
  339   1HE   MET  48           HE2      MET  48  65.062 -12.106   0.149
  340   2HE   MET  48           HE1      MET  48  64.216 -11.043   1.271
  341   3HE   MET  48           HE3      MET  48  64.268 -12.787   1.566
  342    H    LEU  49           HN       LEU  49  63.017  -8.070  -3.010
  343    HA   LEU  49           HA       LEU  49  60.685  -7.569  -4.794
  344   1HB   LEU  49           HB2      LEU  49  60.457  -5.486  -3.339
  345   2HB   LEU  49           HB1      LEU  49  60.190  -7.024  -2.516
  346    HG   LEU  49           HG       LEU  49  63.004  -6.252  -2.509
  347   1HD1  LEU  49          HD12      LEU  49  60.947  -4.394  -1.290
  348   2HD1  LEU  49          HD11      LEU  49  62.638  -4.426  -0.792
  349   3HD1  LEU  49          HD13      LEU  49  62.214  -3.977  -2.443
  350   1HD2  LEU  49          HD22      LEU  49  61.167  -7.721  -0.968
  351   2HD2  LEU  49          HD21      LEU  49  62.873  -7.457  -0.605
  352   3HD2  LEU  49          HD23      LEU  49  61.653  -6.371   0.059
  353    H    GLY  50           HN       GLY  50  62.881  -7.607  -6.316
  354   1HA   GLY  50           HA2      GLY  50  63.041  -5.013  -7.448
  355   2HA   GLY  50           HA1      GLY  50  64.450  -5.223  -6.407
  356    H    GLN  51           HN       GLN  51  66.197  -6.112  -7.374
  357    HA   GLN  51           HA       GLN  51  65.783  -8.096  -9.547
  358   1HB   GLN  51           HB2      GLN  51  67.563  -6.924 -10.890
  359   2HB   GLN  51           HB1      GLN  51  66.065  -6.006 -10.737
  360   1HG   GLN  51           HG2      GLN  51  67.347  -5.099  -8.547
  361   2HG   GLN  51           HG1      GLN  51  68.742  -5.465  -9.561
  362   1HE2  GLN  51          HE22      GLN  51  66.740  -2.105 -10.282
  363   2HE2  GLN  51          HE21      GLN  51  66.651  -2.980  -8.831
  364    H    ASN  52           HN       ASN  52  68.036  -9.056 -10.144
  365    HA   ASN  52           HA       ASN  52  69.719  -9.210  -7.675
  366   1HB   ASN  52           HB2      ASN  52  70.140 -11.638  -8.483
  367   2HB   ASN  52           HB1      ASN  52  68.595 -11.291  -7.704
  368   1HD2  ASN  52          HD22      ASN  52  67.117 -12.811 -10.549
  369   2HD2  ASN  52          HD21      ASN  52  67.418 -12.941  -8.883
  370    HA   PRO  53           HA       PRO  53  72.277  -8.096 -11.354
  371   1HB   PRO  53           HB2      PRO  53  73.393  -5.864 -10.200
  372   2HB   PRO  53           HB1      PRO  53  71.884  -5.835 -11.130
  373   1HG   PRO  53           HG2      PRO  53  72.273  -5.648  -8.179
  374   2HG   PRO  53           HG1      PRO  53  70.950  -5.025  -9.178
  375   1HD   PRO  53           HD2      PRO  53  70.869  -7.370  -7.592
  376   2HD   PRO  53           HD1      PRO  53  69.689  -6.909  -8.837
  377    H    THR  54           HN       THR  54  74.809  -7.065 -10.775
  378    HA   THR  54           HA       THR  54  76.057  -9.368  -9.452
  379    HB   THR  54           HB       THR  54  77.175  -8.598 -11.420
  380    HG1  THR  54           HG1      THR  54  78.565  -9.070  -9.674
  381   1HG2  THR  54          HG22      THR  54  76.842  -5.884 -10.151
  382   2HG2  THR  54          HG21      THR  54  78.042  -6.159 -11.412
  383   3HG2  THR  54          HG23      THR  54  76.332  -6.420 -11.752
  384    H    LYS  55           HN       LYS  55  77.293  -9.261  -7.533
  385    HA   LYS  55           HA       LYS  55  76.394  -7.572  -5.465
  386   1HB   LYS  55           HB2      LYS  55  77.664  -9.662  -5.077
  387   2HB   LYS  55           HB1      LYS  55  79.118  -8.888  -5.709
  388   1HG   LYS  55           HG2      LYS  55  78.926  -7.152  -3.927
  389   2HG   LYS  55           HG1      LYS  55  77.546  -8.026  -3.263
  390   1HD   LYS  55           HD2      LYS  55  80.294  -9.247  -3.646
  391   2HD   LYS  55           HD1      LYS  55  79.721  -8.566  -2.122
  392   1HE   LYS  55           HE2      LYS  55  78.866 -10.608  -1.679
  393   2HE   LYS  55           HE1      LYS  55  77.650 -10.250  -2.906
  394   1HZ   LYS  55           HZ3      LYS  55  80.201 -11.175  -3.918
  395   2HZ   LYS  55           HZ2      LYS  55  79.324 -12.324  -3.023
  396   3HZ   LYS  55           HZ1      LYS  55  78.628 -11.596  -4.390
  397    H    GLU  56           HN       GLU  56  78.651  -6.922  -8.009
  398    HA   GLU  56           HA       GLU  56  80.213  -4.870  -6.806
  399   1HB   GLU  56           HB2      GLU  56  80.143  -6.009  -9.279
  400   2HB   GLU  56           HB1      GLU  56  79.407  -4.443  -9.626
  401   1HG   GLU  56           HG2      GLU  56  81.723  -4.059  -9.908
  402   2HG   GLU  56           HG1      GLU  56  81.380  -3.436  -8.294
  403    H    GLU  57           HN       GLU  57  77.537  -4.268  -9.108
  404    HA   GLU  57           HA       GLU  57  77.115  -1.581  -8.564
  405   1HB   GLU  57           HB2      GLU  57  75.870  -3.075 -10.231
  406   2HB   GLU  57           HB1      GLU  57  74.815  -3.518  -8.889
  407   1HG   GLU  57           HG2      GLU  57  73.629  -1.641  -9.240
  408   2HG   GLU  57           HG1      GLU  57  75.061  -0.690  -8.841
  409    H    LEU  58           HN       LEU  58  75.971  -4.360  -6.676
  410    HA   LEU  58           HA       LEU  58  74.276  -2.997  -4.866
  411   1HB   LEU  58           HB2      LEU  58  75.793  -5.534  -4.874
  412   2HB   LEU  58           HB1      LEU  58  75.437  -4.891  -3.270
  413    HG   LEU  58           HG       LEU  58  73.653  -6.422  -4.199
  414   1HD1  LEU  58          HD13      LEU  58  72.988  -3.533  -3.574
  415   2HD1  LEU  58          HD12      LEU  58  71.775  -4.809  -3.664
  416   3HD1  LEU  58          HD11      LEU  58  73.047  -4.887  -2.444
  417   1HD2  LEU  58          HD23      LEU  58  74.054  -5.004  -6.518
  418   2HD2  LEU  58          HD22      LEU  58  72.630  -5.991  -6.188
  419   3HD2  LEU  58          HD21      LEU  58  72.586  -4.253  -5.892
  420    H    ASP  59           HN       ASP  59  77.792  -3.614  -4.619
  421    HA   ASP  59           HA       ASP  59  78.194  -2.304  -2.131
  422   1HB   ASP  59           HB2      ASP  59  79.871  -3.714  -3.445
  423   2HB   ASP  59           HB1      ASP  59  80.169  -2.279  -4.426
  424    H    ALA  60           HN       ALA  60  78.373  -1.004  -5.457
  425    HA   ALA  60           HA       ALA  60  79.030   1.673  -4.697
  426   1HB   ALA  60           HB1      ALA  60  79.095   0.648  -7.044
  427   2HB   ALA  60           HB3      ALA  60  77.353   0.916  -7.099
  428   3HB   ALA  60           HB2      ALA  60  78.450   2.286  -6.933
  429    H    ILE  61           HN       ILE  61  76.081  -0.130  -4.554
  430    HA   ILE  61           HA       ILE  61  74.307   2.178  -4.473
  431    HB   ILE  61           HB       ILE  61  73.982  -0.749  -3.789
  432   1HG1  ILE  61          HG12      ILE  61  72.733   1.021  -5.915
  433   2HG1  ILE  61          HG11      ILE  61  74.105  -0.056  -6.182
  434   1HG2  ILE  61          HG23      ILE  61  72.582   0.686  -2.278
  435   2HG2  ILE  61          HG22      ILE  61  71.832   1.386  -3.713
  436   3HG2  ILE  61          HG21      ILE  61  71.631  -0.331  -3.361
  437   1HD1  ILE  61          HD12      ILE  61  71.432  -1.005  -5.122
  438   2HD1  ILE  61          HD11      ILE  61  71.859  -1.029  -6.833
  439   3HD1  ILE  61          HD13      ILE  61  72.777  -2.000  -5.681
  440    H    ILE  62           HN       ILE  62  75.609  -0.069  -2.015
  441    HA   ILE  62           HA       ILE  62  74.437   1.252   0.232
  442    HB   ILE  62           HB       ILE  62  76.878  -0.507  -0.071
  443   1HG1  ILE  62          HG12      ILE  62  74.529  -1.265   1.572
  444   2HG1  ILE  62          HG11      ILE  62  74.230  -1.127  -0.161
  445   1HG2  ILE  62          HG23      ILE  62  77.188   1.040   1.850
  446   2HG2  ILE  62          HG22      ILE  62  75.633   0.520   2.498
  447   3HG2  ILE  62          HG21      ILE  62  76.967  -0.628   2.375
  448   1HD1  ILE  62          HD13      ILE  62  76.513  -2.725   1.028
  449   2HD1  ILE  62          HD12      ILE  62  74.962  -3.426   0.568
  450   3HD1  ILE  62          HD11      ILE  62  75.998  -2.700  -0.659
  451    H    GLU  63           HN       GLU  63  77.207   1.994  -1.738
  452    HA   GLU  63           HA       GLU  63  78.608   3.662   0.137
  453   1HB   GLU  63           HB2      GLU  63  79.002   2.804  -2.501
  454   2HB   GLU  63           HB1      GLU  63  78.853   4.558  -2.619
  455   1HG   GLU  63           HG2      GLU  63  81.161   4.172  -2.205
  456   2HG   GLU  63           HG1      GLU  63  80.497   4.663  -0.646
  457    H    GLU  64           HN       GLU  64  76.004   4.296  -2.187
  458    HA   GLU  64           HA       GLU  64  76.023   7.168  -1.527
  459   1HB   GLU  64           HB2      GLU  64  74.770   5.440  -3.568
  460   2HB   GLU  64           HB1      GLU  64  73.754   6.768  -3.005
  461   1HG   GLU  64           HG2      GLU  64  75.487   8.389  -3.530
  462   2HG   GLU  64           HG1      GLU  64  76.613   7.099  -3.953
  463    H    VAL  65           HN       VAL  65  74.502   4.289  -0.422
  464    HA   VAL  65           HA       VAL  65  72.177   5.700   0.712
  465    HB   VAL  65           HB       VAL  65  73.105   2.837   1.096
  466   1HG1  VAL  65          HG12      VAL  65  71.036   4.433   2.322
  467   2HG1  VAL  65          HG11      VAL  65  70.308   3.133   1.377
  468   3HG1  VAL  65          HG13      VAL  65  71.475   2.755   2.645
  469   1HG2  VAL  65          HG21      VAL  65  72.432   3.758  -1.276
  470   2HG2  VAL  65          HG23      VAL  65  71.758   2.228  -0.713
  471   3HG2  VAL  65          HG22      VAL  65  70.795   3.705  -0.619
  472    H    ASP  66           HN       ASP  66  75.377   4.763   1.662
  473    HA   ASP  66           HA       ASP  66  74.772   5.056   4.540
  474   1HB   ASP  66           HB2      ASP  66  76.878   3.853   2.952
  475   2HB   ASP  66           HB1      ASP  66  77.559   4.935   4.167
  476    H    GLU  67           HN       GLU  67  74.062   7.393   3.779
  477    HA   GLU  67           HA       GLU  67  76.088   9.329   3.173
  478   1HB   GLU  67           HB2      GLU  67  74.422  10.992   3.707
  479   2HB   GLU  67           HB1      GLU  67  73.593   9.654   2.909
  480   1HG   GLU  67           HG2      GLU  67  72.838   8.773   5.036
  481   2HG   GLU  67           HG1      GLU  67  73.802   9.960   5.918
  482    H    ASP  68           HN       ASP  68  75.201   7.722   6.104
  483    HA   ASP  68           HA       ASP  68  76.702   9.726   7.720
  484   1HB   ASP  68           HB2      ASP  68  75.804   8.198   9.635
  485   2HB   ASP  68           HB1      ASP  68  74.669   9.269   8.811
  486    H    GLY  69           HN       GLY  69  76.777   6.415   6.571
  487   1HA   GLY  69           HA2      GLY  69  78.631   4.954   6.478
  488   2HA   GLY  69           HA1      GLY  69  79.603   6.205   7.257
  489    H    SER  70           HN       SER  70  76.569   4.998   8.583
  490    HA   SER  70           HA       SER  70  77.746   4.487  11.151
  491   1HB   SER  70           HB2      SER  70  75.482   3.084  11.336
  492   2HB   SER  70           HB1      SER  70  75.475   4.845  11.358
  493    HG   SER  70           HG       SER  70  74.325   3.209   9.617
  494    H    GLY  71           HN       GLY  71  77.339   2.540   8.284
  495   1HA   GLY  71           HA2      GLY  71  78.778   0.582   7.968
  496   2HA   GLY  71           HA1      GLY  71  78.701   0.301   9.708
  497    H    THR  72           HN       THR  72  75.665   1.212   8.624
  498    HA   THR  72           HA       THR  72  74.818  -1.478   7.768
  499    HB   THR  72           HB       THR  72  72.962  -1.024   9.747
  500    HG1  THR  72           HG1      THR  72  73.924   0.418  10.959
  501   1HG2  THR  72          HG23      THR  72  75.426  -2.708   9.509
  502   2HG2  THR  72          HG22      THR  72  74.539  -2.714  11.034
  503   3HG2  THR  72          HG21      THR  72  73.733  -3.201   9.543
  504    H    ILE  73           HN       ILE  73  72.222  -1.364   7.649
  505    HA   ILE  73           HA       ILE  73  71.566   1.309   6.469
  506    HB   ILE  73           HB       ILE  73  70.587  -1.436   5.635
  507   1HG1  ILE  73          HG12      ILE  73  72.975  -0.716   5.042
  508   2HG1  ILE  73          HG11      ILE  73  71.939  -1.166   3.688
  509   1HG2  ILE  73          HG21      ILE  73  68.889   0.377   5.401
  510   2HG2  ILE  73          HG23      ILE  73  70.037   1.286   4.417
  511   3HG2  ILE  73          HG22      ILE  73  69.415  -0.262   3.845
  512   1HD1  ILE  73          HD12      ILE  73  71.605   1.639   4.297
  513   2HD1  ILE  73          HD11      ILE  73  73.312   1.275   4.044
  514   3HD1  ILE  73          HD13      ILE  73  72.134   0.891   2.790
  515    H    ASP  74           HN       ASP  74  69.606   2.221   7.055
  516    HA   ASP  74           HA       ASP  74  68.013   0.709   9.088
  517   1HB   ASP  74           HB2      ASP  74  67.928   3.704   8.786
  518   2HB   ASP  74           HB1      ASP  74  67.575   2.725  10.210
  519    H    PHE  75           HN       PHE  75  65.626   1.425   9.079
  520    HA   PHE  75           HA       PHE  75  64.434   0.872   6.591
  521   1HB   PHE  75           HB2      PHE  75  63.384   0.996   8.981
  522   2HB   PHE  75           HB1      PHE  75  63.072   2.684   8.573
  523    HD1  PHE  75           HD2      PHE  75  63.025  -0.426   6.485
  524    HD2  PHE  75           HD1      PHE  75  60.794   2.894   8.049
  525    HE1  PHE  75           HE2      PHE  75  61.057  -1.115   5.141
  526    HE2  PHE  75           HE1      PHE  75  58.827   2.206   6.705
  527    HZ   PHE  75           HZ       PHE  75  58.958   0.201   5.251
  528    H    GLU  76           HN       GLU  76  65.418   3.980   7.964
  529    HA   GLU  76           HA       GLU  76  64.138   5.621   5.979
  530   1HB   GLU  76           HB2      GLU  76  66.692   6.312   7.442
  531   2HB   GLU  76           HB1      GLU  76  65.448   7.414   6.850
  532   1HG   GLU  76           HG2      GLU  76  64.216   5.495   8.589
  533   2HG   GLU  76           HG1      GLU  76  65.612   6.190   9.414
  534    H    GLU  77           HN       GLU  77  67.415   4.236   6.209
  535    HA   GLU  77           HA       GLU  77  68.284   5.411   3.697
  536   1HB   GLU  77           HB2      GLU  77  69.446   3.036   5.181
  537   2HB   GLU  77           HB1      GLU  77  70.263   4.026   3.973
  538   1HG   GLU  77           HG2      GLU  77  70.035   6.002   5.445
  539   2HG   GLU  77           HG1      GLU  77  69.249   4.993   6.661
  540    H    PHE  78           HN       PHE  78  66.392   2.679   4.553
  541    HA   PHE  78           HA       PHE  78  67.020   0.972   2.324
  542   1HB   PHE  78           HB2      PHE  78  65.414   0.786   4.582
  543   2HB   PHE  78           HB1      PHE  78  64.251   0.818   3.257
  544    HD1  PHE  78           HD1      PHE  78  67.263  -0.914   4.573
  545    HD2  PHE  78           HD2      PHE  78  64.031  -1.021   1.748
  546    HE1  PHE  78           HE1      PHE  78  67.820  -3.268   4.027
  547    HE2  PHE  78           HE2      PHE  78  64.585  -3.373   1.202
  548    HZ   PHE  78           HZ       PHE  78  66.482  -4.498   2.340
  549    H    LEU  79           HN       LEU  79  64.101   2.976   2.864
  550    HA   LEU  79           HA       LEU  79  63.042   2.804   0.281
  551   1HB   LEU  79           HB2      LEU  79  63.025   5.346   1.927
  552   2HB   LEU  79           HB1      LEU  79  61.805   4.801   0.774
  553    HG   LEU  79           HG       LEU  79  62.261   2.769   2.782
  554   1HD1  LEU  79          HD11      LEU  79  62.632   5.306   3.829
  555   2HD1  LEU  79          HD13      LEU  79  60.921   5.002   4.128
  556   3HD1  LEU  79          HD12      LEU  79  62.137   3.885   4.749
  557   1HD2  LEU  79          HD22      LEU  79  60.268   3.062   1.282
  558   2HD2  LEU  79          HD21      LEU  79  59.844   2.911   2.989
  559   3HD2  LEU  79          HD23      LEU  79  59.834   4.496   2.214
  560    H    VAL  80           HN       VAL  80  65.836   4.580   1.385
  561    HA   VAL  80           HA       VAL  80  66.012   6.386  -0.867
  562    HB   VAL  80           HB       VAL  80  68.248   5.347   0.899
  563   1HG1  VAL  80          HG11      VAL  80  67.954   7.752  -0.917
  564   2HG1  VAL  80          HG13      VAL  80  69.238   7.597   0.282
  565   3HG1  VAL  80          HG12      VAL  80  69.133   6.447  -1.049
  566   1HG2  VAL  80          HG21      VAL  80  66.028   6.658   1.785
  567   2HG2  VAL  80          HG23      VAL  80  67.621   6.825   2.524
  568   3HG2  VAL  80          HG22      VAL  80  67.060   8.022   1.356
  569    H    MET  81           HN       MET  81  67.444   3.203  -0.149
  570    HA   MET  81           HA       MET  81  69.078   2.981  -2.450
  571   1HB   MET  81           HB2      MET  81  68.585   1.371  -0.330
  572   2HB   MET  81           HB1      MET  81  67.662   0.524  -1.570
  573   1HG   MET  81           HG2      MET  81  69.553   0.134  -2.898
  574   2HG   MET  81           HG1      MET  81  70.469   1.440  -2.145
  575   1HE   MET  81           HE1      MET  81  70.331   1.585   0.309
  576   2HE   MET  81           HE3      MET  81  69.865   0.259   1.382
  577   3HE   MET  81           HE2      MET  81  71.566   0.561   1.037
  578    H    MET  82           HN       MET  82  65.653   2.078  -1.998
  579    HA   MET  82           HA       MET  82  65.242   0.984  -4.590
  580   1HB   MET  82           HB2      MET  82  63.317   2.441  -2.754
  581   2HB   MET  82           HB1      MET  82  62.830   1.545  -4.193
  582   1HG   MET  82           HG2      MET  82  64.579   0.135  -2.230
  583   2HG   MET  82           HG1      MET  82  62.895   0.394  -1.777
  584   1HE   MET  82           HE2      MET  82  65.476  -1.192  -3.730
  585   2HE   MET  82           HE1      MET  82  64.776  -2.516  -2.802
  586   3HE   MET  82           HE3      MET  82  64.732  -2.549  -4.570
  587    H    VAL  83           HN       VAL  83  64.322   4.269  -3.471
  588    HA   VAL  83           HA       VAL  83  63.937   5.201  -6.191
  589    HB   VAL  83           HB       VAL  83  64.340   6.935  -3.747
  590   1HG1  VAL  83          HG13      VAL  83  63.284   7.254  -6.503
  591   2HG1  VAL  83          HG12      VAL  83  62.362   8.051  -5.229
  592   3HG1  VAL  83          HG11      VAL  83  64.069   8.436  -5.456
  593   1HG2  VAL  83          HG23      VAL  83  62.068   5.149  -4.532
  594   2HG2  VAL  83          HG22      VAL  83  62.664   5.560  -2.923
  595   3HG2  VAL  83          HG21      VAL  83  61.688   6.719  -3.825
  596    H    ARG  84           HN       ARG  84  66.724   4.480  -4.553
  597    HA   ARG  84           HA       ARG  84  68.376   6.750  -5.160
  598   1HB   ARG  84           HB2      ARG  84  69.168   5.175  -3.531
  599   2HB   ARG  84           HB1      ARG  84  69.020   3.834  -4.667
  600   1HG   ARG  84           HG2      ARG  84  71.116   4.206  -5.382
  601   2HG   ARG  84           HG1      ARG  84  70.657   5.833  -5.881
  602   1HD   ARG  84           HD2      ARG  84  71.420   5.100  -3.044
  603   2HD   ARG  84           HD1      ARG  84  72.546   5.778  -4.220
  604    HE   ARG  84           HE       ARG  84  70.249   7.214  -3.005
  605   1HH1  ARG  84          HH11      ARG  84  70.788   7.902  -5.928
  606   2HH1  ARG  84          HH12      ARG  84  71.856   9.255  -5.760
  607   1HH2  ARG  84          HH21      ARG  84  72.569   8.620  -2.427
  608   2HH2  ARG  84          HH22      ARG  84  72.864   9.662  -3.778
  609    H    GLN  85           HN       GLN  85  67.568   3.792  -6.954
  610    HA   GLN  85           HA       GLN  85  68.964   5.000  -9.312
  611   1HB   GLN  85           HB2      GLN  85  68.676   2.102  -8.488
  612   2HB   GLN  85           HB1      GLN  85  69.179   2.590 -10.107
  613   1HG   GLN  85           HG2      GLN  85  70.661   4.024  -8.052
  614   2HG   GLN  85           HG1      GLN  85  70.846   2.279  -7.884
  615   1HE2  GLN  85          HE22      GLN  85  72.761   1.926 -10.843
  616   2HE2  GLN  85          HE21      GLN  85  71.966   1.129  -9.573
  617    H    MET  86           HN       MET  86  66.208   3.008  -8.248
  618    HA   MET  86           HA       MET  86  64.901   2.643 -10.694
  619   1HB   MET  86           HB2      MET  86  62.902   2.310  -9.466
  620   2HB   MET  86           HB1      MET  86  64.182   1.870  -8.336
  621   1HG   MET  86           HG2      MET  86  63.252   3.351  -6.905
  622   2HG   MET  86           HG1      MET  86  63.888   4.613  -7.961
  623   1HE   MET  86           HE3      MET  86  61.395   2.465  -6.741
  624   2HE   MET  86           HE2      MET  86  59.900   3.391  -6.832
  625   3HE   MET  86           HE1      MET  86  60.281   2.220  -8.092
  626    H    LYS  87           HN       LYS  87  65.425   5.587  -8.939
  627    HA   LYS  87           HA       LYS  87  63.315   7.096 -10.265
  628   1HB   LYS  87           HB2      LYS  87  65.012   7.520  -8.079
  629   2HB   LYS  87           HB1      LYS  87  65.532   8.704  -9.278
  630   1HG   LYS  87           HG2      LYS  87  62.596   8.347  -8.818
  631   2HG   LYS  87           HG1      LYS  87  63.530   9.245  -7.619
  632   1HD   LYS  87           HD2      LYS  87  62.954  10.960  -9.073
  633   2HD   LYS  87           HD1      LYS  87  64.500  10.461  -9.761
  634   1HE   LYS  87           HE2      LYS  87  63.530   9.697 -11.657
  635   2HE   LYS  87           HE1      LYS  87  62.243   8.885 -10.765
  636   1HZ   LYS  87           HZ3      LYS  87  62.312  11.823 -11.111
  637   2HZ   LYS  87           HZ2      LYS  87  61.565  10.797 -12.241
  638   3HZ   LYS  87           HZ1      LYS  87  61.003  10.852 -10.639
  639    H    GLU  88           HN       GLU  88  66.890   7.343 -10.465
  640    HA   GLU  88           HA       GLU  88  66.530   8.079 -13.344
  641   1HB   GLU  88           HB2      GLU  88  67.722   9.584 -11.235
  642   2HB   GLU  88           HB1      GLU  88  69.015   9.074 -12.322
  643   1HG   GLU  88           HG2      GLU  88  67.469   9.862 -14.232
  644   2HG   GLU  88           HG1      GLU  88  66.553  10.692 -12.974
  645    H    ASP  89           HN       ASP  89  68.093   7.222 -14.794
  646    HA   ASP  89           HA       ASP  89  70.166   5.420 -13.687
  647   1HB   ASP  89           HB2      ASP  89  67.697   4.543 -15.060
  648   2HB   ASP  89           HB1      ASP  89  69.187   3.830 -15.680
  649    H    ALA  90           HN       ALA  90  71.662   6.922 -14.621
  650    HA   ALA  90           HA       ALA  90  71.565   7.860 -17.307
  651   1HB   ALA  90           HB3      ALA  90  73.247   8.245 -15.159
  652   2HB   ALA  90           HB2      ALA  90  74.269   7.333 -16.270
  653   3HB   ALA  90           HB1      ALA  90  73.540   8.853 -16.788
   
  No H/Q in entry =         653
  Start of MODEL   17
    1   1H    ALA   1           HT3      ALA   1  74.194  11.088  11.709
    2   2H    ALA   1           HT2      ALA   1  74.142  11.191  10.015
    3   3H    ALA   1           HT1      ALA   1  75.418  11.914  10.875
    4    HA   ALA   1           HA       ALA   1  73.945  13.515  11.852
    5   1HB   ALA   1           HB1      ALA   1  74.808  13.566   9.310
    6   2HB   ALA   1           HB3      ALA   1  73.071  13.553   8.999
    7   3HB   ALA   1           HB2      ALA   1  73.783  14.839   9.973
    8    H    SER   2           HN       SER   2  71.606  14.526  10.924
    9    HA   SER   2           HA       SER   2  69.650  12.663  12.005
   10   1HB   SER   2           HB2      SER   2  69.639  15.482  11.032
   11   2HB   SER   2           HB1      SER   2  68.101  14.623  11.035
   12    HG   SER   2           HG       SER   2  69.108  15.798  13.051
   13    H    MET   3           HN       MET   3  67.407  12.988  10.444
   14    HA   MET   3           HA       MET   3  67.716  11.037   8.421
   15   1HB   MET   3           HB2      MET   3  65.507  12.019   7.541
   16   2HB   MET   3           HB1      MET   3  65.509  11.442   9.208
   17   1HG   MET   3           HG2      MET   3  66.384  14.199   9.098
   18   2HG   MET   3           HG1      MET   3  64.813  14.020   8.316
   19   1HE   MET   3           HE1      MET   3  65.332  15.735  10.306
   20   2HE   MET   3           HE3      MET   3  63.837  15.595  11.240
   21   3HE   MET   3           HE2      MET   3  65.392  15.291  12.009
   22    H    THR   4           HN       THR   4  69.233  11.378   6.825
   23    HA   THR   4           HA       THR   4  70.042  13.806   5.689
   24    HB   THR   4           HB       THR   4  70.099  12.030   3.543
   25    HG1  THR   4           HG1      THR   4  70.983  10.197   5.024
   26   1HG2  THR   4          HG23      THR   4  71.899  13.098   5.577
   27   2HG2  THR   4          HG22      THR   4  72.394  11.499   5.024
   28   3HG2  THR   4          HG21      THR   4  72.192  12.810   3.862
   29    H    ASP   5           HN       ASP   5  69.481  14.730   3.539
   30    HA   ASP   5           HA       ASP   5  66.637  15.137   3.290
   31   1HB   ASP   5           HB2      ASP   5  69.055  15.959   1.705
   32   2HB   ASP   5           HB1      ASP   5  67.444  16.204   1.026
   33    H    GLN   6           HN       GLN   6  68.863  12.852   1.914
   34    HA   GLN   6           HA       GLN   6  67.486  12.167  -0.474
   35   1HB   GLN   6           HB2      GLN   6  68.721  10.116  -0.429
   36   2HB   GLN   6           HB1      GLN   6  69.772  11.336   0.293
   37   1HG   GLN   6           HG2      GLN   6  68.886  10.611   2.556
   38   2HG   GLN   6           HG1      GLN   6  68.112   9.255   1.735
   39   1HE2  GLN   6          HE22      GLN   6  71.718   8.427   0.617
   40   2HE2  GLN   6          HE21      GLN   6  70.492   9.225  -0.240
   41    H    GLN   7           HN       GLN   7  66.892  11.277   2.885
   42    HA   GLN   7           HA       GLN   7  64.940   9.223   2.264
   43   1HB   GLN   7           HB2      GLN   7  65.568  10.792   4.774
   44   2HB   GLN   7           HB1      GLN   7  64.305   9.560   4.711
   45   1HG   GLN   7           HG2      GLN   7  65.820   7.899   4.851
   46   2HG   GLN   7           HG1      GLN   7  66.768   8.579   3.528
   47   1HE2  GLN   7          HE22      GLN   7  68.773   8.686   6.731
   48   2HE2  GLN   7          HE21      GLN   7  67.972   7.434   5.909
   49    H    ALA   8           HN       ALA   8  64.857  12.699   2.647
   50    HA   ALA   8           HA       ALA   8  62.003  12.927   3.035
   51   1HB   ALA   8           HB1      ALA   8  63.787  14.713   3.493
   52   2HB   ALA   8           HB3      ALA   8  63.782  15.010   1.755
   53   3HB   ALA   8           HB2      ALA   8  62.314  15.266   2.696
   54    H    GLU   9           HN       GLU   9  64.114  13.039   0.168
   55    HA   GLU   9           HA       GLU   9  61.810  13.409  -1.618
   56   1HB   GLU   9           HB2      GLU   9  64.600  13.829  -1.801
   57   2HB   GLU   9           HB1      GLU   9  64.216  12.574  -2.980
   58   1HG   GLU   9           HG2      GLU   9  62.423  13.994  -3.910
   59   2HG   GLU   9           HG1      GLU   9  62.817  15.255  -2.739
   60    H    ALA  10           HN       ALA  10  63.512  10.778  -0.194
   61    HA   ALA  10           HA       ALA  10  63.039   8.803  -2.239
   62   1HB   ALA  10           HB3      ALA  10  63.720   8.732   0.682
   63   2HB   ALA  10           HB2      ALA  10  63.198   7.245  -0.112
   64   3HB   ALA  10           HB1      ALA  10  64.629   8.098  -0.691
   65    H    ARG  11           HN       ARG  11  61.282   9.600   0.776
   66    HA   ARG  11           HA       ARG  11  59.156   7.720   0.307
   67   1HB   ARG  11           HB2      ARG  11  59.752   9.875   2.207
   68   2HB   ARG  11           HB1      ARG  11  58.033   9.736   1.837
   69   1HG   ARG  11           HG2      ARG  11  57.843   7.766   2.937
   70   2HG   ARG  11           HG1      ARG  11  59.338   7.140   2.242
   71   1HD   ARG  11           HD2      ARG  11  59.999   7.327   4.447
   72   2HD   ARG  11           HD1      ARG  11  60.423   8.944   3.882
   73    HE   ARG  11           HE       ARG  11  58.525   8.424   5.908
   74   1HH1  ARG  11          HH21      ARG  11  56.443   8.945   3.940
   75   2HH1  ARG  11          HH22      ARG  11  56.322  10.672   3.916
   76   1HH2  ARG  11          HH11      ARG  11  59.393  11.170   5.450
   77   2HH2  ARG  11          HH12      ARG  11  57.994  11.932   4.770
   78    H    ALA  12           HN       ALA  12  59.733  11.025  -0.742
   79    HA   ALA  12           HA       ALA  12  57.078  11.677  -1.559
   80   1HB   ALA  12           HB3      ALA  12  59.246  13.150  -1.457
   81   2HB   ALA  12           HB2      ALA  12  59.487  12.591  -3.113
   82   3HB   ALA  12           HB1      ALA  12  58.033  13.492  -2.689
   83    H    PHE  13           HN       PHE  13  59.699   9.948  -3.221
   84    HA   PHE  13           HA       PHE  13  58.111   9.656  -5.669
   85   1HB   PHE  13           HB2      PHE  13  60.523   9.791  -5.900
   86   2HB   PHE  13           HB1      PHE  13  60.746   8.443  -4.785
   87    HD1  PHE  13           HD2      PHE  13  60.176   6.144  -5.448
   88    HD2  PHE  13           HD1      PHE  13  59.766   9.431  -8.184
   89    HE1  PHE  13           HE2      PHE  13  59.983   4.548  -7.337
   90    HE2  PHE  13           HE1      PHE  13  59.571   7.834 -10.072
   91    HZ   PHE  13           HZ       PHE  13  59.679   5.393  -9.648
   92    H    LEU  14           HN       LEU  14  58.737   7.829  -2.751
   93    HA   LEU  14           HA       LEU  14  57.449   5.416  -3.892
   94   1HB   LEU  14           HB2      LEU  14  58.493   5.853  -1.079
   95   2HB   LEU  14           HB1      LEU  14  58.106   4.310  -1.844
   96    HG   LEU  14           HG       LEU  14  60.202   6.198  -2.940
   97   1HD1  LEU  14          HD11      LEU  14  60.314   4.641  -0.549
   98   2HD1  LEU  14          HD13      LEU  14  61.336   3.855  -1.752
   99   3HD1  LEU  14          HD12      LEU  14  61.619   5.542  -1.321
  100   1HD2  LEU  14          HD23      LEU  14  59.164   4.441  -4.429
  101   2HD2  LEU  14          HD22      LEU  14  60.905   4.258  -4.207
  102   3HD2  LEU  14          HD21      LEU  14  59.788   3.217  -3.321
  103    H    SER  15           HN       SER  15  55.343   4.888  -3.460
  104    HA   SER  15           HA       SER  15  53.736   6.827  -1.926
  105   1HB   SER  15           HB2      SER  15  53.116   4.508  -3.739
  106   2HB   SER  15           HB1      SER  15  51.867   5.159  -2.682
  107    HG   SER  15           HG       SER  15  52.918   6.172  -4.974
  108    H    GLU  16           HN       GLU  16  52.178   6.009  -0.273
  109    HA   GLU  16           HA       GLU  16  53.473   4.491   1.756
  110   1HB   GLU  16           HB2      GLU  16  50.670   5.435   1.284
  111   2HB   GLU  16           HB1      GLU  16  50.954   4.248   2.557
  112   1HG   GLU  16           HG2      GLU  16  51.773   5.843   3.915
  113   2HG   GLU  16           HG1      GLU  16  52.968   6.302   2.702
  114    H    GLU  17           HN       GLU  17  51.451   3.522  -0.935
  115    HA   GLU  17           HA       GLU  17  50.747   0.910   0.000
  116   1HB   GLU  17           HB2      GLU  17  50.573   0.407  -2.507
  117   2HB   GLU  17           HB1      GLU  17  49.582   1.739  -1.912
  118   1HG   GLU  17           HG2      GLU  17  50.803   3.323  -3.020
  119   2HG   GLU  17           HG1      GLU  17  52.323   2.463  -2.776
  120    H    MET  18           HN       MET  18  53.666   2.197  -1.483
  121    HA   MET  18           HA       MET  18  54.805  -0.507  -1.813
  122   1HB   MET  18           HB2      MET  18  55.332   2.127  -2.882
  123   2HB   MET  18           HB1      MET  18  56.809   1.446  -2.198
  124   1HG   MET  18           HG2      MET  18  56.779  -0.400  -3.637
  125   2HG   MET  18           HG1      MET  18  55.049  -0.251  -3.950
  126   1HE   MET  18           HE3      MET  18  57.716  -0.627  -5.629
  127   2HE   MET  18           HE2      MET  18  56.307  -0.645  -6.688
  128   3HE   MET  18           HE1      MET  18  57.666   0.416  -7.056
  129    H    ILE  19           HN       ILE  19  55.771   2.483  -0.079
  130    HA   ILE  19           HA       ILE  19  57.867   1.501   1.441
  131    HB   ILE  19           HB       ILE  19  55.652   3.407   2.235
  132   1HG1  ILE  19          HG12      ILE  19  58.335   4.471   2.030
  133   2HG1  ILE  19          HG11      ILE  19  57.909   3.610   0.550
  134   1HG2  ILE  19          HG21      ILE  19  56.644   2.358   4.256
  135   2HG2  ILE  19          HG23      ILE  19  58.248   2.829   3.695
  136   3HG2  ILE  19          HG22      ILE  19  57.069   4.066   4.129
  137   1HD1  ILE  19          HD12      ILE  19  55.735   5.286   1.600
  138   2HD1  ILE  19          HD11      ILE  19  57.169   6.200   1.134
  139   3HD1  ILE  19          HD13      ILE  19  56.364   5.160  -0.042
  140    H    ALA  20           HN       ALA  20  54.427   0.870   1.890
  141    HA   ALA  20           HA       ALA  20  54.661  -0.354   4.487
  142   1HB   ALA  20           HB2      ALA  20  52.533   0.452   3.218
  143   2HB   ALA  20           HB1      ALA  20  52.576  -1.140   2.459
  144   3HB   ALA  20           HB3      ALA  20  52.417  -1.003   4.209
  145    H    GLU  21           HN       GLU  21  54.571  -1.718   1.184
  146    HA   GLU  21           HA       GLU  21  54.803  -4.448   1.961
  147   1HB   GLU  21           HB2      GLU  21  55.715  -3.019  -0.552
  148   2HB   GLU  21           HB1      GLU  21  55.721  -4.773  -0.363
  149   1HG   GLU  21           HG2      GLU  21  53.221  -3.177   0.169
  150   2HG   GLU  21           HG1      GLU  21  53.643  -3.677  -1.470
  151    H    PHE  22           HN       PHE  22  57.290  -1.988   1.311
  152    HA   PHE  22           HA       PHE  22  59.513  -3.809   1.596
  153   1HB   PHE  22           HB2      PHE  22  59.525  -0.820   2.091
  154   2HB   PHE  22           HB1      PHE  22  60.897  -1.834   1.645
  155    HD1  PHE  22           HD1      PHE  22  58.756  -3.463  -0.251
  156    HD2  PHE  22           HD2      PHE  22  60.212   0.570   0.057
  157    HE1  PHE  22           HE1      PHE  22  58.244  -3.094  -2.649
  158    HE2  PHE  22           HE2      PHE  22  59.700   0.935  -2.341
  159    HZ   PHE  22           HZ       PHE  22  58.716  -0.895  -3.694
  160    H    LYS  23           HN       LYS  23  57.594  -1.917   3.854
  161    HA   LYS  23           HA       LYS  23  59.347  -2.009   6.093
  162   1HB   LYS  23           HB2      LYS  23  56.911  -0.917   5.670
  163   2HB   LYS  23           HB1      LYS  23  56.437  -2.335   6.607
  164   1HG   LYS  23           HG2      LYS  23  58.387  -0.162   7.414
  165   2HG   LYS  23           HG1      LYS  23  56.853  -0.568   8.185
  166   1HD   LYS  23           HD2      LYS  23  57.746  -2.781   8.809
  167   2HD   LYS  23           HD1      LYS  23  59.280  -2.378   8.039
  168   1HE   LYS  23           HE2      LYS  23  59.547  -1.945  10.390
  169   2HE   LYS  23           HE1      LYS  23  59.420  -0.379   9.588
  170   1HZ   LYS  23           HZ1      LYS  23  57.126  -1.801  10.819
  171   2HZ   LYS  23           HZ3      LYS  23  58.027  -0.600  11.608
  172   3HZ   LYS  23           HZ2      LYS  23  57.143  -0.215  10.210
  173    H    ALA  24           HN       ALA  24  57.078  -4.388   4.797
  174    HA   ALA  24           HA       ALA  24  57.336  -6.204   7.048
  175   1HB   ALA  24           HB2      ALA  24  55.748  -6.037   4.721
  176   2HB   ALA  24           HB1      ALA  24  56.657  -7.542   4.577
  177   3HB   ALA  24           HB3      ALA  24  55.646  -7.254   5.993
  178    H    ALA  25           HN       ALA  25  59.087  -5.658   4.059
  179    HA   ALA  25           HA       ALA  25  60.553  -8.162   4.128
  180   1HB   ALA  25           HB1      ALA  25  60.184  -6.285   2.212
  181   2HB   ALA  25           HB3      ALA  25  61.772  -5.800   2.803
  182   3HB   ALA  25           HB2      ALA  25  61.523  -7.432   2.185
  183    H    PHE  26           HN       PHE  26  61.793  -4.825   4.553
  184    HA   PHE  26           HA       PHE  26  64.221  -5.519   5.776
  185   1HB   PHE  26           HB2      PHE  26  63.998  -3.249   5.197
  186   2HB   PHE  26           HB1      PHE  26  62.432  -3.101   5.989
  187    HD1  PHE  26           HD2      PHE  26  62.280  -3.023   8.468
  188    HD2  PHE  26           HD1      PHE  26  66.056  -2.987   6.424
  189    HE1  PHE  26           HE2      PHE  26  63.391  -2.226  10.538
  190    HE2  PHE  26           HE1      PHE  26  67.170  -2.190   8.494
  191    HZ   PHE  26           HZ       PHE  26  65.836  -1.809  10.550
  192    H    ASP  27           HN       ASP  27  60.992  -5.604   7.065
  193    HA   ASP  27           HA       ASP  27  61.504  -5.464   9.842
  194   1HB   ASP  27           HB2      ASP  27  59.358  -6.374   8.124
  195   2HB   ASP  27           HB1      ASP  27  59.548  -7.461   9.500
  196    H    MET  28           HN       MET  28  61.267  -8.441   7.855
  197    HA   MET  28           HA       MET  28  62.260 -10.135   9.945
  198   1HB   MET  28           HB2      MET  28  61.590 -11.730   8.502
  199   2HB   MET  28           HB1      MET  28  61.202 -10.462   7.344
  200   1HG   MET  28           HG2      MET  28  62.669 -11.873   6.152
  201   2HG   MET  28           HG1      MET  28  63.719 -10.569   6.704
  202   1HE   MET  28           HE3      MET  28  65.820 -11.135   7.055
  203   2HE   MET  28           HE2      MET  28  66.513 -12.633   7.670
  204   3HE   MET  28           HE1      MET  28  65.704 -12.622   6.104
  205    H    PHE  29           HN       PHE  29  63.856  -8.101   7.612
  206    HA   PHE  29           HA       PHE  29  66.436  -9.453   7.861
  207   1HB   PHE  29           HB2      PHE  29  65.515  -6.880   6.583
  208   2HB   PHE  29           HB1      PHE  29  67.229  -7.282   6.701
  209    HD1  PHE  29           HD2      PHE  29  63.969  -8.825   5.665
  210    HD2  PHE  29           HD1      PHE  29  68.209  -8.559   5.012
  211    HE1  PHE  29           HE2      PHE  29  63.761 -10.336   3.712
  212    HE2  PHE  29           HE1      PHE  29  67.996 -10.073   3.061
  213    HZ   PHE  29           HZ       PHE  29  65.776 -10.960   2.408
  214    H    ASP  30           HN       ASP  30  64.708  -7.067   9.668
  215    HA   ASP  30           HA       ASP  30  67.231  -6.413  11.138
  216   1HB   ASP  30           HB2      ASP  30  66.366  -4.273  11.651
  217   2HB   ASP  30           HB1      ASP  30  65.907  -4.522   9.967
  218    H    ALA  31           HN       ALA  31  65.121  -8.649  11.429
  219    HA   ALA  31           HA       ALA  31  63.810  -8.113  13.965
  220   1HB   ALA  31           HB2      ALA  31  63.593 -10.061  11.977
  221   2HB   ALA  31           HB1      ALA  31  64.222 -10.937  13.371
  222   3HB   ALA  31           HB3      ALA  31  62.714 -10.031  13.504
  223    H    ASP  32           HN       ASP  32  67.012  -8.575  13.227
  224    HA   ASP  32           HA       ASP  32  67.791 -10.381  15.353
  225   1HB   ASP  32           HB2      ASP  32  69.518  -8.251  14.073
  226   2HB   ASP  32           HB1      ASP  32  70.044  -9.758  14.821
  227    H    GLY  33           HN       GLY  33  66.613  -7.221  15.381
  228   1HA   GLY  33           HA2      GLY  33  66.229  -5.904  17.331
  229   2HA   GLY  33           HA1      GLY  33  67.354  -6.935  18.217
  230    H    GLY  34           HN       GLY  34  68.447  -5.789  15.158
  231   1HA   GLY  34           HA2      GLY  34  70.347  -3.985  16.574
  232   2HA   GLY  34           HA1      GLY  34  70.604  -4.676  14.972
  233    H    GLY  35           HN       GLY  35  67.515  -3.866  14.735
  234   1HA   GLY  35           HA2      GLY  35  66.337  -2.035  13.854
  235   2HA   GLY  35           HA1      GLY  35  67.538  -0.990  14.613
  236    H    ASP  36           HN       ASP  36  69.004  -3.320  12.654
  237    HA   ASP  36           HA       ASP  36  68.761  -1.948  10.104
  238   1HB   ASP  36           HB2      ASP  36  71.168  -1.232  10.021
  239   2HB   ASP  36           HB1      ASP  36  70.204  -0.318  11.183
  240    H    ILE  37           HN       ILE  37  70.332  -2.958   8.491
  241    HA   ILE  37           HA       ILE  37  71.257  -5.639   9.398
  242    HB   ILE  37           HB       ILE  37  70.070  -6.796   7.797
  243   1HG1  ILE  37          HG12      ILE  37  70.233  -4.258   6.157
  244   2HG1  ILE  37          HG11      ILE  37  70.895  -5.849   5.783
  245   1HG2  ILE  37          HG22      ILE  37  68.580  -5.120   9.260
  246   2HG2  ILE  37          HG21      ILE  37  68.171  -4.499   7.660
  247   3HG2  ILE  37          HG23      ILE  37  67.864  -6.189   8.055
  248   1HD1  ILE  37          HD11      ILE  37  68.611  -6.747   5.529
  249   2HD1  ILE  37          HD13      ILE  37  67.944  -5.157   5.902
  250   3HD1  ILE  37          HD12      ILE  37  68.884  -5.396   4.429
  251    H    SER  38           HN       SER  38  73.297  -6.090   8.698
  252    HA   SER  38           HA       SER  38  75.016  -4.231   7.563
  253   1HB   SER  38           HB2      SER  38  74.995  -7.238   7.501
  254   2HB   SER  38           HB1      SER  38  76.235  -6.353   6.617
  255    HG   SER  38           HG       SER  38  76.756  -6.900   8.844
  256    H    THR  39           HN       THR  39  75.513  -3.564   5.455
  257    HA   THR  39           HA       THR  39  73.484  -3.800   3.469
  258    HB   THR  39           HB       THR  39  74.868  -2.528   2.075
  259    HG1  THR  39           HG1      THR  39  77.134  -3.430   3.511
  260   1HG2  THR  39          HG21      THR  39  74.824  -1.939   4.843
  261   2HG2  THR  39          HG23      THR  39  76.448  -1.551   4.273
  262   3HG2  THR  39          HG22      THR  39  75.043  -0.809   3.508
  263    H    LYS  40           HN       LYS  40  75.932  -5.979   4.418
  264    HA   LYS  40           HA       LYS  40  76.419  -7.312   1.925
  265   1HB   LYS  40           HB2      LYS  40  76.359  -8.536   4.703
  266   2HB   LYS  40           HB1      LYS  40  77.184  -9.188   3.287
  267   1HG   LYS  40           HG2      LYS  40  78.361  -6.821   3.268
  268   2HG   LYS  40           HG1      LYS  40  77.903  -6.814   4.972
  269   1HD   LYS  40           HD2      LYS  40  79.332  -9.158   3.711
  270   2HD   LYS  40           HD1      LYS  40  80.207  -7.799   4.417
  271   1HE   LYS  40           HE2      LYS  40  78.075  -9.290   5.952
  272   2HE   LYS  40           HE1      LYS  40  79.762  -9.807   5.960
  273   1HZ   LYS  40           HZ2      LYS  40  78.952  -7.033   6.605
  274   2HZ   LYS  40           HZ1      LYS  40  79.053  -8.246   7.792
  275   3HZ   LYS  40           HZ3      LYS  40  80.437  -7.794   6.922
  276    H    ALA  41           HN       ALA  41  73.910  -7.619   4.394
  277    HA   ALA  41           HA       ALA  41  72.586  -9.798   2.905
  278   1HB   ALA  41           HB3      ALA  41  72.710  -9.222   5.573
  279   2HB   ALA  41           HB2      ALA  41  71.160  -8.496   5.148
  280   3HB   ALA  41           HB1      ALA  41  71.446 -10.209   4.840
  281    H    LEU  42           HN       LEU  42  72.737  -6.489   2.623
  282    HA   LEU  42           HA       LEU  42  69.995  -5.763   2.278
  283   1HB   LEU  42           HB2      LEU  42  72.595  -4.571   1.795
  284   2HB   LEU  42           HB1      LEU  42  71.510  -4.242   0.445
  285    HG   LEU  42           HG       LEU  42  71.157  -2.464   1.989
  286   1HD1  LEU  42          HD11      LEU  42  69.111  -3.906   1.152
  287   2HD1  LEU  42          HD13      LEU  42  68.956  -4.303   2.864
  288   3HD1  LEU  42          HD12      LEU  42  68.865  -2.622   2.335
  289   1HD2  LEU  42          HD23      LEU  42  71.676  -4.580   3.943
  290   2HD2  LEU  42          HD22      LEU  42  71.889  -2.835   4.095
  291   3HD2  LEU  42          HD21      LEU  42  70.310  -3.559   4.398
  292    H    GLY  43           HN       GLY  43  72.447  -6.871  -0.075
  293   1HA   GLY  43           HA2      GLY  43  70.851  -6.769  -2.399
  294   2HA   GLY  43           HA1      GLY  43  72.159  -7.925  -2.154
  295    H    THR  44           HN       THR  44  70.621  -8.845   0.345
  296    HA   THR  44           HA       THR  44  69.197 -11.012  -0.972
  297    HB   THR  44           HB       THR  44  69.452 -10.186   1.929
  298    HG1  THR  44           HG1      THR  44  70.628 -12.347   1.728
  299   1HG2  THR  44          HG22      THR  44  67.407 -11.716   0.944
  300   2HG2  THR  44          HG21      THR  44  68.624 -12.943   1.288
  301   3HG2  THR  44          HG23      THR  44  68.068 -11.870   2.571
  302    H    VAL  45           HN       VAL  45  68.243  -8.168   0.956
  303    HA   VAL  45           HA       VAL  45  65.441  -8.706   0.973
  304    HB   VAL  45           HB       VAL  45  66.720  -5.959   0.886
  305   1HG1  VAL  45          HG12      VAL  45  64.095  -6.590   0.814
  306   2HG1  VAL  45          HG11      VAL  45  64.354  -6.627   2.559
  307   3HG1  VAL  45          HG13      VAL  45  64.708  -5.161   1.644
  308   1HG2  VAL  45          HG21      VAL  45  67.588  -7.747   2.625
  309   2HG2  VAL  45          HG23      VAL  45  67.208  -6.111   3.161
  310   3HG2  VAL  45          HG22      VAL  45  66.050  -7.416   3.424
  311    H    MET  46           HN       MET  46  67.203  -6.385  -1.106
  312    HA   MET  46           HA       MET  46  65.080  -5.841  -2.874
  313   1HB   MET  46           HB2      MET  46  66.811  -5.172  -4.501
  314   2HB   MET  46           HB1      MET  46  67.181  -4.567  -2.887
  315   1HG   MET  46           HG2      MET  46  68.589  -6.699  -2.592
  316   2HG   MET  46           HG1      MET  46  68.439  -6.899  -4.338
  317   1HE   MET  46           HE2      MET  46  68.225  -4.664  -5.591
  318   2HE   MET  46           HE1      MET  46  69.390  -3.347  -5.493
  319   3HE   MET  46           HE3      MET  46  69.869  -4.907  -6.175
  320    H    ARG  47           HN       ARG  47  66.905  -8.740  -2.523
  321    HA   ARG  47           HA       ARG  47  66.563  -9.749  -5.211
  322   1HB   ARG  47           HB2      ARG  47  68.206 -10.594  -3.437
  323   2HB   ARG  47           HB1      ARG  47  66.831 -11.422  -2.704
  324   1HG   ARG  47           HG2      ARG  47  66.416 -12.641  -4.789
  325   2HG   ARG  47           HG1      ARG  47  67.740 -11.777  -5.577
  326   1HD   ARG  47           HD2      ARG  47  69.356 -12.759  -4.040
  327   2HD   ARG  47           HD1      ARG  47  68.062 -13.535  -3.128
  328    HE   ARG  47           HE       ARG  47  67.967 -14.329  -5.899
  329   1HH1  ARG  47          HH21      ARG  47  70.815 -14.509  -4.426
  330   2HH1  ARG  47          HH22      ARG  47  70.832 -16.216  -4.127
  331   1HH2  ARG  47          HH11      ARG  47  67.474 -16.649  -4.872
  332   2HH2  ARG  47          HH12      ARG  47  68.942 -17.425  -4.379
  333    H    MET  48           HN       MET  48  64.752 -10.198  -2.168
  334    HA   MET  48           HA       MET  48  62.763 -11.922  -3.378
  335   1HB   MET  48           HB2      MET  48  61.611 -11.776  -1.286
  336   2HB   MET  48           HB1      MET  48  63.331 -11.766  -0.895
  337   1HG   MET  48           HG2      MET  48  62.819  -9.089  -1.268
  338   2HG   MET  48           HG1      MET  48  61.315  -9.652  -0.537
  339   1HE   MET  48           HE2      MET  48  60.960 -10.794   1.232
  340   2HE   MET  48           HE1      MET  48  62.162 -11.806   2.032
  341   3HE   MET  48           HE3      MET  48  61.653 -10.280   2.769
  342    H    LEU  49           HN       LEU  49  63.187  -8.470  -3.174
  343    HA   LEU  49           HA       LEU  49  60.403  -7.788  -3.628
  344   1HB   LEU  49           HB2      LEU  49  62.624  -5.983  -4.518
  345   2HB   LEU  49           HB1      LEU  49  61.104  -5.576  -3.725
  346    HG   LEU  49           HG       LEU  49  63.558  -6.816  -2.469
  347   1HD1  LEU  49          HD12      LEU  49  62.802  -4.178  -2.832
  348   2HD1  LEU  49          HD11      LEU  49  62.248  -4.530  -1.196
  349   3HD1  LEU  49          HD13      LEU  49  63.944  -4.758  -1.620
  350   1HD2  LEU  49          HD22      LEU  49  61.349  -7.857  -1.716
  351   2HD2  LEU  49          HD21      LEU  49  62.314  -7.113  -0.441
  352   3HD2  LEU  49          HD23      LEU  49  60.917  -6.262  -1.100
  353    H    GLY  50           HN       GLY  50  63.207  -7.372  -5.823
  354   1HA   GLY  50           HA2      GLY  50  62.619  -8.805  -8.018
  355   2HA   GLY  50           HA1      GLY  50  61.368  -7.565  -8.129
  356    H    GLN  51           HN       GLN  51  64.745  -7.261  -7.031
  357    HA   GLN  51           HA       GLN  51  65.331  -5.605  -9.428
  358   1HB   GLN  51           HB2      GLN  51  65.574  -4.697  -6.550
  359   2HB   GLN  51           HB1      GLN  51  66.411  -3.899  -7.880
  360   1HG   GLN  51           HG2      GLN  51  64.279  -3.444  -8.993
  361   2HG   GLN  51           HG1      GLN  51  63.410  -4.312  -7.726
  362   1HE2  GLN  51          HE22      GLN  51  64.381  -0.449  -7.146
  363   2HE2  GLN  51          HE21      GLN  51  64.585  -1.228  -8.641
  364    H    ASN  52           HN       ASN  52  66.970  -6.887 -10.221
  365    HA   ASN  52           HA       ASN  52  69.225  -7.482  -8.345
  366   1HB   ASN  52           HB2      ASN  52  67.830  -9.483  -9.161
  367   2HB   ASN  52           HB1      ASN  52  68.519  -9.165 -10.754
  368   1HD2  ASN  52          HD22      ASN  52  70.909 -11.539  -9.371
  369   2HD2  ASN  52          HD21      ASN  52  69.390 -11.513 -10.127
  370    HA   PRO  53           HA       PRO  53  70.825  -4.887 -11.763
  371   1HB   PRO  53           HB2      PRO  53  72.332  -3.287 -10.111
  372   2HB   PRO  53           HB1      PRO  53  70.632  -2.970 -10.499
  373   1HG   PRO  53           HG2      PRO  53  71.814  -4.031  -7.974
  374   2HG   PRO  53           HG1      PRO  53  70.309  -3.130  -8.217
  375   1HD   PRO  53           HD2      PRO  53  70.523  -5.927  -7.826
  376   2HD   PRO  53           HD1      PRO  53  69.080  -5.057  -8.394
  377    H    THR  54           HN       THR  54  73.370  -4.203 -11.912
  378    HA   THR  54           HA       THR  54  74.825  -6.729 -11.784
  379    HB   THR  54           HB       THR  54  76.705  -5.343 -12.729
  380    HG1  THR  54           HG1      THR  54  75.943  -3.195 -13.395
  381   1HG2  THR  54          HG23      THR  54  74.337  -6.193 -13.917
  382   2HG2  THR  54          HG22      THR  54  74.518  -4.532 -14.478
  383   3HG2  THR  54          HG21      THR  54  75.804  -5.705 -14.765
  384    H    LYS  55           HN       LYS  55  76.287  -7.337 -10.231
  385    HA   LYS  55           HA       LYS  55  76.357  -6.272  -7.670
  386   1HB   LYS  55           HB2      LYS  55  77.391  -8.418  -8.177
  387   2HB   LYS  55           HB1      LYS  55  78.620  -7.628  -9.166
  388   1HG   LYS  55           HG2      LYS  55  78.497  -6.435  -6.523
  389   2HG   LYS  55           HG1      LYS  55  78.780  -8.173  -6.416
  390   1HD   LYS  55           HD2      LYS  55  80.599  -7.885  -8.156
  391   2HD   LYS  55           HD1      LYS  55  80.402  -6.142  -7.969
  392   1HE   LYS  55           HE2      LYS  55  82.208  -7.386  -6.529
  393   2HE   LYS  55           HE1      LYS  55  81.203  -6.150  -5.774
  394   1HZ   LYS  55           HZ3      LYS  55  80.415  -8.998  -5.784
  395   2HZ   LYS  55           HZ2      LYS  55  81.429  -8.360  -4.578
  396   3HZ   LYS  55           HZ1      LYS  55  79.855  -7.751  -4.779
  397    H    GLU  56           HN       GLU  56  78.095  -5.143 -10.505
  398    HA   GLU  56           HA       GLU  56  80.026  -3.499  -9.210
  399   1HB   GLU  56           HB2      GLU  56  78.716  -3.511 -11.904
  400   2HB   GLU  56           HB1      GLU  56  79.646  -2.088 -11.428
  401   1HG   GLU  56           HG2      GLU  56  81.054  -4.550 -10.766
  402   2HG   GLU  56           HG1      GLU  56  80.680  -4.460 -12.489
  403    H    GLU  57           HN       GLU  57  76.863  -2.519 -10.591
  404    HA   GLU  57           HA       GLU  57  76.928   0.102  -9.427
  405   1HB   GLU  57           HB2      GLU  57  74.758  -1.635 -10.585
  406   2HB   GLU  57           HB1      GLU  57  74.351  -0.107  -9.804
  407   1HG   GLU  57           HG2      GLU  57  76.108   0.977 -11.308
  408   2HG   GLU  57           HG1      GLU  57  76.133  -0.539 -12.209
  409    H    LEU  58           HN       LEU  58  76.045  -3.019  -8.165
  410    HA   LEU  58           HA       LEU  58  74.350  -2.192  -6.022
  411   1HB   LEU  58           HB2      LEU  58  74.939  -4.587  -6.876
  412   2HB   LEU  58           HB1      LEU  58  76.299  -4.473  -5.757
  413    HG   LEU  58           HG       LEU  58  74.537  -3.751  -4.004
  414   1HD1  LEU  58          HD13      LEU  58  72.811  -4.903  -6.206
  415   2HD1  LEU  58          HD12      LEU  58  72.279  -4.823  -4.527
  416   3HD1  LEU  58          HD11      LEU  58  72.643  -3.339  -5.408
  417   1HD2  LEU  58          HD22      LEU  58  75.467  -6.300  -4.917
  418   2HD2  LEU  58          HD21      LEU  58  74.986  -5.838  -3.284
  419   3HD2  LEU  58          HD23      LEU  58  73.788  -6.481  -4.407
  420    H    ASP  59           HN       ASP  59  77.886  -2.805  -6.037
  421    HA   ASP  59           HA       ASP  59  78.410  -2.072  -3.369
  422   1HB   ASP  59           HB2      ASP  59  79.986  -2.903  -5.356
  423   2HB   ASP  59           HB1      ASP  59  80.326  -1.177  -5.485
  424    H    ALA  60           HN       ALA  60  78.308   0.034  -6.259
  425    HA   ALA  60           HA       ALA  60  78.908   2.463  -4.887
  426   1HB   ALA  60           HB1      ALA  60  78.276   1.714  -7.521
  427   2HB   ALA  60           HB3      ALA  60  77.021   2.863  -7.057
  428   3HB   ALA  60           HB2      ALA  60  78.720   3.326  -6.962
  429    H    ILE  61           HN       ILE  61  75.953   0.616  -5.221
  430    HA   ILE  61           HA       ILE  61  74.140   2.681  -4.355
  431    HB   ILE  61           HB       ILE  61  74.013  -0.336  -4.430
  432   1HG1  ILE  61          HG12      ILE  61  72.335   1.761  -5.833
  433   2HG1  ILE  61          HG11      ILE  61  73.825   1.112  -6.516
  434   1HG2  ILE  61          HG21      ILE  61  71.927   1.601  -3.387
  435   2HG2  ILE  61          HG23      ILE  61  71.590  -0.076  -3.818
  436   3HG2  ILE  61          HG22      ILE  61  72.696   0.289  -2.493
  437   1HD1  ILE  61          HD12      ILE  61  72.231  -1.086  -5.617
  438   2HD1  ILE  61          HD11      ILE  61  71.212  -0.034  -6.599
  439   3HD1  ILE  61          HD13      ILE  61  72.709  -0.689  -7.268
  440    H    ILE  62           HN       ILE  62  75.414  -0.158  -2.578
  441    HA   ILE  62           HA       ILE  62  74.502   0.477  -0.021
  442    HB   ILE  62           HB       ILE  62  77.116  -0.779  -0.898
  443   1HG1  ILE  62          HG12      ILE  62  74.610  -2.004   0.293
  444   2HG1  ILE  62          HG11      ILE  62  74.932  -1.921  -1.439
  445   1HG2  ILE  62          HG23      ILE  62  75.895  -0.559   1.867
  446   2HG2  ILE  62          HG22      ILE  62  77.221  -1.643   1.451
  447   3HG2  ILE  62          HG21      ILE  62  77.442   0.103   1.343
  448   1HD1  ILE  62          HD12      ILE  62  76.997  -3.098   0.399
  449   2HD1  ILE  62          HD11      ILE  62  75.621  -4.076  -0.109
  450   3HD1  ILE  62          HD13      ILE  62  76.725  -3.415  -1.314
  451    H    GLU  63           HN       GLU  63  77.426   1.695  -1.657
  452    HA   GLU  63           HA       GLU  63  78.370   3.229   0.585
  453   1HB   GLU  63           HB2      GLU  63  79.271   2.659  -2.011
  454   2HB   GLU  63           HB1      GLU  63  79.059   4.409  -1.977
  455   1HG   GLU  63           HG2      GLU  63  80.262   3.535   0.493
  456   2HG   GLU  63           HG1      GLU  63  81.197   2.922  -0.871
  457    H    GLU  64           HN       GLU  64  76.193   3.976  -2.115
  458    HA   GLU  64           HA       GLU  64  75.959   6.787  -1.353
  459   1HB   GLU  64           HB2      GLU  64  74.776   5.001  -3.426
  460   2HB   GLU  64           HB1      GLU  64  73.842   6.426  -2.969
  461   1HG   GLU  64           HG2      GLU  64  75.508   7.910  -3.679
  462   2HG   GLU  64           HG1      GLU  64  76.777   6.688  -3.569
  463    H    VAL  65           HN       VAL  65  74.681   3.898  -0.148
  464    HA   VAL  65           HA       VAL  65  72.173   5.176   0.795
  465    HB   VAL  65           HB       VAL  65  73.201   2.343   1.153
  466   1HG1  VAL  65          HG11      VAL  65  71.395   3.567   2.742
  467   2HG1  VAL  65          HG13      VAL  65  70.328   3.063   1.429
  468   3HG1  VAL  65          HG12      VAL  65  71.276   1.862   2.306
  469   1HG2  VAL  65          HG23      VAL  65  72.027   3.679  -1.087
  470   2HG2  VAL  65          HG22      VAL  65  72.429   1.970  -0.930
  471   3HG2  VAL  65          HG21      VAL  65  70.837   2.552  -0.441
  472    H    ASP  66           HN       ASP  66  75.297   4.062   1.955
  473    HA   ASP  66           HA       ASP  66  74.546   4.490   4.771
  474   1HB   ASP  66           HB2      ASP  66  76.409   2.879   3.540
  475   2HB   ASP  66           HB1      ASP  66  77.407   4.208   4.129
  476    H    GLU  67           HN       GLU  67  74.067   6.845   3.581
  477    HA   GLU  67           HA       GLU  67  76.311   8.618   3.334
  478   1HB   GLU  67           HB2      GLU  67  73.355   8.912   3.575
  479   2HB   GLU  67           HB1      GLU  67  74.334  10.325   3.973
  480   1HG   GLU  67           HG2      GLU  67  74.999   8.821   1.477
  481   2HG   GLU  67           HG1      GLU  67  73.565   9.849   1.468
  482    H    ASP  68           HN       ASP  68  74.792   7.215   6.062
  483    HA   ASP  68           HA       ASP  68  75.571   9.362   7.915
  484   1HB   ASP  68           HB2      ASP  68  74.797   6.623   8.846
  485   2HB   ASP  68           HB1      ASP  68  74.392   8.194   9.538
  486    H    GLY  69           HN       GLY  69  76.814   6.290   6.768
  487   1HA   GLY  69           HA2      GLY  69  79.085   5.579   6.920
  488   2HA   GLY  69           HA1      GLY  69  79.383   6.867   8.088
  489    H    SER  70           HN       SER  70  76.567   5.060   8.746
  490    HA   SER  70           HA       SER  70  77.752   3.995  11.189
  491   1HB   SER  70           HB2      SER  70  75.544   3.301  11.751
  492   2HB   SER  70           HB1      SER  70  75.344   4.825  10.891
  493    HG   SER  70           HG       SER  70  74.202   3.756   9.502
  494    H    GLY  71           HN       GLY  71  77.927   2.964   8.057
  495   1HA   GLY  71           HA2      GLY  71  78.492   0.906   7.084
  496   2HA   GLY  71           HA1      GLY  71  78.999   0.409   8.699
  497    H    THR  72           HN       THR  72  75.734   1.455   8.427
  498    HA   THR  72           HA       THR  72  74.749  -1.315   8.019
  499    HB   THR  72           HB       THR  72  73.168  -0.520  10.107
  500    HG1  THR  72           HG1      THR  72  75.721   0.086  11.037
  501   1HG2  THR  72          HG23      THR  72  75.299  -2.408   9.612
  502   2HG2  THR  72          HG22      THR  72  75.353  -1.854  11.285
  503   3HG2  THR  72          HG21      THR  72  73.880  -2.584  10.646
  504    H    ILE  73           HN       ILE  73  72.540  -1.377   7.336
  505    HA   ILE  73           HA       ILE  73  71.506   1.281   6.439
  506    HB   ILE  73           HB       ILE  73  70.819  -1.481   5.388
  507   1HG1  ILE  73          HG12      ILE  73  73.218  -0.752   5.032
  508   2HG1  ILE  73          HG11      ILE  73  72.306  -1.018   3.547
  509   1HG2  ILE  73          HG21      ILE  73  69.571   1.049   5.084
  510   2HG2  ILE  73          HG23      ILE  73  70.393   0.701   3.563
  511   3HG2  ILE  73          HG22      ILE  73  69.214  -0.440   4.208
  512   1HD1  ILE  73          HD11      ILE  73  71.833   1.670   4.231
  513   2HD1  ILE  73          HD13      ILE  73  73.556   1.414   4.505
  514   3HD1  ILE  73          HD12      ILE  73  72.856   1.075   2.922
  515    H    ASP  74           HN       ASP  74  69.463   1.915   7.091
  516    HA   ASP  74           HA       ASP  74  67.931  -0.039   8.765
  517   1HB   ASP  74           HB2      ASP  74  67.118   1.968  10.044
  518   2HB   ASP  74           HB1      ASP  74  68.849   1.676  10.215
  519    H    PHE  75           HN       PHE  75  65.527   0.999   8.992
  520    HA   PHE  75           HA       PHE  75  64.282   0.708   6.489
  521   1HB   PHE  75           HB2      PHE  75  63.247   0.759   8.878
  522   2HB   PHE  75           HB1      PHE  75  63.092   2.494   8.599
  523    HD1  PHE  75           HD2      PHE  75  62.747  -0.461   6.321
  524    HD2  PHE  75           HD1      PHE  75  60.863   2.981   8.067
  525    HE1  PHE  75           HE2      PHE  75  60.730  -0.863   4.935
  526    HE2  PHE  75           HE1      PHE  75  58.845   2.580   6.680
  527    HZ   PHE  75           HZ       PHE  75  58.779   0.658   5.113
  528    H    GLU  76           HN       GLU  76  65.127   3.758   8.164
  529    HA   GLU  76           HA       GLU  76  64.114   5.539   6.222
  530   1HB   GLU  76           HB2      GLU  76  66.346   5.692   8.222
  531   2HB   GLU  76           HB1      GLU  76  66.167   6.986   7.037
  532   1HG   GLU  76           HG2      GLU  76  63.675   6.116   8.397
  533   2HG   GLU  76           HG1      GLU  76  64.849   6.966   9.402
  534    H    GLU  77           HN       GLU  77  67.452   4.250   6.460
  535    HA   GLU  77           HA       GLU  77  68.258   5.364   3.923
  536   1HB   GLU  77           HB2      GLU  77  69.442   2.987   5.392
  537   2HB   GLU  77           HB1      GLU  77  70.242   3.967   4.162
  538   1HG   GLU  77           HG2      GLU  77  70.149   5.932   5.603
  539   2HG   GLU  77           HG1      GLU  77  69.232   5.033   6.813
  540    H    PHE  78           HN       PHE  78  66.287   2.721   4.753
  541    HA   PHE  78           HA       PHE  78  66.895   0.936   2.578
  542   1HB   PHE  78           HB2      PHE  78  65.193   0.898   4.783
  543   2HB   PHE  78           HB1      PHE  78  64.091   0.946   3.407
  544    HD1  PHE  78           HD1      PHE  78  67.002  -0.877   4.849
  545    HD2  PHE  78           HD2      PHE  78  63.783  -0.947   2.007
  546    HE1  PHE  78           HE1      PHE  78  67.444  -3.277   4.409
  547    HE2  PHE  78           HE2      PHE  78  64.225  -3.349   1.565
  548    HZ   PHE  78           HZ       PHE  78  66.055  -4.513   2.768
  549    H    LEU  79           HN       LEU  79  64.089   3.119   2.989
  550    HA   LEU  79           HA       LEU  79  63.059   2.978   0.403
  551   1HB   LEU  79           HB2      LEU  79  63.280   5.512   2.060
  552   2HB   LEU  79           HB1      LEU  79  62.112   5.201   0.776
  553    HG   LEU  79           HG       LEU  79  62.337   3.576   3.329
  554   1HD1  LEU  79          HD12      LEU  79  60.789   6.006   2.586
  555   2HD1  LEU  79          HD11      LEU  79  59.922   4.755   3.476
  556   3HD1  LEU  79          HD13      LEU  79  61.372   5.484   4.164
  557   1HD2  LEU  79          HD22      LEU  79  61.438   2.484   1.188
  558   2HD2  LEU  79          HD21      LEU  79  60.362   2.457   2.587
  559   3HD2  LEU  79          HD23      LEU  79  60.098   3.627   1.294
  560    H    VAL  80           HN       VAL  80  66.010   4.475   1.474
  561    HA   VAL  80           HA       VAL  80  66.399   6.230  -0.778
  562    HB   VAL  80           HB       VAL  80  68.410   4.915   1.076
  563   1HG1  VAL  80          HG13      VAL  80  68.665   6.846  -1.195
  564   2HG1  VAL  80          HG12      VAL  80  69.684   7.097   0.223
  565   3HG1  VAL  80          HG11      VAL  80  69.774   5.579  -0.670
  566   1HG2  VAL  80          HG23      VAL  80  66.898   7.526   1.089
  567   2HG2  VAL  80          HG22      VAL  80  67.059   6.344   2.387
  568   3HG2  VAL  80          HG21      VAL  80  68.431   7.361   1.943
  569    H    MET  81           HN       MET  81  67.726   2.981  -0.051
  570    HA   MET  81           HA       MET  81  69.157   2.571  -2.416
  571   1HB   MET  81           HB2      MET  81  69.033   1.025  -0.418
  572   2HB   MET  81           HB1      MET  81  67.485   0.452  -1.043
  573   1HG   MET  81           HG2      MET  81  68.466  -0.477  -2.969
  574   2HG   MET  81           HG1      MET  81  69.937   0.481  -2.788
  575   1HE   MET  81           HE1      MET  81  71.184   0.572  -0.820
  576   2HE   MET  81           HE3      MET  81  70.633  -0.238   0.654
  577   3HE   MET  81           HE2      MET  81  72.008  -0.878  -0.245
  578    H    MET  82           HN       MET  82  65.676   2.324  -1.868
  579    HA   MET  82           HA       MET  82  64.990   1.037  -4.327
  580   1HB   MET  82           HB2      MET  82  63.565   2.662  -2.277
  581   2HB   MET  82           HB1      MET  82  62.793   2.516  -3.858
  582   1HG   MET  82           HG2      MET  82  62.029   0.701  -2.423
  583   2HG   MET  82           HG1      MET  82  63.041   0.040  -3.707
  584   1HE   MET  82           HE2      MET  82  64.514  -1.639  -3.340
  585   2HE   MET  82           HE1      MET  82  65.737  -0.370  -3.341
  586   3HE   MET  82           HE3      MET  82  65.813  -1.674  -2.148
  587    H    VAL  83           HN       VAL  83  64.230   4.439  -3.617
  588    HA   VAL  83           HA       VAL  83  64.063   5.202  -6.357
  589    HB   VAL  83           HB       VAL  83  64.736   7.035  -4.044
  590   1HG1  VAL  83          HG12      VAL  83  64.759   7.851  -6.481
  591   2HG1  VAL  83          HG11      VAL  83  63.018   7.562  -6.477
  592   3HG1  VAL  83          HG13      VAL  83  63.720   8.736  -5.364
  593   1HG2  VAL  83          HG22      VAL  83  62.466   5.314  -4.401
  594   2HG2  VAL  83          HG21      VAL  83  62.752   6.495  -3.125
  595   3HG2  VAL  83          HG23      VAL  83  61.944   6.985  -4.614
  596    H    ARG  84           HN       ARG  84  66.835   4.454  -4.560
  597    HA   ARG  84           HA       ARG  84  68.698   6.375  -5.507
  598   1HB   ARG  84           HB2      ARG  84  69.074   4.638  -3.699
  599   2HB   ARG  84           HB1      ARG  84  69.268   3.447  -4.987
  600   1HG   ARG  84           HG2      ARG  84  71.451   4.058  -4.904
  601   2HG   ARG  84           HG1      ARG  84  70.909   5.434  -5.863
  602   1HD   ARG  84           HD2      ARG  84  70.328   6.338  -3.374
  603   2HD   ARG  84           HD1      ARG  84  71.726   5.325  -3.015
  604    HE   ARG  84           HE       ARG  84  72.948   6.685  -4.779
  605   1HH1  ARG  84          HH21      ARG  84  71.505   8.481  -6.155
  606   2HH1  ARG  84          HH22      ARG  84  71.250   9.868  -5.149
  607   1HH2  ARG  84          HH11      ARG  84  72.016   8.202  -2.206
  608   2HH2  ARG  84          HH12      ARG  84  71.539   9.709  -2.913
  609    H    GLN  85           HN       GLN  85  68.009   3.094  -6.791
  610    HA   GLN  85           HA       GLN  85  69.335   3.900  -9.327
  611   1HB   GLN  85           HB2      GLN  85  69.348   1.540  -9.876
  612   2HB   GLN  85           HB1      GLN  85  69.924   1.716  -8.218
  613   1HG   GLN  85           HG2      GLN  85  67.093   1.509  -8.093
  614   2HG   GLN  85           HG1      GLN  85  67.657   0.231  -9.171
  615   1HE2  GLN  85          HE22      GLN  85  69.404   0.197  -5.446
  616   2HE2  GLN  85          HE21      GLN  85  69.265   1.667  -6.284
  617    H    MET  86           HN       MET  86  66.256   3.840  -7.988
  618    HA   MET  86           HA       MET  86  64.919   3.246 -10.575
  619   1HB   MET  86           HB2      MET  86  64.103   3.297  -7.725
  620   2HB   MET  86           HB1      MET  86  62.892   3.870  -8.873
  621   1HG   MET  86           HG2      MET  86  64.070   1.541 -10.000
  622   2HG   MET  86           HG1      MET  86  63.687   1.165  -8.321
  623   1HE   MET  86           HE2      MET  86  61.371   2.966  -7.588
  624   2HE   MET  86           HE1      MET  86  59.965   1.973  -7.968
  625   3HE   MET  86           HE3      MET  86  61.404   1.239  -7.247
  626    H    LYS  87           HN       LYS  87  66.467   5.810  -9.474
  627    HA   LYS  87           HA       LYS  87  64.488   7.914  -9.606
  628   1HB   LYS  87           HB2      LYS  87  67.150   7.757  -8.859
  629   2HB   LYS  87           HB1      LYS  87  67.218   8.676 -10.364
  630   1HG   LYS  87           HG2      LYS  87  65.395  10.159  -9.450
  631   2HG   LYS  87           HG1      LYS  87  65.562   9.318  -7.908
  632   1HD   LYS  87           HD2      LYS  87  68.140  10.181  -8.971
  633   2HD   LYS  87           HD1      LYS  87  67.037  11.533  -8.723
  634   1HE   LYS  87           HE2      LYS  87  67.817   9.446  -6.668
  635   2HE   LYS  87           HE1      LYS  87  68.281  11.148  -6.665
  636   1HZ   LYS  87           HZ3      LYS  87  65.480  10.925  -6.893
  637   2HZ   LYS  87           HZ2      LYS  87  66.005  10.011  -5.559
  638   3HZ   LYS  87           HZ1      LYS  87  66.391  11.662  -5.666
  639    H    GLU  88           HN       GLU  88  66.889   6.667 -11.945
  640    HA   GLU  88           HA       GLU  88  65.220   6.922 -14.210
  641   1HB   GLU  88           HB2      GLU  88  65.930   9.441 -13.283
  642   2HB   GLU  88           HB1      GLU  88  67.099   9.139 -14.569
  643   1HG   GLU  88           HG2      GLU  88  64.902   8.272 -15.832
  644   2HG   GLU  88           HG1      GLU  88  64.133   9.416 -14.730
  645    H    ASP  89           HN       ASP  89  66.252   5.990 -15.971
  646    HA   ASP  89           HA       ASP  89  69.189   5.501 -15.662
  647   1HB   ASP  89           HB2      ASP  89  67.006   3.722 -16.778
  648   2HB   ASP  89           HB1      ASP  89  68.724   3.403 -17.024
  649    H    ALA  90           HN       ALA  90  68.928   7.742 -16.898
  650    HA   ALA  90           HA       ALA  90  68.277   7.500 -19.738
  651   1HB   ALA  90           HB2      ALA  90  69.052   9.649 -17.870
  652   2HB   ALA  90           HB1      ALA  90  69.679   9.848 -19.507
  653   3HB   ALA  90           HB3      ALA  90  67.942   9.695 -19.240
   
  No H/Q in entry =         653
  Start of MODEL   18
    1   1H    ALA   1           HT1      ALA   1  67.723  12.846  13.321
    2   2H    ALA   1           HT3      ALA   1  68.715  11.482  13.147
    3   3H    ALA   1           HT2      ALA   1  68.090  11.886  14.673
    4    HA   ALA   1           HA       ALA   1  69.520  13.643  14.974
    5   1HB   ALA   1           HB1      ALA   1  70.695  11.408  14.854
    6   2HB   ALA   1           HB3      ALA   1  71.121  11.792  13.186
    7   3HB   ALA   1           HB2      ALA   1  71.731  12.792  14.503
    8    H    SER   2           HN       SER   2  70.071  12.649  11.569
    9    HA   SER   2           HA       SER   2  70.184  15.563  10.896
   10   1HB   SER   2           HB2      SER   2  71.501  13.834   8.962
   11   2HB   SER   2           HB1      SER   2  72.137  15.237   9.816
   12    HG   SER   2           HG       SER   2  73.300  13.568  10.588
   13    H    MET   3           HN       MET   3  68.801  16.230   9.301
   14    HA   MET   3           HA       MET   3  66.974  14.214   8.154
   15   1HB   MET   3           HB2      MET   3  66.935  17.126   8.615
   16   2HB   MET   3           HB1      MET   3  66.204  16.626   7.089
   17   1HG   MET   3           HG2      MET   3  64.532  16.649   8.907
   18   2HG   MET   3           HG1      MET   3  64.779  15.015   8.291
   19   1HE   MET   3           HE3      MET   3  63.889  16.760  11.012
   20   2HE   MET   3           HE2      MET   3  64.816  16.337  12.450
   21   3HE   MET   3           HE1      MET   3  65.460  17.516  11.309
   22    H    THR   4           HN       THR   4  68.677  13.246   6.771
   23    HA   THR   4           HA       THR   4  69.985  14.786   4.715
   24    HB   THR   4           HB       THR   4  70.065  12.329   3.666
   25    HG1  THR   4           HG1      THR   4  69.187  10.916   4.918
   26   1HG2  THR   4          HG21      THR   4  71.507  13.326   6.131
   27   2HG2  THR   4          HG23      THR   4  71.985  11.868   5.263
   28   3HG2  THR   4          HG22      THR   4  72.041  13.433   4.453
   29    H    ASP   5           HN       ASP   5  69.271  15.320   2.678
   30    HA   ASP   5           HA       ASP   5  66.453  15.155   2.090
   31   1HB   ASP   5           HB2      ASP   5  68.813  15.864   0.319
   32   2HB   ASP   5           HB1      ASP   5  67.121  16.086  -0.130
   33    H    GLN   6           HN       GLN   6  68.957  12.898   1.785
   34    HA   GLN   6           HA       GLN   6  68.361  11.569  -0.640
   35   1HB   GLN   6           HB2      GLN   6  69.641  10.847   1.932
   36   2HB   GLN   6           HB1      GLN   6  69.005   9.491   1.000
   37   1HG   GLN   6           HG2      GLN   6  70.455  11.466  -0.627
   38   2HG   GLN   6           HG1      GLN   6  71.459  10.663   0.581
   39   1HE2  GLN   6          HE22      GLN   6  71.752   7.847  -1.501
   40   2HE2  GLN   6          HE21      GLN   6  72.500   8.947  -0.446
   41    H    GLN   7           HN       GLN   7  67.144  10.710   2.624
   42    HA   GLN   7           HA       GLN   7  65.107   8.957   1.525
   43   1HB   GLN   7           HB2      GLN   7  64.303   8.811   3.851
   44   2HB   GLN   7           HB1      GLN   7  66.054   8.613   3.785
   45   1HG   GLN   7           HG2      GLN   7  66.146  11.177   4.174
   46   2HG   GLN   7           HG1      GLN   7  64.470  11.010   4.694
   47   1HE2  GLN   7          HE22      GLN   7  67.396   9.184   6.946
   48   2HE2  GLN   7          HE21      GLN   7  67.675   9.453   5.294
   49    H    ALA   8           HN       ALA   8  65.330  12.347   2.097
   50    HA   ALA   8           HA       ALA   8  62.554  12.932   2.525
   51   1HB   ALA   8           HB3      ALA   8  64.555  14.503   2.829
   52   2HB   ALA   8           HB2      ALA   8  64.509  14.730   1.080
   53   3HB   ALA   8           HB1      ALA   8  63.125  15.202   2.066
   54    H    GLU   9           HN       GLU   9  64.505  12.555  -0.418
   55    HA   GLU   9           HA       GLU   9  62.196  13.200  -2.126
   56   1HB   GLU   9           HB2      GLU   9  64.961  13.309  -2.462
   57   2HB   GLU   9           HB1      GLU   9  64.466  11.943  -3.462
   58   1HG   GLU   9           HG2      GLU   9  62.640  13.463  -4.400
   59   2HG   GLU   9           HG1      GLU   9  63.478  14.798  -3.608
   60    H    ALA  10           HN       ALA  10  63.994  10.349  -1.061
   61    HA   ALA  10           HA       ALA  10  62.713   8.493  -2.852
   62   1HB   ALA  10           HB3      ALA  10  64.747   8.366  -0.950
   63   2HB   ALA  10           HB2      ALA  10  63.472   7.353  -0.274
   64   3HB   ALA  10           HB1      ALA  10  64.113   7.010  -1.881
   65    H    ARG  11           HN       ARG  11  62.237   8.808   0.686
   66    HA   ARG  11           HA       ARG  11  59.859   7.320   0.843
   67   1HB   ARG  11           HB2      ARG  11  61.098   8.093   2.826
   68   2HB   ARG  11           HB1      ARG  11  60.631   9.756   2.476
   69   1HG   ARG  11           HG2      ARG  11  58.277   9.209   2.781
   70   2HG   ARG  11           HG1      ARG  11  58.670   7.502   2.995
   71   1HD   ARG  11           HD2      ARG  11  59.841   7.946   5.049
   72   2HD   ARG  11           HD1      ARG  11  59.758   9.688   4.785
   73    HE   ARG  11           HE       ARG  11  57.240   8.128   5.135
   74   1HH1  ARG  11          HH11      ARG  11  59.453   9.468   7.172
   75   2HH1  ARG  11          HH12      ARG  11  58.413  10.681   7.840
   76   1HH2  ARG  11          HH21      ARG  11  55.888  10.171   5.516
   77   2HH2  ARG  11          HH22      ARG  11  56.394  11.082   6.902
   78    H    ALA  12           HN       ALA  12  60.197  10.850   0.361
   79    HA   ALA  12           HA       ALA  12  57.406  11.402   0.177
   80   1HB   ALA  12           HB1      ALA  12  59.167  13.145   0.425
   81   2HB   ALA  12           HB3      ALA  12  59.683  12.831  -1.231
   82   3HB   ALA  12           HB2      ALA  12  58.077  13.488  -0.919
   83    H    PHE  13           HN       PHE  13  59.685  10.102  -2.152
   84    HA   PHE  13           HA       PHE  13  57.872  10.487  -4.423
   85   1HB   PHE  13           HB2      PHE  13  60.322  10.473  -4.750
   86   2HB   PHE  13           HB1      PHE  13  60.387   8.810  -4.166
   87    HD1  PHE  13           HD2      PHE  13  59.079   7.019  -5.426
   88    HD2  PHE  13           HD1      PHE  13  59.779  10.952  -7.008
   89    HE1  PHE  13           HE2      PHE  13  58.557   6.196  -7.706
   90    HE2  PHE  13           HE1      PHE  13  59.258  10.128  -9.287
   91    HZ   PHE  13           HZ       PHE  13  58.647   7.749  -9.638
   92    H    LEU  14           HN       LEU  14  58.375   8.109  -1.961
   93    HA   LEU  14           HA       LEU  14  56.950   6.023  -3.510
   94   1HB   LEU  14           HB2      LEU  14  58.026   5.917  -0.677
   95   2HB   LEU  14           HB1      LEU  14  57.480   4.549  -1.646
   96    HG   LEU  14           HG       LEU  14  59.736   6.371  -2.510
   97   1HD1  LEU  14          HD13      LEU  14  59.871   4.787  -0.291
   98   2HD1  LEU  14          HD12      LEU  14  60.357   3.645  -1.544
   99   3HD1  LEU  14          HD11      LEU  14  61.253   5.148  -1.327
  100   1HD2  LEU  14          HD23      LEU  14  58.365   3.969  -3.563
  101   2HD2  LEU  14          HD22      LEU  14  59.257   5.224  -4.425
  102   3HD2  LEU  14          HD21      LEU  14  60.127   3.910  -3.633
  103    H    SER  15           HN       SER  15  54.907   5.217  -2.866
  104    HA   SER  15           HA       SER  15  53.258   7.156  -1.386
  105   1HB   SER  15           HB2      SER  15  52.708   4.707  -3.040
  106   2HB   SER  15           HB1      SER  15  51.460   5.331  -1.963
  107    HG   SER  15           HG       SER  15  51.938   7.423  -3.022
  108    H    GLU  16           HN       GLU  16  51.859   6.436   0.409
  109    HA   GLU  16           HA       GLU  16  53.285   5.060   2.446
  110   1HB   GLU  16           HB2      GLU  16  51.573   6.559   3.135
  111   2HB   GLU  16           HB1      GLU  16  50.373   5.791   2.095
  112   1HG   GLU  16           HG2      GLU  16  50.027   4.046   3.545
  113   2HG   GLU  16           HG1      GLU  16  51.682   4.082   4.151
  114    H    GLU  17           HN       GLU  17  51.017   3.925   0.000
  115    HA   GLU  17           HA       GLU  17  50.521   1.342   1.164
  116   1HB   GLU  17           HB2      GLU  17  49.618   0.737  -0.981
  117   2HB   GLU  17           HB1      GLU  17  49.196   2.427  -0.708
  118   1HG   GLU  17           HG2      GLU  17  51.069   3.160  -2.093
  119   2HG   GLU  17           HG1      GLU  17  51.598   1.490  -2.305
  120    H    MET  18           HN       MET  18  53.058   2.598  -0.955
  121    HA   MET  18           HA       MET  18  54.212  -0.030  -1.463
  122   1HB   MET  18           HB2      MET  18  55.422   2.733  -1.801
  123   2HB   MET  18           HB1      MET  18  56.065   1.234  -2.474
  124   1HG   MET  18           HG2      MET  18  54.003   0.923  -3.782
  125   2HG   MET  18           HG1      MET  18  53.338   2.407  -3.099
  126   1HE   MET  18           HE1      MET  18  55.074   0.740  -5.778
  127   2HE   MET  18           HE3      MET  18  53.715   1.750  -6.290
  128   3HE   MET  18           HE2      MET  18  55.331   2.060  -6.917
  129    H    ILE  19           HN       ILE  19  55.410   2.805   0.385
  130    HA   ILE  19           HA       ILE  19  57.592   1.567   1.626
  131    HB   ILE  19           HB       ILE  19  55.698   3.677   2.684
  132   1HG1  ILE  19          HG12      ILE  19  58.456   4.420   2.117
  133   2HG1  ILE  19          HG11      ILE  19  57.677   3.715   0.700
  134   1HG2  ILE  19          HG22      ILE  19  58.168   2.438   3.871
  135   2HG2  ILE  19          HG21      ILE  19  57.793   4.132   4.189
  136   3HG2  ILE  19          HG23      ILE  19  56.655   2.874   4.665
  137   1HD1  ILE  19          HD12      ILE  19  55.965   5.600   2.172
  138   2HD1  ILE  19          HD11      ILE  19  57.414   6.339   1.491
  139   3HD1  ILE  19          HD13      ILE  19  56.284   5.486   0.440
  140    H    ALA  20           HN       ALA  20  54.181   1.173   2.281
  141    HA   ALA  20           HA       ALA  20  54.414   0.021   4.899
  142   1HB   ALA  20           HB1      ALA  20  52.311   0.779   3.402
  143   2HB   ALA  20           HB3      ALA  20  52.273  -0.953   3.070
  144   3HB   ALA  20           HB2      ALA  20  52.154  -0.371   4.731
  145    H    GLU  21           HN       GLU  21  54.374  -1.420   1.639
  146    HA   GLU  21           HA       GLU  21  54.592  -4.138   2.595
  147   1HB   GLU  21           HB2      GLU  21  54.670  -2.742  -0.004
  148   2HB   GLU  21           HB1      GLU  21  55.653  -4.206   0.065
  149   1HG   GLU  21           HG2      GLU  21  53.585  -5.328   1.122
  150   2HG   GLU  21           HG1      GLU  21  52.687  -3.921   0.549
  151    H    PHE  22           HN       PHE  22  56.982  -1.840   1.249
  152    HA   PHE  22           HA       PHE  22  59.267  -3.460   1.398
  153   1HB   PHE  22           HB2      PHE  22  59.073  -0.499   2.034
  154   2HB   PHE  22           HB1      PHE  22  60.552  -1.365   1.617
  155    HD1  PHE  22           HD1      PHE  22  59.644  -3.175  -0.515
  156    HD2  PHE  22           HD2      PHE  22  58.650   0.938   0.216
  157    HE1  PHE  22           HE1      PHE  22  59.144  -2.869  -2.923
  158    HE2  PHE  22           HE2      PHE  22  58.150   1.245  -2.193
  159    HZ   PHE  22           HZ       PHE  22  58.399  -0.658  -3.763
  160    H    LYS  23           HN       LYS  23  57.575  -1.757   3.989
  161    HA   LYS  23           HA       LYS  23  59.597  -2.115   5.998
  162   1HB   LYS  23           HB2      LYS  23  57.753  -0.528   6.308
  163   2HB   LYS  23           HB1      LYS  23  56.587  -1.852   6.278
  164   1HG   LYS  23           HG2      LYS  23  57.233  -1.049   8.596
  165   2HG   LYS  23           HG1      LYS  23  57.461  -2.776   8.316
  166   1HD   LYS  23           HD2      LYS  23  59.798  -2.565   8.129
  167   2HD   LYS  23           HD1      LYS  23  59.708  -0.830   7.817
  168   1HE   LYS  23           HE2      LYS  23  60.421  -1.704  10.203
  169   2HE   LYS  23           HE1      LYS  23  59.353  -0.308  10.058
  170   1HZ   LYS  23           HZ2      LYS  23  58.403  -3.103  10.367
  171   2HZ   LYS  23           HZ1      LYS  23  58.574  -2.010  11.655
  172   3HZ   LYS  23           HZ3      LYS  23  57.461  -1.689  10.415
  173    H    ALA  24           HN       ALA  24  56.776  -4.072   5.048
  174    HA   ALA  24           HA       ALA  24  56.909  -6.052   7.038
  175   1HB   ALA  24           HB1      ALA  24  55.656  -5.741   4.488
  176   2HB   ALA  24           HB3      ALA  24  56.398  -7.339   4.535
  177   3HB   ALA  24           HB2      ALA  24  55.234  -6.870   5.775
  178    H    ALA  25           HN       ALA  25  58.710  -5.873   3.962
  179    HA   ALA  25           HA       ALA  25  60.158  -8.331   4.404
  180   1HB   ALA  25           HB2      ALA  25  59.840  -7.114   2.180
  181   2HB   ALA  25           HB1      ALA  25  61.088  -5.993   2.724
  182   3HB   ALA  25           HB3      ALA  25  61.470  -7.701   2.507
  183    H    PHE  26           HN       PHE  26  60.629  -5.006   5.400
  184    HA   PHE  26           HA       PHE  26  63.362  -4.950   5.998
  185   1HB   PHE  26           HB2      PHE  26  61.653  -3.089   6.334
  186   2HB   PHE  26           HB1      PHE  26  61.224  -3.877   7.853
  187    HD1  PHE  26           HD1      PHE  26  64.219  -2.659   5.960
  188    HD2  PHE  26           HD2      PHE  26  62.409  -3.338   9.793
  189    HE1  PHE  26           HE1      PHE  26  66.159  -1.578   7.068
  190    HE2  PHE  26           HE2      PHE  26  64.346  -2.260  10.902
  191    HZ   PHE  26           HZ       PHE  26  66.221  -1.379   9.539
  192    H    ASP  27           HN       ASP  27  60.865  -5.708   8.450
  193    HA   ASP  27           HA       ASP  27  62.558  -6.790  10.391
  194   1HB   ASP  27           HB2      ASP  27  59.760  -7.695   9.646
  195   2HB   ASP  27           HB1      ASP  27  60.585  -8.115  11.148
  196    H    MET  28           HN       MET  28  61.593  -8.166   7.339
  197    HA   MET  28           HA       MET  28  62.104 -10.918   7.870
  198   1HB   MET  28           HB2      MET  28  61.399  -9.396   5.638
  199   2HB   MET  28           HB1      MET  28  62.965 -10.088   5.209
  200   1HG   MET  28           HG2      MET  28  60.558 -11.632   6.220
  201   2HG   MET  28           HG1      MET  28  61.150 -11.613   4.559
  202   1HE   MET  28           HE1      MET  28  63.490 -12.028   3.938
  203   2HE   MET  28           HE3      MET  28  64.481 -11.552   5.323
  204   3HE   MET  28           HE2      MET  28  64.580 -13.193   4.687
  205    H    PHE  29           HN       PHE  29  64.294  -8.361   6.649
  206    HA   PHE  29           HA       PHE  29  66.580 -10.211   7.103
  207   1HB   PHE  29           HB2      PHE  29  67.517  -7.706   6.139
  208   2HB   PHE  29           HB1      PHE  29  67.445  -9.235   5.268
  209    HD1  PHE  29           HD1      PHE  29  65.286  -9.851   4.057
  210    HD2  PHE  29           HD2      PHE  29  66.067  -5.915   5.591
  211    HE1  PHE  29           HE1      PHE  29  63.514  -8.928   2.589
  212    HE2  PHE  29           HE2      PHE  29  64.295  -4.991   4.122
  213    HZ   PHE  29           HZ       PHE  29  63.018  -6.498   2.621
  214    H    ASP  30           HN       ASP  30  64.961  -8.722   9.212
  215    HA   ASP  30           HA       ASP  30  67.206  -7.150  10.405
  216   1HB   ASP  30           HB2      ASP  30  64.892  -6.069  10.016
  217   2HB   ASP  30           HB1      ASP  30  64.338  -7.086  11.345
  218    H    ALA  31           HN       ALA  31  67.116 -10.040  10.474
  219    HA   ALA  31           HA       ALA  31  66.014 -11.105  12.858
  220   1HB   ALA  31           HB2      ALA  31  68.055 -11.895  10.904
  221   2HB   ALA  31           HB1      ALA  31  68.378 -12.503  12.527
  222   3HB   ALA  31           HB3      ALA  31  66.852 -12.884  11.730
  223    H    ASP  32           HN       ASP  32  68.587  -8.877  12.429
  224    HA   ASP  32           HA       ASP  32  70.094  -9.525  14.812
  225   1HB   ASP  32           HB2      ASP  32  69.980  -7.255  12.879
  226   2HB   ASP  32           HB1      ASP  32  70.680  -6.929  14.463
  227    H    GLY  33           HN       GLY  33  67.368  -7.369  14.112
  228   1HA   GLY  33           HA2      GLY  33  65.739  -6.609  15.664
  229   2HA   GLY  33           HA1      GLY  33  66.690  -7.325  16.967
  230    H    GLY  34           HN       GLY  34  68.437  -5.345  14.761
  231   1HA   GLY  34           HA2      GLY  34  68.769  -3.321  16.904
  232   2HA   GLY  34           HA1      GLY  34  69.809  -3.501  15.492
  233    H    GLY  35           HN       GLY  35  66.927  -3.779  14.112
  234   1HA   GLY  35           HA2      GLY  35  65.301  -2.232  13.287
  235   2HA   GLY  35           HA1      GLY  35  66.149  -0.932  14.125
  236    H    ASP  36           HN       ASP  36  68.294  -2.922  12.429
  237    HA   ASP  36           HA       ASP  36  68.062  -1.514   9.863
  238   1HB   ASP  36           HB2      ASP  36  70.621  -0.875  10.206
  239   2HB   ASP  36           HB1      ASP  36  69.338   0.205  10.752
  240    H    ILE  37           HN       ILE  37  69.017  -2.719   8.224
  241    HA   ILE  37           HA       ILE  37  70.317  -5.253   9.101
  242    HB   ILE  37           HB       ILE  37  69.456  -6.285   7.199
  243   1HG1  ILE  37          HG12      ILE  37  69.184  -3.558   5.889
  244   2HG1  ILE  37          HG11      ILE  37  70.506  -4.688   5.596
  245   1HG2  ILE  37          HG23      ILE  37  67.702  -4.640   8.626
  246   2HG2  ILE  37          HG22      ILE  37  67.302  -4.349   6.932
  247   3HG2  ILE  37          HG21      ILE  37  67.255  -5.988   7.580
  248   1HD1  ILE  37          HD12      ILE  37  68.698  -6.396   4.968
  249   2HD1  ILE  37          HD11      ILE  37  67.581  -5.032   4.924
  250   3HD1  ILE  37          HD13      ILE  37  68.963  -5.077   3.830
  251    H    SER  38           HN       SER  38  72.458  -5.589   8.631
  252    HA   SER  38           HA       SER  38  74.152  -3.526   7.718
  253   1HB   SER  38           HB2      SER  38  74.497  -6.534   7.654
  254   2HB   SER  38           HB1      SER  38  75.780  -5.416   7.197
  255    HG   SER  38           HG       SER  38  75.261  -6.233   9.583
  256    H    THR  39           HN       THR  39  75.295  -3.372   5.602
  257    HA   THR  39           HA       THR  39  73.421  -3.598   3.412
  258    HB   THR  39           HB       THR  39  75.071  -2.562   2.072
  259    HG1  THR  39           HG1      THR  39  77.044  -3.106   4.009
  260   1HG2  THR  39          HG21      THR  39  74.873  -1.702   4.893
  261   2HG2  THR  39          HG23      THR  39  76.223  -1.013   3.992
  262   3HG2  THR  39          HG22      THR  39  74.571  -0.793   3.413
  263    H    LYS  40           HN       LYS  40  75.300  -5.903   4.902
  264    HA   LYS  40           HA       LYS  40  76.256  -7.386   2.618
  265   1HB   LYS  40           HB2      LYS  40  76.671  -9.173   4.169
  266   2HB   LYS  40           HB1      LYS  40  77.011  -7.675   5.036
  267   1HG   LYS  40           HG2      LYS  40  74.568  -7.777   5.834
  268   2HG   LYS  40           HG1      LYS  40  74.575  -9.445   5.259
  269   1HD   LYS  40           HD2      LYS  40  76.406  -8.239   7.351
  270   2HD   LYS  40           HD1      LYS  40  75.156  -9.455   7.613
  271   1HE   LYS  40           HE2      LYS  40  76.710 -11.038   7.235
  272   2HE   LYS  40           HE1      LYS  40  76.782 -10.487   5.561
  273   1HZ   LYS  40           HZ3      LYS  40  78.248  -8.863   7.454
  274   2HZ   LYS  40           HZ2      LYS  40  78.853 -10.438   7.250
  275   3HZ   LYS  40           HZ1      LYS  40  78.698  -9.404   5.910
  276    H    ALA  41           HN       ALA  41  73.268  -7.437   4.529
  277    HA   ALA  41           HA       ALA  41  72.152  -9.590   2.843
  278   1HB   ALA  41           HB1      ALA  41  71.285  -8.144   5.325
  279   2HB   ALA  41           HB3      ALA  41  70.064  -8.953   4.342
  280   3HB   ALA  41           HB2      ALA  41  71.400  -9.879   5.027
  281    H    LEU  42           HN       LEU  42  72.487  -6.266   2.619
  282    HA   LEU  42           HA       LEU  42  69.933  -5.439   1.651
  283   1HB   LEU  42           HB2      LEU  42  72.685  -4.402   1.623
  284   2HB   LEU  42           HB1      LEU  42  71.758  -3.939   0.198
  285    HG   LEU  42           HG       LEU  42  71.386  -2.227   1.831
  286   1HD1  LEU  42          HD11      LEU  42  69.295  -3.863   0.870
  287   2HD1  LEU  42          HD13      LEU  42  68.892  -3.491   2.549
  288   3HD1  LEU  42          HD12      LEU  42  69.185  -2.183   1.398
  289   1HD2  LEU  42          HD22      LEU  42  71.450  -4.513   3.669
  290   2HD2  LEU  42          HD21      LEU  42  71.831  -2.817   3.968
  291   3HD2  LEU  42          HD23      LEU  42  70.159  -3.366   4.028
  292    H    GLY  43           HN       GLY  43  72.524  -7.261   0.180
  293   1HA   GLY  43           HA2      GLY  43  71.511  -6.930  -2.545
  294   2HA   GLY  43           HA1      GLY  43  72.803  -8.024  -2.046
  295    H    THR  44           HN       THR  44  70.858  -8.999   0.141
  296    HA   THR  44           HA       THR  44  69.816 -11.236  -1.389
  297    HB   THR  44           HB       THR  44  69.516 -10.373   1.496
  298    HG1  THR  44           HG1      THR  44  71.429 -11.504   0.296
  299   1HG2  THR  44          HG21      THR  44  68.262 -12.679   0.006
  300   2HG2  THR  44          HG23      THR  44  68.548 -12.745   1.745
  301   3HG2  THR  44          HG22      THR  44  67.479 -11.512   1.073
  302    H    VAL  45           HN       VAL  45  68.286  -8.569   0.434
  303    HA   VAL  45           HA       VAL  45  65.609  -9.192  -0.303
  304    HB   VAL  45           HB       VAL  45  66.641  -6.384   0.126
  305   1HG1  VAL  45          HG12      VAL  45  64.241  -6.782  -0.499
  306   2HG1  VAL  45          HG11      VAL  45  64.071  -7.760   0.959
  307   3HG1  VAL  45          HG13      VAL  45  64.437  -6.040   1.089
  308   1HG2  VAL  45          HG23      VAL  45  66.324  -8.664   2.068
  309   2HG2  VAL  45          HG22      VAL  45  67.634  -7.488   1.949
  310   3HG2  VAL  45          HG21      VAL  45  66.069  -7.003   2.601
  311    H    MET  46           HN       MET  46  68.186  -7.568  -2.026
  312    HA   MET  46           HA       MET  46  66.686  -6.170  -3.979
  313   1HB   MET  46           HB2      MET  46  69.427  -7.289  -3.796
  314   2HB   MET  46           HB1      MET  46  68.826  -6.989  -5.427
  315   1HG   MET  46           HG2      MET  46  68.144  -4.779  -3.690
  316   2HG   MET  46           HG1      MET  46  69.881  -5.086  -3.634
  317   1HE   MET  46           HE2      MET  46  70.257  -3.059  -4.220
  318   2HE   MET  46           HE1      MET  46  71.103  -3.043  -5.766
  319   3HE   MET  46           HE3      MET  46  69.610  -2.116  -5.560
  320    H    ARG  47           HN       ARG  47  68.068  -9.471  -4.271
  321    HA   ARG  47           HA       ARG  47  66.513  -9.989  -6.682
  322   1HB   ARG  47           HB2      ARG  47  67.931 -12.037  -4.968
  323   2HB   ARG  47           HB1      ARG  47  67.561 -12.139  -6.689
  324   1HG   ARG  47           HG2      ARG  47  69.326 -10.815  -7.286
  325   2HG   ARG  47           HG1      ARG  47  69.176  -9.794  -5.855
  326   1HD   ARG  47           HD2      ARG  47  71.243 -11.372  -6.046
  327   2HD   ARG  47           HD1      ARG  47  70.388 -11.285  -4.506
  328    HE   ARG  47           HE       ARG  47  69.415 -13.392  -6.295
  329   1HH1  ARG  47          HH11      ARG  47  69.761 -13.046  -3.159
  330   2HH1  ARG  47          HH12      ARG  47  70.816 -14.385  -2.857
  331   1HH2  ARG  47          HH21      ARG  47  71.584 -14.879  -6.201
  332   2HH2  ARG  47          HH22      ARG  47  71.849 -15.423  -4.579
  333    H    MET  48           HN       MET  48  65.878 -10.206  -3.319
  334    HA   MET  48           HA       MET  48  64.012 -12.417  -3.426
  335   1HB   MET  48           HB2      MET  48  64.453 -12.172  -1.218
  336   2HB   MET  48           HB1      MET  48  65.007 -10.517  -1.437
  337   1HG   MET  48           HG2      MET  48  62.725  -9.686  -1.356
  338   2HG   MET  48           HG1      MET  48  62.087 -11.329  -1.318
  339   1HE   MET  48           HE3      MET  48  63.109 -13.037   0.211
  340   2HE   MET  48           HE2      MET  48  64.674 -12.483   0.799
  341   3HE   MET  48           HE1      MET  48  63.367 -12.786   1.942
  342    H    LEU  49           HN       LEU  49  63.701  -8.883  -3.668
  343    HA   LEU  49           HA       LEU  49  60.787  -9.054  -3.949
  344   1HB   LEU  49           HB2      LEU  49  62.491  -6.651  -4.614
  345   2HB   LEU  49           HB1      LEU  49  60.815  -6.685  -4.068
  346    HG   LEU  49           HG       LEU  49  63.119  -7.675  -2.374
  347   1HD1  LEU  49          HD12      LEU  49  62.399  -4.977  -3.054
  348   2HD1  LEU  49          HD11      LEU  49  62.035  -5.260  -1.353
  349   3HD1  LEU  49          HD13      LEU  49  63.666  -5.534  -1.962
  350   1HD2  LEU  49          HD22      LEU  49  60.764  -8.473  -1.906
  351   2HD2  LEU  49          HD21      LEU  49  61.515  -7.592  -0.575
  352   3HD2  LEU  49          HD23      LEU  49  60.327  -6.793  -1.603
  353    H    GLY  50           HN       GLY  50  63.282  -7.668  -6.125
  354   1HA   GLY  50           HA2      GLY  50  62.455  -9.258  -8.383
  355   2HA   GLY  50           HA1      GLY  50  61.728  -7.653  -8.461
  356    H    GLN  51           HN       GLN  51  63.852  -6.152  -7.337
  357    HA   GLN  51           HA       GLN  51  65.466  -5.634  -9.595
  358   1HB   GLN  51           HB2      GLN  51  65.523  -4.892  -6.726
  359   2HB   GLN  51           HB1      GLN  51  67.065  -4.763  -7.573
  360   1HG   GLN  51           HG2      GLN  51  65.992  -2.646  -7.855
  361   2HG   GLN  51           HG1      GLN  51  65.804  -3.489  -9.393
  362   1HE2  GLN  51          HE22      GLN  51  62.515  -2.266  -7.523
  363   2HE2  GLN  51          HE21      GLN  51  64.073  -1.665  -7.214
  364    H    ASN  52           HN       ASN  52  67.359  -6.525 -10.350
  365    HA   ASN  52           HA       ASN  52  68.887  -8.356  -8.585
  366   1HB   ASN  52           HB2      ASN  52  68.975  -9.985 -10.593
  367   2HB   ASN  52           HB1      ASN  52  67.496  -9.961  -9.632
  368   1HD2  ASN  52          HD22      ASN  52  67.361  -8.873 -13.528
  369   2HD2  ASN  52          HD21      ASN  52  68.795  -9.424 -12.805
  370    HA   PRO  53           HA       PRO  53  71.382  -5.682 -11.481
  371   1HB   PRO  53           HB2      PRO  53  72.500  -4.089  -9.539
  372   2HB   PRO  53           HB1      PRO  53  70.993  -3.691 -10.384
  373   1HG   PRO  53           HG2      PRO  53  71.379  -4.687  -7.600
  374   2HG   PRO  53           HG1      PRO  53  70.061  -3.712  -8.271
  375   1HD   PRO  53           HD2      PRO  53  69.964  -6.493  -7.738
  376   2HD   PRO  53           HD1      PRO  53  68.791  -5.571  -8.702
  377    H    THR  54           HN       THR  54  73.814  -5.568 -11.473
  378    HA   THR  54           HA       THR  54  74.952  -8.003 -10.345
  379    HB   THR  54           HB       THR  54  75.686  -7.228 -12.546
  380    HG1  THR  54           HG1      THR  54  77.860  -7.409 -12.168
  381   1HG2  THR  54          HG21      THR  54  76.599  -4.769 -11.029
  382   2HG2  THR  54          HG23      THR  54  77.032  -5.125 -12.701
  383   3HG2  THR  54          HG22      THR  54  75.348  -4.838 -12.268
  384    H    LYS  55           HN       LYS  55  76.584  -8.108  -8.730
  385    HA   LYS  55           HA       LYS  55  76.345  -6.378  -6.517
  386   1HB   LYS  55           HB2      LYS  55  77.359  -8.527  -6.193
  387   2HB   LYS  55           HB1      LYS  55  78.612  -8.186  -7.388
  388   1HG   LYS  55           HG2      LYS  55  79.589  -6.482  -5.968
  389   2HG   LYS  55           HG1      LYS  55  78.257  -6.618  -4.819
  390   1HD   LYS  55           HD2      LYS  55  78.987  -9.160  -4.757
  391   2HD   LYS  55           HD1      LYS  55  80.528  -8.509  -5.318
  392   1HE   LYS  55           HE2      LYS  55  79.075  -7.368  -2.926
  393   2HE   LYS  55           HE1      LYS  55  80.237  -8.685  -2.779
  394   1HZ   LYS  55           HZ3      LYS  55  81.328  -6.660  -4.394
  395   2HZ   LYS  55           HZ2      LYS  55  80.761  -5.960  -2.954
  396   3HZ   LYS  55           HZ1      LYS  55  81.884  -7.235  -2.898
  397    H    GLU  56           HN       GLU  56  78.067  -5.930  -9.474
  398    HA   GLU  56           HA       GLU  56  80.129  -4.161  -8.647
  399   1HB   GLU  56           HB2      GLU  56  78.642  -4.663 -11.182
  400   2HB   GLU  56           HB1      GLU  56  79.543  -3.150 -11.065
  401   1HG   GLU  56           HG2      GLU  56  81.365  -4.350 -11.651
  402   2HG   GLU  56           HG1      GLU  56  81.304  -5.034 -10.026
  403    H    GLU  57           HN       GLU  57  76.726  -3.509  -9.473
  404    HA   GLU  57           HA       GLU  57  77.091  -0.643  -8.861
  405   1HB   GLU  57           HB2      GLU  57  75.589  -1.640 -10.728
  406   2HB   GLU  57           HB1      GLU  57  74.455  -1.994  -9.423
  407   1HG   GLU  57           HG2      GLU  57  74.162   0.283  -8.893
  408   2HG   GLU  57           HG1      GLU  57  75.640   0.760  -9.731
  409    H    LEU  58           HN       LEU  58  75.731  -3.537  -7.393
  410    HA   LEU  58           HA       LEU  58  74.139  -2.311  -5.382
  411   1HB   LEU  58           HB2      LEU  58  74.098  -4.735  -5.829
  412   2HB   LEU  58           HB1      LEU  58  75.746  -4.879  -5.218
  413    HG   LEU  58           HG       LEU  58  74.680  -3.652  -3.102
  414   1HD1  LEU  58          HD11      LEU  58  72.368  -5.083  -4.445
  415   2HD1  LEU  58          HD13      LEU  58  72.372  -4.614  -2.745
  416   3HD1  LEU  58          HD12      LEU  58  72.453  -3.377  -4.001
  417   1HD2  LEU  58          HD22      LEU  58  74.825  -6.525  -3.913
  418   2HD2  LEU  58          HD21      LEU  58  75.660  -5.685  -2.607
  419   3HD2  LEU  58          HD23      LEU  58  73.968  -6.145  -2.419
  420    H    ASP  59           HN       ASP  59  77.600  -3.215  -5.327
  421    HA   ASP  59           HA       ASP  59  78.106  -2.389  -2.651
  422   1HB   ASP  59           HB2      ASP  59  79.713  -3.713  -3.971
  423   2HB   ASP  59           HB1      ASP  59  79.979  -2.332  -5.035
  424    H    ALA  60           HN       ALA  60  78.424  -0.565  -5.712
  425    HA   ALA  60           HA       ALA  60  79.297   1.874  -4.500
  426   1HB   ALA  60           HB2      ALA  60  79.166   1.117  -7.033
  427   2HB   ALA  60           HB1      ALA  60  77.590   1.906  -6.964
  428   3HB   ALA  60           HB3      ALA  60  79.052   2.825  -6.607
  429    H    ILE  61           HN       ILE  61  76.171   0.382  -4.758
  430    HA   ILE  61           HA       ILE  61  74.636   2.807  -4.274
  431    HB   ILE  61           HB       ILE  61  74.012  -0.148  -4.191
  432   1HG1  ILE  61          HG12      ILE  61  72.890   2.106  -5.880
  433   2HG1  ILE  61          HG11      ILE  61  74.252   1.098  -6.374
  434   1HG2  ILE  61          HG22      ILE  61  72.309   2.192  -3.330
  435   2HG2  ILE  61          HG21      ILE  61  71.586   0.701  -3.938
  436   3HG2  ILE  61          HG23      ILE  61  72.587   0.667  -2.486
  437   1HD1  ILE  61          HD11      ILE  61  72.434  -0.801  -5.624
  438   2HD1  ILE  61          HD13      ILE  61  71.375   0.451  -6.271
  439   3HD1  ILE  61          HD12      ILE  61  72.647  -0.234  -7.280
  440    H    ILE  62           HN       ILE  62  75.769   0.092  -2.272
  441    HA   ILE  62           HA       ILE  62  74.561   0.812   0.172
  442    HB   ILE  62           HB       ILE  62  77.249  -0.471  -0.385
  443   1HG1  ILE  62          HG12      ILE  62  74.608  -1.663   0.513
  444   2HG1  ILE  62          HG11      ILE  62  75.156  -1.639  -1.162
  445   1HG2  ILE  62          HG23      ILE  62  75.742   0.020   2.183
  446   2HG2  ILE  62          HG22      ILE  62  76.875  -1.325   2.027
  447   3HG2  ILE  62          HG21      ILE  62  77.442   0.333   1.832
  448   1HD1  ILE  62          HD11      ILE  62  76.852  -2.812   1.045
  449   2HD1  ILE  62          HD13      ILE  62  75.655  -3.774   0.177
  450   3HD1  ILE  62          HD12      ILE  62  77.007  -3.052  -0.694
  451    H    GLU  63           HN       GLU  63  77.609   1.951  -1.271
  452    HA   GLU  63           HA       GLU  63  78.403   3.564   0.968
  453   1HB   GLU  63           HB2      GLU  63  80.055   2.995  -0.687
  454   2HB   GLU  63           HB1      GLU  63  79.085   3.702  -1.979
  455   1HG   GLU  63           HG2      GLU  63  79.317   5.932  -0.899
  456   2HG   GLU  63           HG1      GLU  63  80.354   5.206   0.330
  457    H    GLU  64           HN       GLU  64  76.583   4.324  -2.004
  458    HA   GLU  64           HA       GLU  64  76.262   7.121  -1.299
  459   1HB   GLU  64           HB2      GLU  64  75.403   5.325  -3.468
  460   2HB   GLU  64           HB1      GLU  64  74.239   6.592  -3.079
  461   1HG   GLU  64           HG2      GLU  64  77.123   7.350  -3.303
  462   2HG   GLU  64           HG1      GLU  64  76.227   7.040  -4.791
  463    H    VAL  65           HN       VAL  65  74.785   4.257  -0.203
  464    HA   VAL  65           HA       VAL  65  72.215   5.562   0.440
  465    HB   VAL  65           HB       VAL  65  73.267   2.797   1.110
  466   1HG1  VAL  65          HG13      VAL  65  71.047   4.288   2.136
  467   2HG1  VAL  65          HG12      VAL  65  70.421   2.985   1.125
  468   3HG1  VAL  65          HG11      VAL  65  71.490   2.616   2.479
  469   1HG2  VAL  65          HG23      VAL  65  72.616   3.712  -1.353
  470   2HG2  VAL  65          HG22      VAL  65  72.308   2.053  -0.836
  471   3HG2  VAL  65          HG21      VAL  65  71.014   3.250  -0.775
  472    H    ASP  66           HN       ASP  66  75.156   4.456   2.084
  473    HA   ASP  66           HA       ASP  66  74.103   5.208   4.719
  474   1HB   ASP  66           HB2      ASP  66  76.291   3.649   3.721
  475   2HB   ASP  66           HB1      ASP  66  76.933   4.899   4.787
  476    H    GLU  67           HN       GLU  67  73.648   7.482   3.966
  477    HA   GLU  67           HA       GLU  67  75.782   9.272   3.270
  478   1HB   GLU  67           HB2      GLU  67  72.970   9.591   4.265
  479   2HB   GLU  67           HB1      GLU  67  74.039  10.994   4.269
  480   1HG   GLU  67           HG2      GLU  67  74.409   9.698   1.773
  481   2HG   GLU  67           HG1      GLU  67  72.668   9.792   2.042
  482    H    ASP  68           HN       ASP  68  74.881   7.814   6.241
  483    HA   ASP  68           HA       ASP  68  76.323   9.894   7.811
  484   1HB   ASP  68           HB2      ASP  68  75.486   8.385   9.759
  485   2HB   ASP  68           HB1      ASP  68  74.300   9.372   8.903
  486    H    GLY  69           HN       GLY  69  76.792   6.843   6.365
  487   1HA   GLY  69           HA2      GLY  69  78.590   5.338   6.451
  488   2HA   GLY  69           HA1      GLY  69  79.518   6.657   7.168
  489    H    SER  70           HN       SER  70  76.597   5.086   8.454
  490    HA   SER  70           HA       SER  70  77.890   4.778  11.055
  491   1HB   SER  70           HB2      SER  70  75.683   3.606  11.606
  492   2HB   SER  70           HB1      SER  70  75.560   5.293  11.114
  493    HG   SER  70           HG       SER  70  74.819   2.959   9.781
  494    H    GLY  71           HN       GLY  71  77.764   2.933   8.208
  495   1HA   GLY  71           HA2      GLY  71  78.931   0.878   7.860
  496   2HA   GLY  71           HA1      GLY  71  79.014   0.659   9.610
  497    H    THR  72           HN       THR  72  75.921   1.542   8.434
  498    HA   THR  72           HA       THR  72  75.002  -1.200   7.959
  499    HB   THR  72           HB       THR  72  73.234  -0.495   9.961
  500    HG1  THR  72           HG1      THR  72  74.929  -0.123  11.680
  501   1HG2  THR  72          HG23      THR  72  75.728  -2.207  10.015
  502   2HG2  THR  72          HG22      THR  72  74.532  -2.206  11.309
  503   3HG2  THR  72          HG21      THR  72  74.074  -2.727   9.687
  504    H    ILE  73           HN       ILE  73  72.530  -1.164   7.632
  505    HA   ILE  73           HA       ILE  73  71.764   1.476   6.445
  506    HB   ILE  73           HB       ILE  73  70.922  -1.317   5.611
  507   1HG1  ILE  73          HG12      ILE  73  73.303  -0.533   5.076
  508   2HG1  ILE  73          HG11      ILE  73  72.316  -1.007   3.694
  509   1HG2  ILE  73          HG22      ILE  73  70.011   1.431   4.889
  510   2HG2  ILE  73          HG21      ILE  73  70.150   0.255   3.582
  511   3HG2  ILE  73          HG23      ILE  73  69.096  -0.075   4.957
  512   1HD1  ILE  73          HD12      ILE  73  71.891   1.788   4.300
  513   2HD1  ILE  73          HD11      ILE  73  73.613   1.467   4.086
  514   3HD1  ILE  73          HD13      ILE  73  72.473   1.055   2.804
  515    H    ASP  74           HN       ASP  74  69.721   2.285   6.954
  516    HA   ASP  74           HA       ASP  74  68.166   0.698   8.959
  517   1HB   ASP  74           HB2      ASP  74  68.163   3.712   8.689
  518   2HB   ASP  74           HB1      ASP  74  67.542   2.745  10.029
  519    H    PHE  75           HN       PHE  75  65.769   1.325   8.944
  520    HA   PHE  75           HA       PHE  75  64.595   0.797   6.447
  521   1HB   PHE  75           HB2      PHE  75  63.535   0.787   8.813
  522   2HB   PHE  75           HB1      PHE  75  63.214   2.498   8.520
  523    HD1  PHE  75           HD2      PHE  75  63.071  -0.627   6.444
  524    HD2  PHE  75           HD1      PHE  75  61.031   2.891   7.821
  525    HE1  PHE  75           HE2      PHE  75  61.096  -1.235   5.071
  526    HE2  PHE  75           HE1      PHE  75  59.055   2.285   6.449
  527    HZ   PHE  75           HZ       PHE  75  59.088   0.222   5.073
  528    H    GLU  76           HN       GLU  76  65.076   3.973   8.016
  529    HA   GLU  76           HA       GLU  76  63.865   5.577   6.037
  530   1HB   GLU  76           HB2      GLU  76  65.283   7.399   6.868
  531   2HB   GLU  76           HB1      GLU  76  64.692   6.432   8.220
  532   1HG   GLU  76           HG2      GLU  76  66.812   5.202   8.299
  533   2HG   GLU  76           HG1      GLU  76  67.407   6.108   6.908
  534    H    GLU  77           HN       GLU  77  67.046   4.049   6.072
  535    HA   GLU  77           HA       GLU  77  67.885   5.453   3.630
  536   1HB   GLU  77           HB2      GLU  77  69.152   3.158   5.158
  537   2HB   GLU  77           HB1      GLU  77  69.899   4.007   3.803
  538   1HG   GLU  77           HG2      GLU  77  69.664   6.147   5.102
  539   2HG   GLU  77           HG1      GLU  77  69.112   5.193   6.479
  540    H    PHE  78           HN       PHE  78  66.250   2.515   4.474
  541    HA   PHE  78           HA       PHE  78  66.859   0.889   2.235
  542   1HB   PHE  78           HB2      PHE  78  65.213   0.659   4.418
  543   2HB   PHE  78           HB1      PHE  78  64.043   0.832   3.109
  544    HD1  PHE  78           HD1      PHE  78  66.767  -1.223   4.480
  545    HD2  PHE  78           HD2      PHE  78  63.891  -0.815   1.319
  546    HE1  PHE  78           HE1      PHE  78  67.176  -3.578   3.805
  547    HE2  PHE  78           HE2      PHE  78  64.299  -3.167   0.641
  548    HZ   PHE  78           HZ       PHE  78  65.942  -4.548   1.883
  549    H    LEU  79           HN       LEU  79  64.106   3.134   2.658
  550    HA   LEU  79           HA       LEU  79  62.977   2.911   0.107
  551   1HB   LEU  79           HB2      LEU  79  63.294   5.513   1.634
  552   2HB   LEU  79           HB1      LEU  79  62.043   5.122   0.455
  553    HG   LEU  79           HG       LEU  79  62.451   3.799   3.152
  554   1HD1  LEU  79          HD12      LEU  79  60.410   5.703   2.005
  555   2HD1  LEU  79          HD11      LEU  79  60.044   4.687   3.400
  556   3HD1  LEU  79          HD13      LEU  79  61.350   5.867   3.488
  557   1HD2  LEU  79          HD22      LEU  79  60.966   3.004   0.713
  558   2HD2  LEU  79          HD21      LEU  79  61.567   2.007   2.039
  559   3HD2  LEU  79          HD23      LEU  79  60.055   2.900   2.221
  560    H    VAL  80           HN       VAL  80  65.940   4.522   1.068
  561    HA   VAL  80           HA       VAL  80  66.260   6.084  -1.341
  562    HB   VAL  80           HB       VAL  80  68.251   5.089   0.714
  563   1HG1  VAL  80          HG13      VAL  80  68.593   6.655  -1.819
  564   2HG1  VAL  80          HG12      VAL  80  69.582   7.081  -0.421
  565   3HG1  VAL  80          HG11      VAL  80  69.661   5.453  -1.094
  566   1HG2  VAL  80          HG23      VAL  80  66.441   7.383   0.457
  567   2HG2  VAL  80          HG22      VAL  80  67.275   6.768   1.883
  568   3HG2  VAL  80          HG21      VAL  80  68.110   7.856   0.774
  569    H    MET  81           HN       MET  81  67.363   2.857  -0.341
  570    HA   MET  81           HA       MET  81  69.023   2.294  -2.566
  571   1HB   MET  81           HB2      MET  81  67.292   0.446  -0.900
  572   2HB   MET  81           HB1      MET  81  68.500  -0.112  -2.058
  573   1HG   MET  81           HG2      MET  81  69.949   1.701  -0.608
  574   2HG   MET  81           HG1      MET  81  68.868   1.053   0.627
  575   1HE   MET  81           HE1      MET  81  71.545   1.116   0.834
  576   2HE   MET  81           HE3      MET  81  72.038  -0.479   1.419
  577   3HE   MET  81           HE2      MET  81  72.601   0.102  -0.146
  578    H    MET  82           HN       MET  82  65.512   1.846  -2.159
  579    HA   MET  82           HA       MET  82  65.074   0.559  -4.678
  580   1HB   MET  82           HB2      MET  82  63.392   1.938  -2.646
  581   2HB   MET  82           HB1      MET  82  62.707   1.768  -4.263
  582   1HG   MET  82           HG2      MET  82  62.082  -0.180  -2.965
  583   2HG   MET  82           HG1      MET  82  63.265  -0.675  -4.176
  584   1HE   MET  82           HE2      MET  82  65.423  -1.352  -3.924
  585   2HE   MET  82           HE1      MET  82  66.085  -2.094  -2.468
  586   3HE   MET  82           HE3      MET  82  64.600  -2.727  -3.190
  587    H    VAL  83           HN       VAL  83  63.872   3.824  -3.931
  588    HA   VAL  83           HA       VAL  83  63.654   4.683  -6.597
  589    HB   VAL  83           HB       VAL  83  64.398   6.500  -4.297
  590   1HG1  VAL  83          HG12      VAL  83  63.087   6.793  -6.978
  591   2HG1  VAL  83          HG11      VAL  83  62.584   7.861  -5.667
  592   3HG1  VAL  83          HG13      VAL  83  64.268   7.839  -6.191
  593   1HG2  VAL  83          HG22      VAL  83  62.008   4.821  -4.753
  594   2HG2  VAL  83          HG21      VAL  83  62.589   5.570  -3.266
  595   3HG2  VAL  83          HG23      VAL  83  61.659   6.519  -4.426
  596    H    ARG  84           HN       ARG  84  66.524   4.196  -4.764
  597    HA   ARG  84           HA       ARG  84  68.299   6.100  -5.800
  598   1HB   ARG  84           HB2      ARG  84  68.501   3.547  -4.494
  599   2HB   ARG  84           HB1      ARG  84  69.677   3.616  -5.807
  600   1HG   ARG  84           HG2      ARG  84  69.895   6.129  -4.684
  601   2HG   ARG  84           HG1      ARG  84  69.616   5.105  -3.276
  602   1HD   ARG  84           HD2      ARG  84  71.968   5.071  -3.565
  603   2HD   ARG  84           HD1      ARG  84  71.418   3.552  -4.274
  604    HE   ARG  84           HE       ARG  84  72.375   4.339  -6.268
  605   1HH1  ARG  84          HH11      ARG  84  70.530   6.086  -7.354
  606   2HH1  ARG  84          HH12      ARG  84  71.201   7.677  -7.207
  607   1HH2  ARG  84          HH21      ARG  84  73.516   6.761  -4.792
  608   2HH2  ARG  84          HH22      ARG  84  72.892   8.058  -5.755
  609    H    GLN  85           HN       GLN  85  67.666   2.857  -7.219
  610    HA   GLN  85           HA       GLN  85  68.773   3.911  -9.780
  611   1HB   GLN  85           HB2      GLN  85  68.738   1.267  -8.461
  612   2HB   GLN  85           HB1      GLN  85  68.445   1.235 -10.199
  613   1HG   GLN  85           HG2      GLN  85  70.601   3.068  -9.531
  614   2HG   GLN  85           HG1      GLN  85  70.937   1.441  -8.939
  615   1HE2  GLN  85          HE22      GLN  85  71.520   2.126 -12.791
  616   2HE2  GLN  85          HE21      GLN  85  71.516   3.310 -11.575
  617    H    MET  86           HN       MET  86  65.829   2.853  -8.283
  618    HA   MET  86           HA       MET  86  64.428   2.035 -10.641
  619   1HB   MET  86           HB2      MET  86  62.715   1.685  -9.200
  620   2HB   MET  86           HB1      MET  86  63.844   2.147  -7.933
  621   1HG   MET  86           HG2      MET  86  63.100   4.566  -8.363
  622   2HG   MET  86           HG1      MET  86  61.782   3.879  -9.311
  623   1HE   MET  86           HE3      MET  86  60.644   1.583  -8.286
  624   2HE   MET  86           HE2      MET  86  59.576   2.011  -6.952
  625   3HE   MET  86           HE1      MET  86  59.635   3.033  -8.386
  626    H    LYS  87           HN       LYS  87  65.597   5.074  -9.703
  627    HA   LYS  87           HA       LYS  87  63.589   6.816 -10.742
  628   1HB   LYS  87           HB2      LYS  87  66.510   7.021 -10.173
  629   2HB   LYS  87           HB1      LYS  87  65.806   8.244 -11.230
  630   1HG   LYS  87           HG2      LYS  87  63.940   8.084  -9.211
  631   2HG   LYS  87           HG1      LYS  87  65.454   7.844  -8.337
  632   1HD   LYS  87           HD2      LYS  87  66.197   9.888  -9.931
  633   2HD   LYS  87           HD1      LYS  87  64.473  10.241  -9.801
  634   1HE   LYS  87           HE2      LYS  87  66.163   9.642  -7.370
  635   2HE   LYS  87           HE1      LYS  87  65.996  11.277  -8.010
  636   1HZ   LYS  87           HZ1      LYS  87  63.567  11.006  -7.833
  637   2HZ   LYS  87           HZ3      LYS  87  63.804   9.502  -7.084
  638   3HZ   LYS  87           HZ2      LYS  87  64.352  10.922  -6.329
  639    H    GLU  88           HN       GLU  88  65.895   4.750 -12.318
  640    HA   GLU  88           HA       GLU  88  66.334   4.376 -14.595
  641   1HB   GLU  88           HB2      GLU  88  63.675   4.356 -14.355
  642   2HB   GLU  88           HB1      GLU  88  63.819   5.808 -15.349
  643   1HG   GLU  88           HG2      GLU  88  65.311   4.435 -16.902
  644   2HG   GLU  88           HG1      GLU  88  64.780   3.014 -16.001
  645    H    ASP  89           HN       ASP  89  68.094   5.865 -14.742
  646    HA   ASP  89           HA       ASP  89  67.483   8.662 -15.480
  647   1HB   ASP  89           HB2      ASP  89  70.050   8.795 -15.536
  648   2HB   ASP  89           HB1      ASP  89  69.307   8.482 -13.967
  649    H    ALA  90           HN       ALA  90  67.356   5.925 -17.164
  650    HA   ALA  90           HA       ALA  90  67.518   5.434 -19.452
  651   1HB   ALA  90           HB1      ALA  90  66.508   7.774 -19.575
  652   2HB   ALA  90           HB3      ALA  90  68.149   8.371 -19.828
  653   3HB   ALA  90           HB2      ALA  90  67.424   7.265 -20.995
   
  No H/Q in entry =         653
  Start of MODEL   19
    1   1H    ALA   1           HT3      ALA   1  69.276  16.505  12.012
    2   2H    ALA   1           HT2      ALA   1  70.408  15.468  12.743
    3   3H    ALA   1           HT1      ALA   1  69.566  16.609  13.680
    4    HA   ALA   1           HA       ALA   1  70.731  18.408  12.780
    5   1HB   ALA   1           HB3      ALA   1  72.031  16.355  14.103
    6   2HB   ALA   1           HB2      ALA   1  73.064  16.631  12.701
    7   3HB   ALA   1           HB1      ALA   1  72.703  17.959  13.803
    8    H    SER   2           HN       SER   2  71.410  15.431  10.941
    9    HA   SER   2           HA       SER   2  71.736  17.140   8.522
   10   1HB   SER   2           HB2      SER   2  73.607  14.909   9.368
   11   2HB   SER   2           HB1      SER   2  73.643  15.707   7.799
   12    HG   SER   2           HG       SER   2  73.936  16.968  10.331
   13    H    MET   3           HN       MET   3  70.464  16.378   6.901
   14    HA   MET   3           HA       MET   3  69.813  13.466   6.864
   15   1HB   MET   3           HB2      MET   3  67.474  14.189   6.112
   16   2HB   MET   3           HB1      MET   3  67.851  14.438   7.816
   17   1HG   MET   3           HG2      MET   3  68.309  16.780   7.445
   18   2HG   MET   3           HG1      MET   3  68.190  16.577   5.698
   19   1HE   MET   3           HE2      MET   3  66.851  16.644   8.989
   20   2HE   MET   3           HE1      MET   3  65.913  18.076   8.574
   21   3HE   MET   3           HE3      MET   3  65.092  16.554   8.943
   22    H    THR   4           HN       THR   4  70.523  12.704   4.935
   23    HA   THR   4           HA       THR   4  71.347  14.293   2.746
   24    HB   THR   4           HB       THR   4  71.019  12.104   1.422
   25    HG1  THR   4           HG1      THR   4  69.665  10.855   2.440
   26   1HG2  THR   4          HG23      THR   4  72.783  12.681   3.717
   27   2HG2  THR   4          HG22      THR   4  72.709  10.983   3.252
   28   3HG2  THR   4          HG21      THR   4  73.197  12.199   2.072
   29    H    ASP   5           HN       ASP   5  70.263  15.156   1.000
   30    HA   ASP   5           HA       ASP   5  67.403  15.459   1.148
   31   1HB   ASP   5           HB2      ASP   5  69.430  16.075  -1.012
   32   2HB   ASP   5           HB1      ASP   5  67.711  16.423  -1.201
   33    H    GLN   6           HN       GLN   6  69.491  13.129  -0.380
   34    HA   GLN   6           HA       GLN   6  67.787  12.154  -2.422
   35   1HB   GLN   6           HB2      GLN   6  69.914  10.883  -0.711
   36   2HB   GLN   6           HB1      GLN   6  68.979   9.900  -1.839
   37   1HG   GLN   6           HG2      GLN   6  70.051  10.756  -3.641
   38   2HG   GLN   6           HG1      GLN   6  69.945  12.404  -3.022
   39   1HE2  GLN   6          HE22      GLN   6  73.041  10.280  -1.368
   40   2HE2  GLN   6          HE21      GLN   6  71.477   9.623  -1.365
   41    H    GLN   7           HN       GLN   7  67.698  11.688   1.058
   42    HA   GLN   7           HA       GLN   7  65.762   9.508   0.940
   43   1HB   GLN   7           HB2      GLN   7  66.716  11.298   3.191
   44   2HB   GLN   7           HB1      GLN   7  65.542  10.000   3.416
   45   1HG   GLN   7           HG2      GLN   7  67.122   8.330   2.741
   46   2HG   GLN   7           HG1      GLN   7  68.260   9.549   2.166
   47   1HE2  GLN   7          HE22      GLN   7  69.786   9.003   5.356
   48   2HE2  GLN   7          HE21      GLN   7  69.873   8.604   3.708
   49    H    ALA   8           HN       ALA   8  65.637  13.019   1.208
   50    HA   ALA   8           HA       ALA   8  62.858  13.173   1.966
   51   1HB   ALA   8           HB1      ALA   8  64.792  15.002   1.934
   52   2HB   ALA   8           HB3      ALA   8  64.131  15.335   0.333
   53   3HB   ALA   8           HB2      ALA   8  63.099  15.467   1.759
   54    H    GLU   9           HN       GLU   9  64.506  12.674  -1.065
   55    HA   GLU   9           HA       GLU   9  62.129  13.337  -2.668
   56   1HB   GLU   9           HB2      GLU   9  64.916  13.050  -3.167
   57   2HB   GLU   9           HB1      GLU   9  64.086  11.837  -4.142
   58   1HG   GLU   9           HG2      GLU   9  63.417  14.795  -4.068
   59   2HG   GLU   9           HG1      GLU   9  64.278  13.969  -5.368
   60    H    ALA  10           HN       ALA  10  63.946  10.411  -1.738
   61    HA   ALA  10           HA       ALA  10  62.353   8.536  -3.162
   62   1HB   ALA  10           HB3      ALA  10  63.945   8.306  -0.601
   63   2HB   ALA  10           HB2      ALA  10  63.132   6.924  -1.338
   64   3HB   ALA  10           HB1      ALA  10  64.408   7.767  -2.215
   65    H    ARG  11           HN       ARG  11  61.911  10.025   0.023
   66    HA   ARG  11           HA       ARG  11  59.666   8.386   0.788
   67   1HB   ARG  11           HB2      ARG  11  61.214  10.400   1.982
   68   2HB   ARG  11           HB1      ARG  11  59.581  11.062   1.911
   69   1HG   ARG  11           HG2      ARG  11  58.796   9.595   3.450
   70   2HG   ARG  11           HG1      ARG  11  59.668   8.241   2.730
   71   1HD   ARG  11           HD2      ARG  11  60.685   8.517   4.850
   72   2HD   ARG  11           HD1      ARG  11  61.790   9.320   3.733
   73    HE   ARG  11           HE       ARG  11  61.345  11.300   4.911
   74   1HH1  ARG  11          HH11      ARG  11  59.352   8.959   6.219
   75   2HH1  ARG  11          HH12      ARG  11  58.111  10.047   6.745
   76   1HH2  ARG  11          HH21      ARG  11  59.455  12.794   5.112
   77   2HH2  ARG  11          HH22      ARG  11  58.170  12.217   6.118
   78    H    ALA  12           HN       ALA  12  60.019  11.178  -1.264
   79    HA   ALA  12           HA       ALA  12  57.198  11.918  -1.182
   80   1HB   ALA  12           HB3      ALA  12  59.605  13.030  -2.223
   81   2HB   ALA  12           HB2      ALA  12  58.483  12.846  -3.571
   82   3HB   ALA  12           HB1      ALA  12  58.010  13.779  -2.150
   83    H    PHE  13           HN       PHE  13  59.210   9.782  -3.105
   84    HA   PHE  13           HA       PHE  13  57.099   9.400  -5.123
   85   1HB   PHE  13           HB2      PHE  13  59.494   9.365  -5.776
   86   2HB   PHE  13           HB1      PHE  13  59.742   7.957  -4.742
   87    HD1  PHE  13           HD1      PHE  13  57.170   9.022  -7.264
   88    HD2  PHE  13           HD2      PHE  13  59.854   5.957  -5.911
   89    HE1  PHE  13           HE1      PHE  13  56.401   7.541  -9.099
   90    HE2  PHE  13           HE2      PHE  13  59.086   4.473  -7.746
   91    HZ   PHE  13           HZ       PHE  13  57.359   5.265  -9.339
   92    H    LEU  14           HN       LEU  14  58.308   7.850  -2.228
   93    HA   LEU  14           HA       LEU  14  56.682   5.428  -2.751
   94   1HB   LEU  14           HB2      LEU  14  58.442   6.101  -0.374
   95   2HB   LEU  14           HB1      LEU  14  57.747   4.525  -0.749
   96    HG   LEU  14           HG       LEU  14  59.633   6.009  -2.598
   97   1HD1  LEU  14          HD12      LEU  14  60.127   4.332  -0.229
   98   2HD1  LEU  14          HD11      LEU  14  60.976   3.790  -1.676
   99   3HD1  LEU  14          HD13      LEU  14  61.217   5.430  -1.075
  100   1HD2  LEU  14          HD21      LEU  14  58.397   3.249  -2.547
  101   2HD2  LEU  14          HD23      LEU  14  58.338   4.448  -3.841
  102   3HD2  LEU  14          HD22      LEU  14  59.845   3.600  -3.491
  103    H    SER  15           HN       SER  15  54.623   5.317  -2.007
  104    HA   SER  15           HA       SER  15  53.697   7.356  -0.071
  105   1HB   SER  15           HB2      SER  15  52.256   5.332  -1.798
  106   2HB   SER  15           HB1      SER  15  51.428   6.318  -0.595
  107    HG   SER  15           HG       SER  15  51.883   8.108  -1.737
  108    H    GLU  16           HN       GLU  16  52.141   6.509   1.674
  109    HA   GLU  16           HA       GLU  16  53.509   4.684   3.375
  110   1HB   GLU  16           HB2      GLU  16  51.124   6.283   3.476
  111   2HB   GLU  16           HB1      GLU  16  50.755   4.666   4.074
  112   1HG   GLU  16           HG2      GLU  16  51.524   5.933   5.963
  113   2HG   GLU  16           HG1      GLU  16  52.841   4.847   5.515
  114    H    GLU  17           HN       GLU  17  50.996   4.185   0.957
  115    HA   GLU  17           HA       GLU  17  50.323   1.497   1.755
  116   1HB   GLU  17           HB2      GLU  17  49.140   1.355  -0.326
  117   2HB   GLU  17           HB1      GLU  17  48.955   3.017   0.239
  118   1HG   GLU  17           HG2      GLU  17  49.749   3.654  -1.776
  119   2HG   GLU  17           HG1      GLU  17  51.323   3.080  -1.222
  120    H    MET  18           HN       MET  18  52.962   2.860  -0.048
  121    HA   MET  18           HA       MET  18  53.708   0.203  -1.139
  122   1HB   MET  18           HB2      MET  18  53.854   2.467  -2.424
  123   2HB   MET  18           HB1      MET  18  55.320   2.724  -1.477
  124   1HG   MET  18           HG2      MET  18  56.322   1.578  -3.174
  125   2HG   MET  18           HG1      MET  18  55.710   0.162  -2.320
  126   1HE   MET  18           HE2      MET  18  55.505   2.667  -4.946
  127   2HE   MET  18           HE1      MET  18  54.359   2.114  -6.164
  128   3HE   MET  18           HE3      MET  18  53.780   2.932  -4.706
  129    H    ILE  19           HN       ILE  19  54.557   2.413   1.420
  130    HA   ILE  19           HA       ILE  19  57.143   1.115   1.925
  131    HB   ILE  19           HB       ILE  19  55.569   3.268   3.347
  132   1HG1  ILE  19          HG12      ILE  19  58.362   3.690   2.511
  133   2HG1  ILE  19          HG11      ILE  19  57.263   3.342   1.175
  134   1HG2  ILE  19          HG23      ILE  19  58.080   1.815   4.197
  135   2HG2  ILE  19          HG22      ILE  19  57.716   3.447   4.754
  136   3HG2  ILE  19          HG21      ILE  19  56.625   2.119   5.144
  137   1HD1  ILE  19          HD13      ILE  19  56.653   5.406   3.301
  138   2HD1  ILE  19          HD12      ILE  19  57.482   5.802   1.796
  139   3HD1  ILE  19          HD11      ILE  19  55.835   5.174   1.756
  140    H    ALA  20           HN       ALA  20  53.849   0.666   2.831
  141    HA   ALA  20           HA       ALA  20  54.293  -0.629   5.374
  142   1HB   ALA  20           HB2      ALA  20  52.040  -0.361   3.447
  143   2HB   ALA  20           HB1      ALA  20  51.987  -1.756   4.526
  144   3HB   ALA  20           HB3      ALA  20  52.058  -0.126   5.195
  145    H    GLU  21           HN       GLU  21  54.201  -1.692   2.023
  146    HA   GLU  21           HA       GLU  21  54.423  -4.522   2.690
  147   1HB   GLU  21           HB2      GLU  21  53.419  -4.246   0.611
  148   2HB   GLU  21           HB1      GLU  21  54.424  -2.862   0.194
  149   1HG   GLU  21           HG2      GLU  21  56.131  -4.167  -0.607
  150   2HG   GLU  21           HG1      GLU  21  55.810  -5.474   0.534
  151    H    PHE  22           HN       PHE  22  56.640  -1.992   1.488
  152    HA   PHE  22           HA       PHE  22  58.961  -3.622   1.282
  153   1HB   PHE  22           HB2      PHE  22  58.529  -0.678   1.769
  154   2HB   PHE  22           HB1      PHE  22  60.154  -1.361   1.773
  155    HD1  PHE  22           HD1      PHE  22  57.709  -3.046  -0.312
  156    HD2  PHE  22           HD2      PHE  22  60.614   0.117  -0.229
  157    HE1  PHE  22           HE1      PHE  22  57.737  -3.007  -2.791
  158    HE2  PHE  22           HE2      PHE  22  60.642   0.155  -2.709
  159    HZ   PHE  22           HZ       PHE  22  59.204  -1.407  -3.988
  160    H    LYS  23           HN       LYS  23  57.461  -2.043   4.059
  161    HA   LYS  23           HA       LYS  23  59.642  -2.368   5.888
  162   1HB   LYS  23           HB2      LYS  23  57.788  -0.913   6.462
  163   2HB   LYS  23           HB1      LYS  23  56.648  -2.256   6.361
  164   1HG   LYS  23           HG2      LYS  23  57.147  -1.905   8.697
  165   2HG   LYS  23           HG1      LYS  23  57.955  -3.391   8.200
  166   1HD   LYS  23           HD2      LYS  23  60.068  -2.422   8.250
  167   2HD   LYS  23           HD1      LYS  23  59.440  -0.795   7.989
  168   1HE   LYS  23           HE2      LYS  23  60.206  -1.013  10.301
  169   2HE   LYS  23           HE1      LYS  23  58.451  -0.839  10.272
  170   1HZ   LYS  23           HZ2      LYS  23  59.749  -3.495  10.276
  171   2HZ   LYS  23           HZ1      LYS  23  59.418  -2.666  11.721
  172   3HZ   LYS  23           HZ3      LYS  23  58.148  -3.100  10.684
  173    H    ALA  24           HN       ALA  24  57.090  -4.541   4.796
  174    HA   ALA  24           HA       ALA  24  57.338  -6.555   6.780
  175   1HB   ALA  24           HB2      ALA  24  56.270  -6.360   4.044
  176   2HB   ALA  24           HB1      ALA  24  56.842  -7.974   4.468
  177   3HB   ALA  24           HB3      ALA  24  55.606  -7.189   5.453
  178    H    ALA  25           HN       ALA  25  58.995  -6.310   3.612
  179    HA   ALA  25           HA       ALA  25  60.697  -8.575   4.064
  180   1HB   ALA  25           HB2      ALA  25  60.189  -6.908   1.931
  181   2HB   ALA  25           HB1      ALA  25  61.822  -6.426   2.392
  182   3HB   ALA  25           HB3      ALA  25  61.481  -8.108   1.981
  183    H    PHE  26           HN       PHE  26  60.952  -5.165   4.908
  184    HA   PHE  26           HA       PHE  26  63.683  -4.950   5.501
  185   1HB   PHE  26           HB2      PHE  26  61.934  -3.123   5.676
  186   2HB   PHE  26           HB1      PHE  26  61.471  -3.816   7.231
  187    HD1  PHE  26           HD1      PHE  26  64.696  -3.062   5.464
  188    HD2  PHE  26           HD2      PHE  26  62.379  -2.710   9.061
  189    HE1  PHE  26           HE1      PHE  26  66.577  -1.867   6.556
  190    HE2  PHE  26           HE2      PHE  26  64.258  -1.515  10.156
  191    HZ   PHE  26           HZ       PHE  26  66.357  -1.094   8.903
  192    H    ASP  27           HN       ASP  27  61.225  -5.567   8.034
  193    HA   ASP  27           HA       ASP  27  63.053  -6.480   9.982
  194   1HB   ASP  27           HB2      ASP  27  61.111  -7.504  11.087
  195   2HB   ASP  27           HB1      ASP  27  60.689  -5.910  10.460
  196    H    MET  28           HN       MET  28  61.969  -8.034   7.109
  197    HA   MET  28           HA       MET  28  62.277 -10.771   7.936
  198   1HB   MET  28           HB2      MET  28  61.470  -9.464   5.617
  199   2HB   MET  28           HB1      MET  28  62.974 -10.254   5.144
  200   1HG   MET  28           HG2      MET  28  61.664 -12.180   6.670
  201   2HG   MET  28           HG1      MET  28  60.370 -11.435   5.731
  202   1HE   MET  28           HE2      MET  28  63.860 -12.710   5.793
  203   2HE   MET  28           HE1      MET  28  64.204 -13.401   4.210
  204   3HE   MET  28           HE3      MET  28  64.215 -11.647   4.434
  205    H    PHE  29           HN       PHE  29  64.517  -8.390   6.539
  206    HA   PHE  29           HA       PHE  29  66.718 -10.343   6.534
  207   1HB   PHE  29           HB2      PHE  29  67.208  -7.415   6.185
  208   2HB   PHE  29           HB1      PHE  29  67.917  -8.780   5.325
  209    HD1  PHE  29           HD1      PHE  29  65.869 -10.298   4.182
  210    HD2  PHE  29           HD2      PHE  29  65.915  -6.050   4.815
  211    HE1  PHE  29           HE1      PHE  29  64.213 -10.009   2.357
  212    HE2  PHE  29           HE2      PHE  29  64.260  -5.760   2.991
  213    HZ   PHE  29           HZ       PHE  29  63.409  -7.739   1.761
  214    H    ASP  30           HN       ASP  30  65.260  -8.326   8.818
  215    HA   ASP  30           HA       ASP  30  67.783  -8.225  10.424
  216   1HB   ASP  30           HB2      ASP  30  66.165  -6.116   9.743
  217   2HB   ASP  30           HB1      ASP  30  65.513  -6.568  11.319
  218    H    ALA  31           HN       ALA  31  67.306 -10.472  11.093
  219    HA   ALA  31           HA       ALA  31  64.869 -11.000  12.610
  220   1HB   ALA  31           HB2      ALA  31  66.411 -12.675  11.300
  221   2HB   ALA  31           HB1      ALA  31  67.345 -12.695  12.794
  222   3HB   ALA  31           HB3      ALA  31  65.655 -13.194  12.806
  223    H    ASP  32           HN       ASP  32  67.889  -9.547  13.282
  224    HA   ASP  32           HA       ASP  32  68.022 -10.269  16.100
  225   1HB   ASP  32           HB2      ASP  32  69.359  -8.015  14.570
  226   2HB   ASP  32           HB1      ASP  32  69.764  -8.513  16.214
  227    H    GLY  33           HN       GLY  33  66.138  -8.089  14.279
  228   1HA   GLY  33           HA2      GLY  33  64.505  -6.552  14.985
  229   2HA   GLY  33           HA1      GLY  33  64.798  -7.095  16.637
  230    H    GLY  34           HN       GLY  34  67.445  -5.942  14.674
  231   1HA   GLY  34           HA2      GLY  34  68.006  -3.846  16.631
  232   2HA   GLY  34           HA1      GLY  34  68.966  -4.205  15.194
  233    H    GLY  35           HN       GLY  35  66.196  -4.061  13.730
  234   1HA   GLY  35           HA2      GLY  35  64.806  -2.341  12.839
  235   2HA   GLY  35           HA1      GLY  35  65.667  -1.166  13.835
  236    H    ASP  36           HN       ASP  36  67.833  -3.196  12.229
  237    HA   ASP  36           HA       ASP  36  67.920  -1.760   9.694
  238   1HB   ASP  36           HB2      ASP  36  70.365  -0.982  10.299
  239   2HB   ASP  36           HB1      ASP  36  68.987   0.015  10.766
  240    H    ILE  37           HN       ILE  37  68.960  -3.039   8.209
  241    HA   ILE  37           HA       ILE  37  70.436  -5.393   9.294
  242    HB   ILE  37           HB       ILE  37  69.150  -6.613   7.900
  243   1HG1  ILE  37          HG12      ILE  37  71.080  -6.168   6.295
  244   2HG1  ILE  37          HG11      ILE  37  69.550  -6.611   5.533
  245   1HG2  ILE  37          HG21      ILE  37  67.476  -4.801   8.108
  246   2HG2  ILE  37          HG23      ILE  37  68.169  -4.014   6.688
  247   3HG2  ILE  37          HG22      ILE  37  67.395  -5.590   6.532
  248   1HD1  ILE  37          HD12      ILE  37  69.560  -3.778   5.901
  249   2HD1  ILE  37          HD11      ILE  37  71.086  -4.231   5.145
  250   3HD1  ILE  37          HD13      ILE  37  69.558  -4.679   4.385
  251    H    SER  38           HN       SER  38  72.458  -5.971   8.320
  252    HA   SER  38           HA       SER  38  74.111  -3.739   7.585
  253   1HB   SER  38           HB2      SER  38  74.685  -6.162   8.554
  254   2HB   SER  38           HB1      SER  38  74.921  -6.520   6.847
  255    HG   SER  38           HG       SER  38  76.301  -4.766   8.538
  256    H    THR  39           HN       THR  39  75.074  -3.294   5.504
  257    HA   THR  39           HA       THR  39  73.269  -3.584   3.291
  258    HB   THR  39           HB       THR  39  74.877  -2.399   2.008
  259    HG1  THR  39           HG1      THR  39  76.678  -3.527   3.853
  260   1HG2  THR  39          HG21      THR  39  74.478  -1.663   4.811
  261   2HG2  THR  39          HG23      THR  39  75.939  -0.956   4.122
  262   3HG2  THR  39          HG22      THR  39  74.376  -0.662   3.362
  263    H    LYS  40           HN       LYS  40  75.428  -5.780   4.656
  264    HA   LYS  40           HA       LYS  40  76.420  -7.111   2.314
  265   1HB   LYS  40           HB2      LYS  40  76.615  -7.458   5.105
  266   2HB   LYS  40           HB1      LYS  40  75.900  -8.949   4.491
  267   1HG   LYS  40           HG2      LYS  40  77.713  -9.072   2.785
  268   2HG   LYS  40           HG1      LYS  40  78.457  -7.649   3.515
  269   1HD   LYS  40           HD2      LYS  40  78.808  -8.812   5.601
  270   2HD   LYS  40           HD1      LYS  40  77.863 -10.194   5.046
  271   1HE   LYS  40           HE2      LYS  40  79.516 -10.668   3.305
  272   2HE   LYS  40           HE1      LYS  40  80.444  -9.241   3.770
  273   1HZ   LYS  40           HZ1      LYS  40  79.958 -10.825   6.044
  274   2HZ   LYS  40           HZ3      LYS  40  80.618 -11.807   4.828
  275   3HZ   LYS  40           HZ2      LYS  40  81.447 -10.413   5.336
  276    H    ALA  41           HN       ALA  41  73.467  -7.490   4.237
  277    HA   ALA  41           HA       ALA  41  72.514  -9.668   2.493
  278   1HB   ALA  41           HB2      ALA  41  71.696  -8.451   5.064
  279   2HB   ALA  41           HB1      ALA  41  70.370  -9.005   4.044
  280   3HB   ALA  41           HB3      ALA  41  71.628 -10.135   4.544
  281    H    LEU  42           HN       LEU  42  72.540  -6.297   2.401
  282    HA   LEU  42           HA       LEU  42  70.002  -5.546   1.491
  283   1HB   LEU  42           HB2      LEU  42  72.679  -4.484   1.341
  284   2HB   LEU  42           HB1      LEU  42  71.866  -4.241  -0.204
  285    HG   LEU  42           HG       LEU  42  71.332  -2.322   1.111
  286   1HD1  LEU  42          HD11      LEU  42  69.365  -4.063   0.208
  287   2HD1  LEU  42          HD13      LEU  42  68.851  -3.680   1.852
  288   3HD1  LEU  42          HD12      LEU  42  69.117  -2.383   0.686
  289   1HD2  LEU  42          HD22      LEU  42  71.323  -4.306   3.281
  290   2HD2  LEU  42          HD21      LEU  42  71.694  -2.582   3.334
  291   3HD2  LEU  42          HD23      LEU  42  70.017  -3.126   3.396
  292    H    GLY  43           HN       GLY  43  72.444  -7.454  -0.139
  293   1HA   GLY  43           HA2      GLY  43  71.380  -7.211  -2.802
  294   2HA   GLY  43           HA1      GLY  43  72.433  -8.510  -2.238
  295    H    THR  44           HN       THR  44  70.888  -9.636  -0.228
  296    HA   THR  44           HA       THR  44  69.054 -11.263  -1.725
  297    HB   THR  44           HB       THR  44  69.343 -10.860   1.267
  298    HG1  THR  44           HG1      THR  44  71.177 -11.754   0.516
  299   1HG2  THR  44          HG21      THR  44  67.229 -12.048  -0.063
  300   2HG2  THR  44          HG23      THR  44  68.291 -13.413   0.287
  301   3HG2  THR  44          HG22      THR  44  67.710 -12.389   1.600
  302    H    VAL  45           HN       VAL  45  68.660  -8.415   0.318
  303    HA   VAL  45           HA       VAL  45  65.862  -8.428   0.647
  304    HB   VAL  45           HB       VAL  45  67.731  -6.082   0.197
  305   1HG1  VAL  45          HG11      VAL  45  64.831  -6.275   0.974
  306   2HG1  VAL  45          HG13      VAL  45  65.822  -4.941   1.567
  307   3HG1  VAL  45          HG12      VAL  45  65.602  -5.172  -0.167
  308   1HG2  VAL  45          HG22      VAL  45  66.939  -7.761   2.532
  309   2HG2  VAL  45          HG21      VAL  45  68.483  -6.988   2.181
  310   3HG2  VAL  45          HG23      VAL  45  67.141  -6.033   2.812
  311    H    MET  46           HN       MET  46  67.760  -6.939  -1.996
  312    HA   MET  46           HA       MET  46  65.446  -6.159  -3.519
  313   1HB   MET  46           HB2      MET  46  68.206  -6.755  -4.620
  314   2HB   MET  46           HB1      MET  46  66.991  -5.666  -5.295
  315   1HG   MET  46           HG2      MET  46  67.163  -4.249  -3.260
  316   2HG   MET  46           HG1      MET  46  68.431  -5.313  -2.648
  317   1HE   MET  46           HE1      MET  46  67.448  -2.434  -4.028
  318   2HE   MET  46           HE3      MET  46  69.011  -1.868  -3.426
  319   3HE   MET  46           HE2      MET  46  68.635  -1.762  -5.144
  320    H    ARG  47           HN       ARG  47  66.996  -9.195  -3.055
  321    HA   ARG  47           HA       ARG  47  66.499 -10.489  -5.526
  322   1HB   ARG  47           HB2      ARG  47  67.719 -11.356  -3.401
  323   2HB   ARG  47           HB1      ARG  47  66.118 -11.886  -2.885
  324   1HG   ARG  47           HG2      ARG  47  65.968 -13.493  -4.523
  325   2HG   ARG  47           HG1      ARG  47  66.937 -12.566  -5.668
  326   1HD   ARG  47           HD2      ARG  47  68.963 -13.055  -4.308
  327   2HD   ARG  47           HD1      ARG  47  67.977 -14.050  -3.238
  328    HE   ARG  47           HE       ARG  47  68.802 -14.750  -5.979
  329   1HH1  ARG  47          HH11      ARG  47  65.806 -15.235  -5.270
  330   2HH1  ARG  47          HH12      ARG  47  65.873 -16.905  -4.820
  331   1HH2  ARG  47          HH21      ARG  47  69.327 -16.962  -4.524
  332   2HH2  ARG  47          HH22      ARG  47  67.865 -17.884  -4.398
  333    H    MET  48           HN       MET  48  64.415 -10.616  -2.603
  334    HA   MET  48           HA       MET  48  62.201 -11.755  -4.084
  335   1HB   MET  48           HB2      MET  48  60.908 -11.333  -2.016
  336   2HB   MET  48           HB1      MET  48  62.449 -12.113  -1.661
  337   1HG   MET  48           HG2      MET  48  63.440  -9.967  -1.055
  338   2HG   MET  48           HG1      MET  48  61.958  -9.126  -1.507
  339   1HE   MET  48           HE3      MET  48  63.798 -11.483   0.526
  340   2HE   MET  48           HE2      MET  48  63.025 -11.576   2.106
  341   3HE   MET  48           HE1      MET  48  62.446 -12.592   0.789
  342    H    LEU  49           HN       LEU  49  63.467  -8.631  -3.915
  343    HA   LEU  49           HA       LEU  49  60.994  -7.128  -4.085
  344   1HB   LEU  49           HB2      LEU  49  63.906  -6.566  -4.483
  345   2HB   LEU  49           HB1      LEU  49  62.738  -5.420  -5.136
  346    HG   LEU  49           HG       LEU  49  63.605  -5.064  -2.704
  347   1HD1  LEU  49          HD12      LEU  49  61.646  -3.941  -3.873
  348   2HD1  LEU  49          HD11      LEU  49  60.610  -5.145  -3.103
  349   3HD1  LEU  49          HD13      LEU  49  61.538  -4.018  -2.113
  350   1HD2  LEU  49          HD22      LEU  49  62.909  -7.594  -2.257
  351   2HD2  LEU  49          HD21      LEU  49  62.742  -6.377  -0.996
  352   3HD2  LEU  49          HD23      LEU  49  61.338  -6.866  -1.940
  353    H    GLY  50           HN       GLY  50  63.341  -8.363  -6.466
  354   1HA   GLY  50           HA2      GLY  50  62.222  -9.236  -8.578
  355   2HA   GLY  50           HA1      GLY  50  61.347  -7.704  -8.598
  356    H    GLN  51           HN       GLN  51  64.508  -7.294  -7.462
  357    HA   GLN  51           HA       GLN  51  65.358  -6.347 -10.169
  358   1HB   GLN  51           HB2      GLN  51  65.922  -5.305  -7.392
  359   2HB   GLN  51           HB1      GLN  51  66.939  -4.865  -8.765
  360   1HG   GLN  51           HG2      GLN  51  65.398  -3.159  -8.912
  361   2HG   GLN  51           HG1      GLN  51  64.551  -4.372  -9.873
  362   1HE2  GLN  51          HE22      GLN  51  62.077  -3.205  -7.388
  363   2HE2  GLN  51          HE21      GLN  51  62.863  -2.571  -8.753
  364    H    ASN  52           HN       ASN  52  67.749  -6.470 -10.543
  365    HA   ASN  52           HA       ASN  52  69.206  -8.430  -8.884
  366   1HB   ASN  52           HB2      ASN  52  69.064  -8.960 -11.841
  367   2HB   ASN  52           HB1      ASN  52  69.479 -10.069 -10.532
  368   1HD2  ASN  52          HD22      ASN  52  65.528  -9.372 -11.398
  369   2HD2  ASN  52          HD21      ASN  52  66.714  -8.310 -11.985
  370    HA   PRO  53           HA       PRO  53  71.764  -5.078 -10.789
  371   1HB   PRO  53           HB2      PRO  53  72.673  -4.074  -8.396
  372   2HB   PRO  53           HB1      PRO  53  71.196  -3.511  -9.197
  373   1HG   PRO  53           HG2      PRO  53  71.482  -5.261  -6.798
  374   2HG   PRO  53           HG1      PRO  53  70.149  -4.183  -7.248
  375   1HD   PRO  53           HD2      PRO  53  70.176  -6.996  -7.551
  376   2HD   PRO  53           HD1      PRO  53  69.015  -5.878  -8.297
  377    H    THR  54           HN       THR  54  74.089  -5.111 -10.924
  378    HA   THR  54           HA       THR  54  75.316  -7.636 -10.188
  379    HB   THR  54           HB       THR  54  76.103  -6.651 -12.209
  380    HG1  THR  54           HG1      THR  54  78.005  -7.232 -11.585
  381   1HG2  THR  54          HG23      THR  54  75.987  -4.176 -10.591
  382   2HG2  THR  54          HG22      THR  54  77.318  -4.265 -11.746
  383   3HG2  THR  54          HG21      THR  54  75.653  -4.419 -12.307
  384    H    LYS  55           HN       LYS  55  76.790  -8.032  -8.522
  385    HA   LYS  55           HA       LYS  55  76.616  -6.599  -6.115
  386   1HB   LYS  55           HB2      LYS  55  77.748  -8.922  -6.725
  387   2HB   LYS  55           HB1      LYS  55  79.210  -7.935  -6.803
  388   1HG   LYS  55           HG2      LYS  55  77.740  -7.179  -4.465
  389   2HG   LYS  55           HG1      LYS  55  77.895  -8.936  -4.478
  390   1HD   LYS  55           HD2      LYS  55  80.153  -6.929  -4.745
  391   2HD   LYS  55           HD1      LYS  55  79.836  -7.970  -3.357
  392   1HE   LYS  55           HE2      LYS  55  80.054  -9.942  -4.986
  393   2HE   LYS  55           HE1      LYS  55  80.739  -8.783  -6.123
  394   1HZ   LYS  55           HZ3      LYS  55  81.760  -9.191  -3.369
  395   2HZ   LYS  55           HZ2      LYS  55  82.403  -9.963  -4.737
  396   3HZ   LYS  55           HZ1      LYS  55  82.474  -8.272  -4.602
  397    H    GLU  56           HN       GLU  56  78.436  -5.857  -8.968
  398    HA   GLU  56           HA       GLU  56  80.447  -4.187  -7.768
  399   1HB   GLU  56           HB2      GLU  56  80.067  -5.121 -10.269
  400   2HB   GLU  56           HB1      GLU  56  79.415  -3.494 -10.473
  401   1HG   GLU  56           HG2      GLU  56  81.837  -3.559 -10.972
  402   2HG   GLU  56           HG1      GLU  56  81.495  -2.532  -9.581
  403    H    GLU  57           HN       GLU  57  77.725  -3.036  -9.781
  404    HA   GLU  57           HA       GLU  57  77.751  -0.377  -8.892
  405   1HB   GLU  57           HB2      GLU  57  76.152  -1.882 -10.579
  406   2HB   GLU  57           HB1      GLU  57  75.036  -1.408  -9.298
  407   1HG   GLU  57           HG2      GLU  57  74.922   0.382 -10.838
  408   2HG   GLU  57           HG1      GLU  57  76.023   0.968  -9.591
  409    H    LEU  58           HN       LEU  58  76.080  -3.170  -7.464
  410    HA   LEU  58           HA       LEU  58  74.568  -1.847  -5.494
  411   1HB   LEU  58           HB2      LEU  58  74.537  -4.318  -5.986
  412   2HB   LEU  58           HB1      LEU  58  76.055  -4.459  -5.099
  413    HG   LEU  58           HG       LEU  58  74.400  -2.985  -3.397
  414   1HD1  LEU  58          HD12      LEU  58  72.729  -4.307  -5.217
  415   2HD1  LEU  58          HD11      LEU  58  72.721  -5.328  -3.780
  416   3HD1  LEU  58          HD13      LEU  58  72.256  -3.631  -3.659
  417   1HD2  LEU  58          HD23      LEU  58  75.147  -5.920  -3.511
  418   2HD2  LEU  58          HD22      LEU  58  75.956  -4.640  -2.606
  419   3HD2  LEU  58          HD21      LEU  58  74.350  -5.186  -2.120
  420    H    ASP  59           HN       ASP  59  77.961  -2.956  -5.295
  421    HA   ASP  59           HA       ASP  59  78.467  -2.145  -2.633
  422   1HB   ASP  59           HB2      ASP  59  80.267  -2.267  -5.064
  423   2HB   ASP  59           HB1      ASP  59  80.871  -1.881  -3.452
  424    H    ALA  60           HN       ALA  60  78.797  -0.275  -5.660
  425    HA   ALA  60           HA       ALA  60  79.702   2.130  -4.373
  426   1HB   ALA  60           HB1      ALA  60  78.439   1.529  -7.045
  427   2HB   ALA  60           HB3      ALA  60  78.760   3.190  -6.551
  428   3HB   ALA  60           HB2      ALA  60  80.090   2.041  -6.699
  429    H    ILE  61           HN       ILE  61  76.584   0.660  -4.712
  430    HA   ILE  61           HA       ILE  61  75.055   3.105  -4.270
  431    HB   ILE  61           HB       ILE  61  74.361   0.161  -4.177
  432   1HG1  ILE  61          HG12      ILE  61  73.495   2.406  -6.025
  433   2HG1  ILE  61          HG11      ILE  61  74.779   1.253  -6.390
  434   1HG2  ILE  61          HG21      ILE  61  72.679   2.589  -3.538
  435   2HG2  ILE  61          HG23      ILE  61  71.960   1.080  -4.101
  436   3HG2  ILE  61          HG22      ILE  61  72.870   1.113  -2.592
  437   1HD1  ILE  61          HD13      ILE  61  72.880  -0.511  -5.776
  438   2HD1  ILE  61          HD12      ILE  61  71.824   0.818  -6.248
  439   3HD1  ILE  61          HD11      ILE  61  72.997   0.174  -7.395
  440    H    ILE  62           HN       ILE  62  76.272   0.450  -2.268
  441    HA   ILE  62           HA       ILE  62  74.918   1.090   0.144
  442    HB   ILE  62           HB       ILE  62  77.644  -0.135  -0.356
  443   1HG1  ILE  62          HG12      ILE  62  74.983  -1.340   0.467
  444   2HG1  ILE  62          HG11      ILE  62  75.644  -1.381  -1.167
  445   1HG2  ILE  62          HG22      ILE  62  76.113   0.351   2.195
  446   2HG2  ILE  62          HG21      ILE  62  77.237  -1.000   2.054
  447   3HG2  ILE  62          HG23      ILE  62  77.818   0.653   1.859
  448   1HD1  ILE  62          HD11      ILE  62  77.627  -2.291   0.729
  449   2HD1  ILE  62          HD13      ILE  62  76.142  -3.224   0.908
  450   3HD1  ILE  62          HD12      ILE  62  76.949  -3.142  -0.659
  451    H    GLU  63           HN       GLU  63  77.741   2.529  -1.381
  452    HA   GLU  63           HA       GLU  63  78.658   4.011   0.907
  453   1HB   GLU  63           HB2      GLU  63  79.897   3.537  -1.300
  454   2HB   GLU  63           HB1      GLU  63  78.986   4.898  -1.958
  455   1HG   GLU  63           HG2      GLU  63  80.184   6.434  -0.781
  456   2HG   GLU  63           HG1      GLU  63  80.260   5.414   0.656
  457    H    GLU  64           HN       GLU  64  76.592   4.958  -1.860
  458    HA   GLU  64           HA       GLU  64  76.132   7.624  -0.850
  459   1HB   GLU  64           HB2      GLU  64  74.443   6.038  -2.802
  460   2HB   GLU  64           HB1      GLU  64  74.459   7.792  -2.607
  461   1HG   GLU  64           HG2      GLU  64  76.840   7.837  -3.276
  462   2HG   GLU  64           HG1      GLU  64  76.806   6.087  -3.496
  463    H    VAL  65           HN       VAL  65  74.749   4.553  -0.061
  464    HA   VAL  65           HA       VAL  65  72.270   5.759   0.992
  465    HB   VAL  65           HB       VAL  65  73.217   2.913   1.380
  466   1HG1  VAL  65          HG12      VAL  65  70.941   4.389   2.205
  467   2HG1  VAL  65          HG11      VAL  65  70.401   3.301   0.925
  468   3HG1  VAL  65          HG13      VAL  65  71.206   2.652   2.355
  469   1HG2  VAL  65          HG22      VAL  65  72.994   4.035  -1.086
  470   2HG2  VAL  65          HG21      VAL  65  72.601   2.348  -0.751
  471   3HG2  VAL  65          HG23      VAL  65  71.320   3.558  -0.807
  472    H    ASP  66           HN       ASP  66  75.337   4.491   2.199
  473    HA   ASP  66           HA       ASP  66  74.450   4.897   4.994
  474   1HB   ASP  66           HB2      ASP  66  76.439   3.273   3.665
  475   2HB   ASP  66           HB1      ASP  66  77.194   4.238   4.935
  476    H    GLU  67           HN       GLU  67  74.337   7.318   3.998
  477    HA   GLU  67           HA       GLU  67  76.817   8.768   3.822
  478   1HB   GLU  67           HB2      GLU  67  73.937   9.548   4.228
  479   2HB   GLU  67           HB1      GLU  67  75.213  10.756   4.376
  480   1HG   GLU  67           HG2      GLU  67  75.084   8.934   1.978
  481   2HG   GLU  67           HG1      GLU  67  74.129  10.416   2.042
  482    H    ASP  68           HN       ASP  68  74.902   7.645   6.491
  483    HA   ASP  68           HA       ASP  68  76.101   9.508   8.418
  484   1HB   ASP  68           HB2      ASP  68  74.857   8.189  10.096
  485   2HB   ASP  68           HB1      ASP  68  73.806   8.675   8.766
  486    H    GLY  69           HN       GLY  69  77.419   7.059   6.761
  487   1HA   GLY  69           HA2      GLY  69  79.099   5.460   7.195
  488   2HA   GLY  69           HA1      GLY  69  79.740   6.739   8.228
  489    H    SER  70           HN       SER  70  76.657   5.096   8.756
  490    HA   SER  70           HA       SER  70  77.445   4.454  11.491
  491   1HB   SER  70           HB2      SER  70  75.197   3.655  11.757
  492   2HB   SER  70           HB1      SER  70  75.099   5.091  10.742
  493    HG   SER  70           HG       SER  70  75.215   3.563   8.932
  494    H    GLY  71           HN       GLY  71  77.411   2.805   8.426
  495   1HA   GLY  71           HA2      GLY  71  78.632   0.782   7.999
  496   2HA   GLY  71           HA1      GLY  71  78.636   0.448   9.731
  497    H    THR  72           HN       THR  72  75.571   1.435   8.783
  498    HA   THR  72           HA       THR  72  74.653  -1.246   7.957
  499    HB   THR  72           HB       THR  72  72.842  -0.635   9.975
  500    HG1  THR  72           HG1      THR  72  74.545  -0.530  11.740
  501   1HG2  THR  72          HG22      THR  72  74.814  -2.648   9.330
  502   2HG2  THR  72          HG21      THR  72  74.739  -2.402  11.074
  503   3HG2  THR  72          HG23      THR  72  73.280  -2.831  10.180
  504    H    ILE  73           HN       ILE  73  72.199  -1.151   7.551
  505    HA   ILE  73           HA       ILE  73  71.497   1.587   6.570
  506    HB   ILE  73           HB       ILE  73  70.585  -1.095   5.488
  507   1HG1  ILE  73          HG12      ILE  73  73.051  -0.402   5.158
  508   2HG1  ILE  73          HG11      ILE  73  72.130  -0.799   3.707
  509   1HG2  ILE  73          HG23      ILE  73  68.971   0.778   5.209
  510   2HG2  ILE  73          HG22      ILE  73  70.229   1.715   4.404
  511   3HG2  ILE  73          HG21      ILE  73  69.628   0.230   3.667
  512   1HD1  ILE  73          HD11      ILE  73  71.825   2.007   4.401
  513   2HD1  ILE  73          HD13      ILE  73  73.524   1.583   4.196
  514   3HD1  ILE  73          HD12      ILE  73  72.379   1.287   2.888
  515    H    ASP  74           HN       ASP  74  69.517   2.413   7.181
  516    HA   ASP  74           HA       ASP  74  67.909   0.729   9.049
  517   1HB   ASP  74           HB2      ASP  74  67.561   3.701   8.755
  518   2HB   ASP  74           HB1      ASP  74  67.284   2.684  10.170
  519    H    PHE  75           HN       PHE  75  65.479   1.229   8.937
  520    HA   PHE  75           HA       PHE  75  64.432   0.597   6.409
  521   1HB   PHE  75           HB2      PHE  75  63.276   0.558   8.717
  522   2HB   PHE  75           HB1      PHE  75  62.900   2.254   8.412
  523    HD1  PHE  75           HD2      PHE  75  63.054  -0.715   6.141
  524    HD2  PHE  75           HD1      PHE  75  60.638   2.411   7.824
  525    HE1  PHE  75           HE2      PHE  75  61.159  -1.397   4.688
  526    HE2  PHE  75           HE1      PHE  75  58.744   1.731   6.375
  527    HZ   PHE  75           HZ       PHE  75  59.004  -0.172   4.806
  528    H    GLU  76           HN       GLU  76  65.362   3.709   7.701
  529    HA   GLU  76           HA       GLU  76  63.897   5.264   5.723
  530   1HB   GLU  76           HB2      GLU  76  66.052   5.883   7.737
  531   2HB   GLU  76           HB1      GLU  76  65.566   7.083   6.538
  532   1HG   GLU  76           HG2      GLU  76  63.330   7.138   7.343
  533   2HG   GLU  76           HG1      GLU  76  63.549   5.660   8.280
  534    H    GLU  77           HN       GLU  77  67.166   3.935   5.979
  535    HA   GLU  77           HA       GLU  77  68.035   5.315   3.535
  536   1HB   GLU  77           HB2      GLU  77  69.336   3.275   5.351
  537   2HB   GLU  77           HB1      GLU  77  70.102   3.857   3.873
  538   1HG   GLU  77           HG2      GLU  77  70.138   6.117   4.677
  539   2HG   GLU  77           HG1      GLU  77  69.095   5.713   6.042
  540    H    PHE  78           HN       PHE  78  66.475   2.348   4.346
  541    HA   PHE  78           HA       PHE  78  67.385   0.780   2.111
  542   1HB   PHE  78           HB2      PHE  78  66.398  -0.617   3.641
  543   2HB   PHE  78           HB1      PHE  78  65.252   0.609   4.174
  544    HD1  PHE  78           HD2      PHE  78  63.191   1.037   2.903
  545    HD2  PHE  78           HD1      PHE  78  65.872  -2.133   1.830
  546    HE1  PHE  78           HE2      PHE  78  61.414   0.015   1.498
  547    HE2  PHE  78           HE1      PHE  78  64.103  -3.159   0.423
  548    HZ   PHE  78           HZ       PHE  78  61.873  -2.084   0.259
  549    H    LEU  79           HN       LEU  79  64.474   2.785   2.652
  550    HA   LEU  79           HA       LEU  79  63.245   2.410   0.143
  551   1HB   LEU  79           HB2      LEU  79  63.379   4.995   1.728
  552   2HB   LEU  79           HB1      LEU  79  62.168   4.580   0.515
  553    HG   LEU  79           HG       LEU  79  62.617   2.804   2.906
  554   1HD1  LEU  79          HD13      LEU  79  61.476   5.505   2.854
  555   2HD1  LEU  79          HD12      LEU  79  60.358   4.294   3.484
  556   3HD1  LEU  79          HD11      LEU  79  61.939   4.508   4.233
  557   1HD2  LEU  79          HD22      LEU  79  61.169   2.382   0.699
  558   2HD2  LEU  79          HD21      LEU  79  60.612   1.837   2.281
  559   3HD2  LEU  79          HD23      LEU  79  59.985   3.334   1.593
  560    H    VAL  80           HN       VAL  80  66.062   4.288   1.032
  561    HA   VAL  80           HA       VAL  80  66.193   5.877  -1.373
  562    HB   VAL  80           HB       VAL  80  68.255   5.070   0.692
  563   1HG1  VAL  80          HG12      VAL  80  68.623   6.219  -1.980
  564   2HG1  VAL  80          HG11      VAL  80  69.286   7.236  -0.700
  565   3HG1  VAL  80          HG13      VAL  80  69.824   5.562  -0.866
  566   1HG2  VAL  80          HG21      VAL  80  66.734   7.606   0.036
  567   2HG2  VAL  80          HG23      VAL  80  66.662   6.663   1.524
  568   3HG2  VAL  80          HG22      VAL  80  68.118   7.575   1.128
  569    H    MET  81           HN       MET  81  67.574   2.742  -0.417
  570    HA   MET  81           HA       MET  81  69.176   2.366  -2.761
  571   1HB   MET  81           HB2      MET  81  67.875   0.374  -0.882
  572   2HB   MET  81           HB1      MET  81  69.010  -0.078  -2.155
  573   1HG   MET  81           HG2      MET  81  70.331   1.983  -0.888
  574   2HG   MET  81           HG1      MET  81  69.527   1.168   0.453
  575   1HE   MET  81           HE3      MET  81  72.003   1.343   0.914
  576   2HE   MET  81           HE2      MET  81  71.761  -0.224   1.682
  577   3HE   MET  81           HE1      MET  81  73.144   0.026   0.619
  578    H    MET  82           HN       MET  82  65.771   1.792  -2.084
  579    HA   MET  82           HA       MET  82  65.269   0.228  -4.467
  580   1HB   MET  82           HB2      MET  82  63.148   1.895  -3.142
  581   2HB   MET  82           HB1      MET  82  63.017   0.285  -3.848
  582   1HG   MET  82           HG2      MET  82  64.317   1.052  -1.223
  583   2HG   MET  82           HG1      MET  82  62.940  -0.019  -1.474
  584   1HE   MET  82           HE2      MET  82  63.710  -1.572  -4.000
  585   2HE   MET  82           HE1      MET  82  64.463  -3.027  -3.350
  586   3HE   MET  82           HE3      MET  82  63.029  -2.343  -2.570
  587    H    VAL  83           HN       VAL  83  63.949   3.476  -3.742
  588    HA   VAL  83           HA       VAL  83  63.396   4.148  -6.428
  589    HB   VAL  83           HB       VAL  83  64.204   6.066  -4.220
  590   1HG1  VAL  83          HG12      VAL  83  64.044   6.898  -6.635
  591   2HG1  VAL  83          HG11      VAL  83  62.326   6.514  -6.550
  592   3HG1  VAL  83          HG13      VAL  83  63.013   7.722  -5.465
  593   1HG2  VAL  83          HG23      VAL  83  62.291   4.315  -3.817
  594   2HG2  VAL  83          HG22      VAL  83  61.993   6.012  -3.438
  595   3HG2  VAL  83          HG21      VAL  83  61.377   5.323  -4.940
  596    H    ARG  84           HN       ARG  84  66.427   4.042  -4.752
  597    HA   ARG  84           HA       ARG  84  67.889   5.879  -6.414
  598   1HB   ARG  84           HB2      ARG  84  68.890   5.238  -4.337
  599   2HB   ARG  84           HB1      ARG  84  68.728   3.521  -4.710
  600   1HG   ARG  84           HG2      ARG  84  70.362   3.697  -6.493
  601   2HG   ARG  84           HG1      ARG  84  70.438   5.448  -6.304
  602   1HD   ARG  84           HD2      ARG  84  71.024   3.683  -3.945
  603   2HD   ARG  84           HD1      ARG  84  72.270   3.945  -5.165
  604    HE   ARG  84           HE       ARG  84  71.619   5.810  -3.148
  605   1HH1  ARG  84          HH21      ARG  84  72.583   5.503  -6.413
  606   2HH1  ARG  84          HH22      ARG  84  72.775   7.205  -6.671
  607   1HH2  ARG  84          HH11      ARG  84  71.579   8.082  -3.535
  608   2HH2  ARG  84          HH12      ARG  84  72.205   8.666  -5.041
  609    H    GLN  85           HN       GLN  85  67.248   2.389  -6.618
  610    HA   GLN  85           HA       GLN  85  68.883   2.044  -9.003
  611   1HB   GLN  85           HB2      GLN  85  67.495   0.358  -7.166
  612   2HB   GLN  85           HB1      GLN  85  66.889  -0.001  -8.784
  613   1HG   GLN  85           HG2      GLN  85  69.586   0.217  -9.243
  614   2HG   GLN  85           HG1      GLN  85  69.555  -0.489  -7.625
  615   1HE2  GLN  85          HE22      GLN  85  67.727  -2.631 -10.636
  616   2HE2  GLN  85          HE21      GLN  85  67.677  -0.934 -10.690
  617    H    MET  86           HN       MET  86  65.425   2.522  -8.342
  618    HA   MET  86           HA       MET  86  64.825   2.426 -11.236
  619   1HB   MET  86           HB2      MET  86  63.035   2.919  -8.835
  620   2HB   MET  86           HB1      MET  86  62.476   2.753 -10.501
  621   1HG   MET  86           HG2      MET  86  63.550   0.481 -10.563
  622   2HG   MET  86           HG1      MET  86  63.894   0.651  -8.842
  623   1HE   MET  86           HE2      MET  86  62.426   0.923  -7.085
  624   2HE   MET  86           HE1      MET  86  61.233   2.107  -7.614
  625   3HE   MET  86           HE3      MET  86  60.711   0.528  -7.008
  626    H    LYS  87           HN       LYS  87  66.552   4.561 -10.174
  627    HA   LYS  87           HA       LYS  87  64.787   6.921 -10.684
  628   1HB   LYS  87           HB2      LYS  87  66.775   6.409  -8.667
  629   2HB   LYS  87           HB1      LYS  87  67.294   7.769  -9.663
  630   1HG   LYS  87           HG2      LYS  87  64.467   7.979  -9.111
  631   2HG   LYS  87           HG1      LYS  87  65.365   7.808  -7.602
  632   1HD   LYS  87           HD2      LYS  87  66.616   9.749  -7.970
  633   2HD   LYS  87           HD1      LYS  87  66.349   9.707  -9.712
  634   1HE   LYS  87           HE2      LYS  87  64.026  10.348  -9.430
  635   2HE   LYS  87           HE1      LYS  87  64.164  10.227  -7.677
  636   1HZ   LYS  87           HZ2      LYS  87  65.676  12.116  -9.400
  637   2HZ   LYS  87           HZ1      LYS  87  64.341  12.519  -8.430
  638   3HZ   LYS  87           HZ3      LYS  87  65.788  12.008  -7.708
  639    H    GLU  88           HN       GLU  88  67.962   5.479 -11.382
  640    HA   GLU  88           HA       GLU  88  68.254   7.391 -13.653
  641   1HB   GLU  88           HB2      GLU  88  70.632   6.385 -13.688
  642   2HB   GLU  88           HB1      GLU  88  70.222   7.434 -12.331
  643   1HG   GLU  88           HG2      GLU  88  69.855   5.569 -10.878
  644   2HG   GLU  88           HG1      GLU  88  69.898   4.428 -12.222
  645    H    ASP  89           HN       ASP  89  66.365   5.319 -13.953
  646    HA   ASP  89           HA       ASP  89  65.773   3.702 -15.550
  647   1HB   ASP  89           HB2      ASP  89  67.998   5.142 -16.688
  648   2HB   ASP  89           HB1      ASP  89  68.114   3.436 -17.119
  649    H    ALA  90           HN       ALA  90  66.210   2.405 -13.423
  650    HA   ALA  90           HA       ALA  90  67.053   0.454 -12.426
  651   1HB   ALA  90           HB3      ALA  90  67.710  -0.117 -15.331
  652   2HB   ALA  90           HB2      ALA  90  67.791  -1.312 -14.036
  653   3HB   ALA  90           HB1      ALA  90  66.241  -0.591 -14.475
   
  No H/Q in entry =         653
  Start of MODEL   20
    1   1H    ALA   1           HT3      ALA   1  63.175  14.749  13.993
    2   2H    ALA   1           HT2      ALA   1  63.218  15.198  15.631
    3   3H    ALA   1           HT1      ALA   1  61.908  15.665  14.653
    4    HA   ALA   1           HA       ALA   1  63.161  17.593  14.774
    5   1HB   ALA   1           HB1      ALA   1  65.107  16.376  15.844
    6   2HB   ALA   1           HB3      ALA   1  65.639  15.944  14.220
    7   3HB   ALA   1           HB2      ALA   1  65.567  17.637  14.702
    8    H    SER   2           HN       SER   2  65.356  17.929  12.820
    9    HA   SER   2           HA       SER   2  63.755  18.210  10.444
   10   1HB   SER   2           HB2      SER   2  66.779  18.235  10.624
   11   2HB   SER   2           HB1      SER   2  65.781  18.993   9.387
   12    HG   SER   2           HG       SER   2  66.180  20.609  10.775
   13    H    MET   3           HN       MET   3  65.879  17.281   8.574
   14    HA   MET   3           HA       MET   3  66.338  14.478   8.869
   15   1HB   MET   3           HB2      MET   3  64.587  13.897   6.974
   16   2HB   MET   3           HB1      MET   3  64.082  13.935   8.665
   17   1HG   MET   3           HG2      MET   3  63.146  16.126   8.433
   18   2HG   MET   3           HG1      MET   3  63.900  16.352   6.854
   19   1HE   MET   3           HE1      MET   3  62.395  16.899   5.450
   20   2HE   MET   3           HE3      MET   3  62.703  15.441   4.496
   21   3HE   MET   3           HE2      MET   3  61.049  15.973   4.791
   22    H    THR   4           HN       THR   4  67.442  13.625   7.019
   23    HA   THR   4           HA       THR   4  68.792  15.589   5.409
   24    HB   THR   4           HB       THR   4  69.763  13.646   4.241
   25    HG1  THR   4           HG1      THR   4  68.185  11.980   5.857
   26   1HG2  THR   4          HG21      THR   4  69.897  14.201   7.011
   27   2HG2  THR   4          HG23      THR   4  69.875  12.445   6.856
   28   3HG2  THR   4          HG22      THR   4  71.109  13.388   6.022
   29    H    ASP   5           HN       ASP   5  68.587  15.950   3.125
   30    HA   ASP   5           HA       ASP   5  65.868  15.967   2.161
   31   1HB   ASP   5           HB2      ASP   5  68.446  16.380   0.615
   32   2HB   ASP   5           HB1      ASP   5  66.831  16.852   0.086
   33    H    GLN   6           HN       GLN   6  68.439  13.657   2.004
   34    HA   GLN   6           HA       GLN   6  67.730  12.272  -0.383
   35   1HB   GLN   6           HB2      GLN   6  69.153  11.532   2.151
   36   2HB   GLN   6           HB1      GLN   6  68.692  10.251   1.029
   37   1HG   GLN   6           HG2      GLN   6  69.996  12.655  -0.148
   38   2HG   GLN   6           HG1      GLN   6  71.021  11.581   0.806
   39   1HE2  GLN   6          HE22      GLN   6  70.938   8.945  -1.570
   40   2HE2  GLN   6          HE21      GLN   6  71.383   9.405   0.002
   41    H    GLN   7           HN       GLN   7  66.572  11.897   2.968
   42    HA   GLN   7           HA       GLN   7  64.764   9.725   2.256
   43   1HB   GLN   7           HB2      GLN   7  64.597  11.460   4.727
   44   2HB   GLN   7           HB1      GLN   7  64.063   9.790   4.533
   45   1HG   GLN   7           HG2      GLN   7  66.411   9.082   4.205
   46   2HG   GLN   7           HG1      GLN   7  66.939  10.751   4.432
   47   1HE2  GLN   7          HE22      GLN   7  67.060   8.846   7.713
   48   2HE2  GLN   7          HE21      GLN   7  67.681   8.498   6.171
   49    H    ALA   8           HN       ALA   8  64.649  13.170   2.138
   50    HA   ALA   8           HA       ALA   8  61.781  13.473   2.349
   51   1HB   ALA   8           HB1      ALA   8  63.981  15.192   2.162
   52   2HB   ALA   8           HB3      ALA   8  63.076  15.473   0.675
   53   3HB   ALA   8           HB2      ALA   8  62.285  15.671   2.239
   54    H    GLU   9           HN       GLU   9  64.025  12.924  -0.337
   55    HA   GLU   9           HA       GLU   9  61.856  13.117  -2.314
   56   1HB   GLU   9           HB2      GLU   9  64.684  13.301  -2.381
   57   2HB   GLU   9           HB1      GLU   9  64.248  11.899  -3.358
   58   1HG   GLU   9           HG2      GLU   9  63.969  13.509  -4.971
   59   2HG   GLU   9           HG1      GLU   9  62.371  13.624  -4.230
   60    H    ALA  10           HN       ALA  10  63.545  10.648  -0.500
   61    HA   ALA  10           HA       ALA  10  62.860   8.400  -2.140
   62   1HB   ALA  10           HB3      ALA  10  64.524   8.459  -0.201
   63   2HB   ALA  10           HB2      ALA  10  63.129   8.352   0.874
   64   3HB   ALA  10           HB1      ALA  10  63.468   7.047  -0.265
   65    H    ARG  11           HN       ARG  11  61.316   9.540   0.892
   66    HA   ARG  11           HA       ARG  11  59.018   7.829   0.570
   67   1HB   ARG  11           HB2      ARG  11  59.998   9.714   2.501
   68   2HB   ARG  11           HB1      ARG  11  58.315  10.095   2.139
   69   1HG   ARG  11           HG2      ARG  11  57.539   8.069   2.935
   70   2HG   ARG  11           HG1      ARG  11  59.041   7.226   2.557
   71   1HD   ARG  11           HD2      ARG  11  59.051   7.378   4.917
   72   2HD   ARG  11           HD1      ARG  11  60.104   8.695   4.398
   73    HE   ARG  11           HE       ARG  11  57.654   9.018   5.847
   74   1HH1  ARG  11          HH11      ARG  11  56.337  10.370   3.866
   75   2HH1  ARG  11          HH12      ARG  11  57.074  11.931   3.729
   76   1HH2  ARG  11          HH21      ARG  11  59.970  11.004   5.397
   77   2HH2  ARG  11          HH22      ARG  11  59.130  12.291   4.596
   78    H    ALA  12           HN       ALA  12  59.878  10.963  -0.676
   79    HA   ALA  12           HA       ALA  12  57.218  11.896  -1.258
   80   1HB   ALA  12           HB3      ALA  12  59.917  12.544  -2.467
   81   2HB   ALA  12           HB2      ALA  12  58.429  13.362  -2.941
   82   3HB   ALA  12           HB1      ALA  12  59.015  13.491  -1.282
   83    H    PHE  13           HN       PHE  13  59.526   9.863  -3.012
   84    HA   PHE  13           HA       PHE  13  57.787   9.763  -5.384
   85   1HB   PHE  13           HB2      PHE  13  60.316   9.690  -5.496
   86   2HB   PHE  13           HB1      PHE  13  60.232   8.079  -4.780
   87    HD1  PHE  13           HD2      PHE  13  58.779   6.316  -5.956
   88    HD2  PHE  13           HD1      PHE  13  60.003   9.990  -7.813
   89    HE1  PHE  13           HE2      PHE  13  58.304   5.346  -8.189
   90    HE2  PHE  13           HE1      PHE  13  59.528   9.021 -10.045
   91    HZ   PHE  13           HZ       PHE  13  58.679   6.698 -10.235
   92    H    LEU  14           HN       LEU  14  58.552   7.775  -2.575
   93    HA   LEU  14           HA       LEU  14  56.901   5.554  -3.630
   94   1HB   LEU  14           HB2      LEU  14  58.294   5.768  -0.946
   95   2HB   LEU  14           HB1      LEU  14  57.670   4.304  -1.708
   96    HG   LEU  14           HG       LEU  14  59.819   6.031  -2.961
   97   1HD1  LEU  14          HD12      LEU  14  59.987   3.728  -1.029
   98   2HD1  LEU  14          HD11      LEU  14  61.262   3.983  -2.221
   99   3HD1  LEU  14          HD13      LEU  14  60.900   5.238  -1.035
  100   1HD2  LEU  14          HD21      LEU  14  58.408   3.494  -3.621
  101   2HD2  LEU  14          HD23      LEU  14  59.070   4.724  -4.698
  102   3HD2  LEU  14          HD22      LEU  14  60.140   3.539  -3.950
  103    H    SER  15           HN       SER  15  54.802   5.251  -3.017
  104    HA   SER  15           HA       SER  15  53.572   7.249  -1.244
  105   1HB   SER  15           HB2      SER  15  52.606   6.151  -3.451
  106   2HB   SER  15           HB1      SER  15  52.083   4.887  -2.342
  107    HG   SER  15           HG       SER  15  50.709   6.898  -2.781
  108    H    GLU  16           HN       GLU  16  52.240   6.588   0.614
  109    HA   GLU  16           HA       GLU  16  53.566   4.931   2.459
  110   1HB   GLU  16           HB2      GLU  16  50.632   5.677   2.288
  111   2HB   GLU  16           HB1      GLU  16  51.364   4.885   3.684
  112   1HG   GLU  16           HG2      GLU  16  51.973   6.912   4.449
  113   2HG   GLU  16           HG1      GLU  16  53.048   7.064   3.058
  114    H    GLU  17           HN       GLU  17  51.442   4.067  -0.151
  115    HA   GLU  17           HA       GLU  17  50.658   1.473   0.835
  116   1HB   GLU  17           HB2      GLU  17  50.345   3.023  -1.595
  117   2HB   GLU  17           HB1      GLU  17  50.744   1.347  -1.975
  118   1HG   GLU  17           HG2      GLU  17  48.543   2.209  -0.076
  119   2HG   GLU  17           HG1      GLU  17  48.289   1.701  -1.746
  120    H    MET  18           HN       MET  18  53.285   2.552  -1.332
  121    HA   MET  18           HA       MET  18  54.367  -0.108  -1.676
  122   1HB   MET  18           HB2      MET  18  55.900   2.483  -1.962
  123   2HB   MET  18           HB1      MET  18  56.182   0.958  -2.803
  124   1HG   MET  18           HG2      MET  18  53.457   1.910  -3.196
  125   2HG   MET  18           HG1      MET  18  54.646   3.095  -3.738
  126   1HE   MET  18           HE2      MET  18  53.191   2.539  -5.982
  127   2HE   MET  18           HE1      MET  18  54.835   3.148  -6.164
  128   3HE   MET  18           HE3      MET  18  54.256   1.832  -7.195
  129    H    ILE  19           HN       ILE  19  55.477   2.697   0.262
  130    HA   ILE  19           HA       ILE  19  57.648   1.479   1.550
  131    HB   ILE  19           HB       ILE  19  55.651   3.510   2.575
  132   1HG1  ILE  19          HG12      ILE  19  58.393   4.370   2.217
  133   2HG1  ILE  19          HG11      ILE  19  57.786   3.630   0.736
  134   1HG2  ILE  19          HG21      ILE  19  58.174   2.422   3.841
  135   2HG2  ILE  19          HG23      ILE  19  57.492   3.988   4.281
  136   3HG2  ILE  19          HG22      ILE  19  56.562   2.512   4.549
  137   1HD1  ILE  19          HD11      ILE  19  55.786   5.355   1.956
  138   2HD1  ILE  19          HD13      ILE  19  57.274   6.236   1.610
  139   3HD1  ILE  19          HD12      ILE  19  56.433   5.383   0.316
  140    H    ALA  20           HN       ALA  20  54.203   1.101   2.177
  141    HA   ALA  20           HA       ALA  20  54.420  -0.209   4.711
  142   1HB   ALA  20           HB3      ALA  20  52.306   0.688   3.552
  143   2HB   ALA  20           HB2      ALA  20  52.307  -0.823   2.642
  144   3HB   ALA  20           HB1      ALA  20  52.152  -0.853   4.399
  145    H    GLU  21           HN       GLU  21  54.444  -1.458   1.378
  146    HA   GLU  21           HA       GLU  21  54.569  -4.235   2.168
  147   1HB   GLU  21           HB2      GLU  21  54.986  -2.702  -0.369
  148   2HB   GLU  21           HB1      GLU  21  55.594  -4.355  -0.282
  149   1HG   GLU  21           HG2      GLU  21  53.513  -5.122  -0.651
  150   2HG   GLU  21           HG1      GLU  21  52.984  -4.360   0.851
  151    H    PHE  22           HN       PHE  22  56.998  -1.751   1.506
  152    HA   PHE  22           HA       PHE  22  59.263  -3.511   1.448
  153   1HB   PHE  22           HB2      PHE  22  59.080  -0.589   2.243
  154   2HB   PHE  22           HB1      PHE  22  60.583  -1.456   1.923
  155    HD1  PHE  22           HD1      PHE  22  59.606  -3.201  -0.354
  156    HD2  PHE  22           HD2      PHE  22  59.099   0.989   0.448
  157    HE1  PHE  22           HE1      PHE  22  59.342  -2.768  -2.780
  158    HE2  PHE  22           HE2      PHE  22  58.835   1.422  -1.979
  159    HZ   PHE  22           HZ       PHE  22  58.956  -0.459  -3.594
  160    H    LYS  23           HN       LYS  23  57.470  -2.000   4.075
  161    HA   LYS  23           HA       LYS  23  59.346  -2.373   6.169
  162   1HB   LYS  23           HB2      LYS  23  57.286  -1.079   6.476
  163   2HB   LYS  23           HB1      LYS  23  56.319  -2.540   6.260
  164   1HG   LYS  23           HG2      LYS  23  56.615  -1.990   8.658
  165   2HG   LYS  23           HG1      LYS  23  57.352  -3.539   8.251
  166   1HD   LYS  23           HD2      LYS  23  59.513  -2.724   8.447
  167   2HD   LYS  23           HD1      LYS  23  59.035  -1.070   8.060
  168   1HE   LYS  23           HE2      LYS  23  58.129  -2.424  10.602
  169   2HE   LYS  23           HE1      LYS  23  59.662  -1.557  10.510
  170   1HZ   LYS  23           HZ3      LYS  23  57.096  -0.335   9.680
  171   2HZ   LYS  23           HZ2      LYS  23  57.675  -0.239  11.276
  172   3HZ   LYS  23           HZ1      LYS  23  58.571   0.441  10.003
  173    H    ALA  24           HN       ALA  24  57.638  -4.688   4.309
  174    HA   ALA  24           HA       ALA  24  57.671  -6.781   6.361
  175   1HB   ALA  24           HB2      ALA  24  56.197  -6.420   4.090
  176   2HB   ALA  24           HB1      ALA  24  57.407  -7.571   3.524
  177   3HB   ALA  24           HB3      ALA  24  56.385  -7.973   4.904
  178    H    ALA  25           HN       ALA  25  59.594  -5.893   3.512
  179    HA   ALA  25           HA       ALA  25  61.319  -8.227   3.718
  180   1HB   ALA  25           HB1      ALA  25  60.905  -6.117   1.856
  181   2HB   ALA  25           HB3      ALA  25  62.599  -6.051   2.343
  182   3HB   ALA  25           HB2      ALA  25  61.934  -7.538   1.666
  183    H    PHE  26           HN       PHE  26  61.401  -4.907   4.919
  184    HA   PHE  26           HA       PHE  26  64.116  -4.803   5.723
  185   1HB   PHE  26           HB2      PHE  26  62.684  -2.826   5.739
  186   2HB   PHE  26           HB1      PHE  26  61.658  -3.548   6.979
  187    HD1  PHE  26           HD2      PHE  26  62.657  -4.090   9.236
  188    HD2  PHE  26           HD1      PHE  26  64.681  -1.694   6.310
  189    HE1  PHE  26           HE2      PHE  26  64.157  -3.203  11.005
  190    HE2  PHE  26           HE1      PHE  26  66.185  -0.803   8.074
  191    HZ   PHE  26           HZ       PHE  26  65.921  -1.558  10.422
  192    H    ASP  27           HN       ASP  27  61.283  -5.532   7.803
  193    HA   ASP  27           HA       ASP  27  62.769  -6.430  10.039
  194   1HB   ASP  27           HB2      ASP  27  60.038  -7.341   9.082
  195   2HB   ASP  27           HB1      ASP  27  60.695  -7.634  10.693
  196    H    MET  28           HN       MET  28  62.336  -7.911   6.969
  197    HA   MET  28           HA       MET  28  62.667 -10.661   7.832
  198   1HB   MET  28           HB2      MET  28  62.103  -9.328   5.408
  199   2HB   MET  28           HB1      MET  28  63.614 -10.199   5.142
  200   1HG   MET  28           HG2      MET  28  61.106 -11.436   6.315
  201   2HG   MET  28           HG1      MET  28  61.596 -11.584   4.627
  202   1HE   MET  28           HE3      MET  28  63.889 -11.962   4.013
  203   2HE   MET  28           HE2      MET  28  65.111 -11.939   5.281
  204   3HE   MET  28           HE1      MET  28  64.713 -13.456   4.478
  205    H    PHE  29           HN       PHE  29  64.858  -8.089   6.773
  206    HA   PHE  29           HA       PHE  29  67.168  -9.932   7.118
  207   1HB   PHE  29           HB2      PHE  29  67.678  -7.124   6.345
  208   2HB   PHE  29           HB1      PHE  29  68.315  -8.613   5.650
  209    HD1  PHE  29           HD1      PHE  29  66.145 -10.136   4.702
  210    HD2  PHE  29           HD2      PHE  29  66.508  -5.860   4.787
  211    HE1  PHE  29           HE1      PHE  29  64.507  -9.961   2.847
  212    HE2  PHE  29           HE2      PHE  29  64.869  -5.683   2.934
  213    HZ   PHE  29           HZ       PHE  29  63.869  -7.733   1.963
  214    H    ASP  30           HN       ASP  30  65.387  -8.324   9.197
  215    HA   ASP  30           HA       ASP  30  67.497  -6.771  10.551
  216   1HB   ASP  30           HB2      ASP  30  65.791  -6.066  12.067
  217   2HB   ASP  30           HB1      ASP  30  65.035  -6.090  10.474
  218    H    ALA  31           HN       ALA  31  68.403  -9.318  10.395
  219    HA   ALA  31           HA       ALA  31  67.601 -11.055  12.531
  220   1HB   ALA  31           HB3      ALA  31  69.374 -11.217  10.410
  221   2HB   ALA  31           HB2      ALA  31  70.441 -11.200  11.815
  222   3HB   ALA  31           HB1      ALA  31  69.184 -12.430  11.675
  223    H    ASP  32           HN       ASP  32  69.214  -8.072  12.575
  224    HA   ASP  32           HA       ASP  32  70.959  -8.532  14.838
  225   1HB   ASP  32           HB2      ASP  32  69.742  -5.922  13.889
  226   2HB   ASP  32           HB1      ASP  32  71.162  -6.105  14.920
  227    H    GLY  33           HN       GLY  33  67.634  -7.337  14.464
  228   1HA   GLY  33           HA2      GLY  33  65.899  -7.535  16.085
  229   2HA   GLY  33           HA1      GLY  33  67.100  -8.052  17.270
  230    H    GLY  34           HN       GLY  34  68.655  -5.541  16.120
  231   1HA   GLY  34           HA2      GLY  34  67.746  -3.763  18.265
  232   2HA   GLY  34           HA1      GLY  34  69.103  -3.467  17.178
  233    H    GLY  35           HN       GLY  35  66.909  -4.258  15.015
  234   1HA   GLY  35           HA2      GLY  35  65.025  -3.056  14.045
  235   2HA   GLY  35           HA1      GLY  35  65.492  -1.638  14.989
  236    H    ASP  36           HN       ASP  36  67.716  -3.650  13.117
  237    HA   ASP  36           HA       ASP  36  67.830  -1.700  10.924
  238   1HB   ASP  36           HB2      ASP  36  70.266  -1.241  11.293
  239   2HB   ASP  36           HB1      ASP  36  69.238  -0.573  12.561
  240    H    ILE  37           HN       ILE  37  69.266  -2.463   9.189
  241    HA   ILE  37           HA       ILE  37  69.843  -5.390   9.415
  242    HB   ILE  37           HB       ILE  37  68.144  -5.350   7.833
  243   1HG1  ILE  37          HG12      ILE  37  70.657  -4.793   6.226
  244   2HG1  ILE  37          HG11      ILE  37  70.047  -6.374   6.717
  245   1HG2  ILE  37          HG21      ILE  37  69.241  -2.644   7.060
  246   2HG2  ILE  37          HG23      ILE  37  68.028  -3.474   6.086
  247   3HG2  ILE  37          HG22      ILE  37  67.663  -3.021   7.752
  248   1HD1  ILE  37          HD11      ILE  37  67.992  -4.885   5.329
  249   2HD1  ILE  37          HD13      ILE  37  69.449  -4.985   4.341
  250   3HD1  ILE  37          HD12      ILE  37  68.683  -6.458   4.930
  251    H    SER  38           HN       SER  38  71.571  -6.081   7.838
  252    HA   SER  38           HA       SER  38  73.826  -4.159   7.994
  253   1HB   SER  38           HB2      SER  38  73.795  -7.054   7.077
  254   2HB   SER  38           HB1      SER  38  75.228  -6.077   7.382
  255    HG   SER  38           HG       SER  38  74.900  -6.231   9.488
  256    H    THR  39           HN       THR  39  74.913  -3.426   6.082
  257    HA   THR  39           HA       THR  39  73.218  -3.164   3.774
  258    HB   THR  39           HB       THR  39  74.908  -1.847   2.828
  259    HG1  THR  39           HG1      THR  39  76.856  -2.959   4.532
  260   1HG2  THR  39          HG21      THR  39  74.428  -1.636   5.642
  261   2HG2  THR  39          HG23      THR  39  76.108  -1.196   5.331
  262   3HG2  THR  39          HG22      THR  39  74.805  -0.348   4.497
  263    H    LYS  40           HN       LYS  40  75.383  -5.616   4.794
  264    HA   LYS  40           HA       LYS  40  76.053  -6.615   2.139
  265   1HB   LYS  40           HB2      LYS  40  76.962  -8.546   3.326
  266   2HB   LYS  40           HB1      LYS  40  77.453  -7.068   4.157
  267   1HG   LYS  40           HG2      LYS  40  76.558  -7.929   6.037
  268   2HG   LYS  40           HG1      LYS  40  74.973  -7.744   5.285
  269   1HD   LYS  40           HD2      LYS  40  74.872  -9.968   4.626
  270   2HD   LYS  40           HD1      LYS  40  76.627 -10.144   4.586
  271   1HE   LYS  40           HE2      LYS  40  76.787 -10.458   6.882
  272   2HE   LYS  40           HE1      LYS  40  75.293  -9.580   7.211
  273   1HZ   LYS  40           HZ1      LYS  40  74.538 -11.697   5.647
  274   2HZ   LYS  40           HZ3      LYS  40  75.680 -12.359   6.713
  275   3HZ   LYS  40           HZ2      LYS  40  74.316 -11.552   7.326
  276    H    ALA  41           HN       ALA  41  73.266  -6.706   4.078
  277    HA   ALA  41           HA       ALA  41  72.305  -9.288   3.024
  278   1HB   ALA  41           HB2      ALA  41  71.807  -7.936   5.357
  279   2HB   ALA  41           HB1      ALA  41  70.385  -7.522   4.400
  280   3HB   ALA  41           HB3      ALA  41  70.779  -9.214   4.708
  281    H    LEU  42           HN       LEU  42  72.595  -6.295   1.713
  282    HA   LEU  42           HA       LEU  42  69.996  -5.760   0.645
  283   1HB   LEU  42           HB2      LEU  42  72.799  -5.018  -0.129
  284   2HB   LEU  42           HB1      LEU  42  71.502  -4.718  -1.281
  285    HG   LEU  42           HG       LEU  42  71.741  -2.716   0.018
  286   1HD1  LEU  42          HD12      LEU  42  69.380  -3.861  -0.281
  287   2HD1  LEU  42          HD11      LEU  42  69.470  -4.017   1.475
  288   3HD1  LEU  42          HD13      LEU  42  69.553  -2.424   0.726
  289   1HD2  LEU  42          HD21      LEU  42  71.933  -4.659   2.291
  290   2HD2  LEU  42          HD23      LEU  42  72.927  -3.246   1.937
  291   3HD2  LEU  42          HD22      LEU  42  71.308  -3.041   2.606
  292    H    GLY  43           HN       GLY  43  72.789  -7.427  -0.850
  293   1HA   GLY  43           HA2      GLY  43  71.723  -8.195  -3.275
  294   2HA   GLY  43           HA1      GLY  43  72.777  -9.258  -2.341
  295    H    THR  44           HN       THR  44  70.970  -9.608  -0.110
  296    HA   THR  44           HA       THR  44  69.332 -11.737  -1.211
  297    HB   THR  44           HB       THR  44  69.318 -10.544   1.580
  298    HG1  THR  44           HG1      THR  44  70.887 -12.477   0.282
  299   1HG2  THR  44          HG22      THR  44  67.358 -12.013   0.768
  300   2HG2  THR  44          HG21      THR  44  68.526 -13.335   0.758
  301   3HG2  THR  44          HG23      THR  44  68.163 -12.489   2.264
  302    H    VAL  45           HN       VAL  45  68.593  -8.608   0.357
  303    HA   VAL  45           HA       VAL  45  65.793  -8.703   0.233
  304    HB   VAL  45           HB       VAL  45  67.431  -6.235  -0.399
  305   1HG1  VAL  45          HG13      VAL  45  64.650  -6.827   0.514
  306   2HG1  VAL  45          HG12      VAL  45  65.440  -5.397   1.177
  307   3HG1  VAL  45          HG11      VAL  45  65.231  -5.561  -0.567
  308   1HG2  VAL  45          HG23      VAL  45  67.067  -7.790   2.138
  309   2HG2  VAL  45          HG22      VAL  45  68.481  -6.911   1.558
  310   3HG2  VAL  45          HG21      VAL  45  67.112  -6.029   2.231
  311    H    MET  46           HN       MET  46  67.880  -7.140  -2.231
  312    HA   MET  46           HA       MET  46  65.948  -6.637  -4.169
  313   1HB   MET  46           HB2      MET  46  68.739  -7.690  -4.722
  314   2HB   MET  46           HB1      MET  46  67.736  -6.753  -5.831
  315   1HG   MET  46           HG2      MET  46  68.835  -5.812  -3.166
  316   2HG   MET  46           HG1      MET  46  69.343  -5.263  -4.764
  317   1HE   MET  46           HE1      MET  46  69.185  -3.102  -3.787
  318   2HE   MET  46           HE3      MET  46  68.462  -2.730  -5.359
  319   3HE   MET  46           HE2      MET  46  67.762  -2.068  -3.884
  320    H    ARG  47           HN       ARG  47  67.408  -9.734  -3.333
  321    HA   ARG  47           HA       ARG  47  66.398 -11.151  -5.645
  322   1HB   ARG  47           HB2      ARG  47  67.468 -11.993  -2.955
  323   2HB   ARG  47           HB1      ARG  47  66.782 -13.178  -4.067
  324   1HG   ARG  47           HG2      ARG  47  69.080 -11.291  -4.659
  325   2HG   ARG  47           HG1      ARG  47  69.197 -13.035  -4.420
  326   1HD   ARG  47           HD2      ARG  47  67.238 -12.767  -6.380
  327   2HD   ARG  47           HD1      ARG  47  68.434 -11.543  -6.811
  328    HE   ARG  47           HE       ARG  47  69.810 -13.962  -6.206
  329   1HH1  ARG  47          HH11      ARG  47  69.690 -12.092  -8.741
  330   2HH1  ARG  47          HH12      ARG  47  69.336 -13.283  -9.950
  331   1HH2  ARG  47          HH21      ARG  47  68.469 -15.735  -7.656
  332   2HH2  ARG  47          HH22      ARG  47  68.647 -15.346  -9.335
  333    H    MET  48           HN       MET  48  65.201 -10.664  -2.328
  334    HA   MET  48           HA       MET  48  62.880 -12.355  -2.673
  335   1HB   MET  48           HB2      MET  48  63.999 -10.638  -0.603
  336   2HB   MET  48           HB1      MET  48  62.248 -10.464  -0.713
  337   1HG   MET  48           HG2      MET  48  61.894 -12.800  -0.376
  338   2HG   MET  48           HG1      MET  48  63.600 -13.166  -0.633
  339   1HE   MET  48           HE1      MET  48  65.365 -11.717   0.623
  340   2HE   MET  48           HE3      MET  48  65.434 -11.906   2.381
  341   3HE   MET  48           HE2      MET  48  65.341 -13.324   1.341
  342    H    LEU  49           HN       LEU  49  63.051  -8.791  -2.332
  343    HA   LEU  49           HA       LEU  49  60.474  -8.138  -3.106
  344   1HB   LEU  49           HB2      LEU  49  62.821  -6.600  -4.219
  345   2HB   LEU  49           HB1      LEU  49  61.265  -5.979  -3.666
  346    HG   LEU  49           HG       LEU  49  63.551  -7.035  -1.994
  347   1HD1  LEU  49          HD11      LEU  49  62.485  -4.447  -2.701
  348   2HD1  LEU  49          HD13      LEU  49  62.367  -4.688  -0.958
  349   3HD1  LEU  49          HD12      LEU  49  63.929  -4.829  -1.763
  350   1HD2  LEU  49          HD23      LEU  49  60.658  -6.561  -1.203
  351   2HD2  LEU  49          HD22      LEU  49  61.548  -8.082  -1.102
  352   3HD2  LEU  49          HD21      LEU  49  61.978  -6.737  -0.046
  353    H    GLY  50           HN       GLY  50  63.211  -8.246  -5.426
  354   1HA   GLY  50           HA2      GLY  50  62.259  -9.904  -7.375
  355   2HA   GLY  50           HA1      GLY  50  61.325  -8.436  -7.665
  356    H    GLN  51           HN       GLN  51  63.448  -6.617  -6.844
  357    HA   GLN  51           HA       GLN  51  64.706  -6.079  -9.280
  358   1HB   GLN  51           HB2      GLN  51  64.972  -5.185  -6.544
  359   2HB   GLN  51           HB1      GLN  51  66.563  -5.313  -7.295
  360   1HG   GLN  51           HG2      GLN  51  65.700  -3.996  -9.239
  361   2HG   GLN  51           HG1      GLN  51  64.179  -3.780  -8.372
  362   1HE2  GLN  51          HE22      GLN  51  65.849  -0.763  -7.333
  363   2HE2  GLN  51          HE21      GLN  51  64.816  -1.385  -8.528
  364    H    ASN  52           HN       ASN  52  67.064  -6.305  -9.824
  365    HA   ASN  52           HA       ASN  52  68.449  -8.595  -8.578
  366   1HB   ASN  52           HB2      ASN  52  66.925  -9.523 -10.380
  367   2HB   ASN  52           HB1      ASN  52  67.864  -8.599 -11.550
  368   1HD2  ASN  52          HD22      ASN  52  69.426 -11.961 -11.406
  369   2HD2  ASN  52          HD21      ASN  52  67.943 -11.316 -11.921
  370    HA   PRO  53           HA       PRO  53  71.096  -5.148 -10.227
  371   1HB   PRO  53           HB2      PRO  53  72.091  -4.374  -7.782
  372   2HB   PRO  53           HB1      PRO  53  70.629  -3.683  -8.508
  373   1HG   PRO  53           HG2      PRO  53  70.867  -5.626  -6.258
  374   2HG   PRO  53           HG1      PRO  53  69.583  -4.455  -6.598
  375   1HD   PRO  53           HD2      PRO  53  69.465  -7.233  -7.115
  376   2HD   PRO  53           HD1      PRO  53  68.353  -6.004  -7.757
  377    H    THR  54           HN       THR  54  73.395  -5.299 -10.452
  378    HA   THR  54           HA       THR  54  74.521  -7.917  -9.896
  379    HB   THR  54           HB       THR  54  76.557  -7.005 -10.954
  380    HG1  THR  54           HG1      THR  54  76.626  -4.852 -11.509
  381   1HG2  THR  54          HG22      THR  54  73.860  -6.589 -12.182
  382   2HG2  THR  54          HG21      THR  54  75.284  -6.043 -13.067
  383   3HG2  THR  54          HG23      THR  54  75.122  -7.740 -12.618
  384    H    LYS  55           HN       LYS  55  76.348  -8.352  -8.522
  385    HA   LYS  55           HA       LYS  55  76.253  -7.281  -5.930
  386   1HB   LYS  55           HB2      LYS  55  78.666  -8.165  -5.762
  387   2HB   LYS  55           HB1      LYS  55  77.420  -9.331  -6.209
  388   1HG   LYS  55           HG2      LYS  55  78.677  -9.806  -8.022
  389   2HG   LYS  55           HG1      LYS  55  78.216  -8.222  -8.645
  390   1HD   LYS  55           HD2      LYS  55  80.182  -7.195  -7.796
  391   2HD   LYS  55           HD1      LYS  55  80.546  -8.572  -6.755
  392   1HE   LYS  55           HE2      LYS  55  80.711  -9.938  -8.942
  393   2HE   LYS  55           HE1      LYS  55  80.792  -8.375  -9.757
  394   1HZ   LYS  55           HZ1      LYS  55  82.599  -7.918  -7.958
  395   2HZ   LYS  55           HZ3      LYS  55  82.706  -9.609  -7.903
  396   3HZ   LYS  55           HZ2      LYS  55  82.992  -8.788  -9.362
  397    H    GLU  56           HN       GLU  56  78.349  -6.314  -8.646
  398    HA   GLU  56           HA       GLU  56  79.879  -4.376  -7.229
  399   1HB   GLU  56           HB2      GLU  56  79.160  -4.806 -10.110
  400   2HB   GLU  56           HB1      GLU  56  79.933  -3.291  -9.642
  401   1HG   GLU  56           HG2      GLU  56  81.543  -4.982  -8.322
  402   2HG   GLU  56           HG1      GLU  56  81.026  -6.064  -9.616
  403    H    GLU  57           HN       GLU  57  77.258  -3.608  -9.550
  404    HA   GLU  57           HA       GLU  57  76.842  -0.957  -8.879
  405   1HB   GLU  57           HB2      GLU  57  75.419  -2.902 -10.312
  406   2HB   GLU  57           HB1      GLU  57  74.273  -2.301  -9.113
  407   1HG   GLU  57           HG2      GLU  57  74.667  -0.003  -9.823
  408   2HG   GLU  57           HG1      GLU  57  75.924  -0.533 -10.941
  409    H    LEU  58           HN       LEU  58  76.000  -3.774  -6.970
  410    HA   LEU  58           HA       LEU  58  74.209  -2.413  -5.155
  411   1HB   LEU  58           HB2      LEU  58  74.515  -4.960  -5.527
  412   2HB   LEU  58           HB1      LEU  58  75.884  -4.814  -4.424
  413    HG   LEU  58           HG       LEU  58  73.873  -3.406  -3.129
  414   1HD1  LEU  58          HD12      LEU  58  72.454  -4.671  -5.006
  415   2HD1  LEU  58          HD11      LEU  58  72.589  -6.005  -3.860
  416   3HD1  LEU  58          HD13      LEU  58  71.842  -4.486  -3.361
  417   1HD2  LEU  58          HD22      LEU  58  75.161  -6.088  -2.895
  418   2HD2  LEU  58          HD21      LEU  58  75.149  -4.746  -1.752
  419   3HD2  LEU  58          HD23      LEU  58  73.735  -5.791  -1.900
  420    H    ASP  59           HN       ASP  59  77.667  -3.303  -4.936
  421    HA   ASP  59           HA       ASP  59  78.130  -2.161  -2.372
  422   1HB   ASP  59           HB2      ASP  59  79.659  -3.592  -4.053
  423   2HB   ASP  59           HB1      ASP  59  80.292  -1.986  -4.418
  424    H    ALA  60           HN       ALA  60  78.526  -0.730  -5.624
  425    HA   ALA  60           HA       ALA  60  79.396   1.833  -4.706
  426   1HB   ALA  60           HB3      ALA  60  78.157   0.796  -7.237
  427   2HB   ALA  60           HB2      ALA  60  78.299   2.539  -7.002
  428   3HB   ALA  60           HB1      ALA  60  79.743   1.528  -6.991
  429    H    ILE  61           HN       ILE  61  76.252   0.344  -4.866
  430    HA   ILE  61           HA       ILE  61  74.727   2.805  -4.700
  431    HB   ILE  61           HB       ILE  61  74.097  -0.111  -4.236
  432   1HG1  ILE  61          HG12      ILE  61  72.815   1.853  -6.139
  433   2HG1  ILE  61          HG11      ILE  61  74.317   1.026  -6.548
  434   1HG2  ILE  61          HG23      ILE  61  72.638   2.248  -3.259
  435   2HG2  ILE  61          HG22      ILE  61  71.657   1.171  -4.254
  436   3HG2  ILE  61          HG21      ILE  61  72.462   0.551  -2.812
  437   1HD1  ILE  61          HD12      ILE  61  72.015  -0.599  -5.530
  438   2HD1  ILE  61          HD11      ILE  61  71.981  -0.038  -7.201
  439   3HD1  ILE  61          HD13      ILE  61  73.304  -1.061  -6.641
  440    H    ILE  62           HN       ILE  62  75.752   0.358  -2.306
  441    HA   ILE  62           HA       ILE  62  74.584   1.636  -0.034
  442    HB   ILE  62           HB       ILE  62  76.960  -0.217  -0.331
  443   1HG1  ILE  62          HG12      ILE  62  74.427  -0.885   1.108
  444   2HG1  ILE  62          HG11      ILE  62  74.364  -0.791  -0.651
  445   1HG2  ILE  62          HG23      ILE  62  77.227   1.220   1.681
  446   2HG2  ILE  62          HG22      ILE  62  75.628   0.720   2.228
  447   3HG2  ILE  62          HG21      ILE  62  76.928  -0.465   2.104
  448   1HD1  ILE  62          HD12      ILE  62  76.670  -2.223  -0.269
  449   2HD1  ILE  62          HD11      ILE  62  75.680  -2.787   1.077
  450   3HD1  ILE  62          HD13      ILE  62  75.090  -2.944  -0.578
  451    H    GLU  63           HN       GLU  63  77.224   2.537  -2.002
  452    HA   GLU  63           HA       GLU  63  78.854   3.883  -0.053
  453   1HB   GLU  63           HB2      GLU  63  79.291   3.270  -2.592
  454   2HB   GLU  63           HB1      GLU  63  78.643   4.888  -2.868
  455   1HG   GLU  63           HG2      GLU  63  81.020   4.144  -1.141
  456   2HG   GLU  63           HG1      GLU  63  81.040   5.089  -2.630
  457    H    GLU  64           HN       GLU  64  76.177   5.001  -2.132
  458    HA   GLU  64           HA       GLU  64  76.319   7.680  -0.892
  459   1HB   GLU  64           HB2      GLU  64  75.277   6.576  -3.348
  460   2HB   GLU  64           HB1      GLU  64  74.011   7.474  -2.510
  461   1HG   GLU  64           HG2      GLU  64  76.753   8.674  -2.730
  462   2HG   GLU  64           HG1      GLU  64  75.665   8.744  -4.118
  463    H    VAL  65           HN       VAL  65  74.587   4.714  -0.492
  464    HA   VAL  65           HA       VAL  65  72.240   5.896   0.759
  465    HB   VAL  65           HB       VAL  65  73.349   3.077   0.737
  466   1HG1  VAL  65          HG12      VAL  65  70.943   4.277   2.098
  467   2HG1  VAL  65          HG11      VAL  65  70.919   2.599   1.554
  468   3HG1  VAL  65          HG13      VAL  65  72.116   3.125   2.739
  469   1HG2  VAL  65          HG22      VAL  65  70.983   4.406  -0.623
  470   2HG2  VAL  65          HG21      VAL  65  72.471   3.883  -1.411
  471   3HG2  VAL  65          HG23      VAL  65  71.370   2.689  -0.723
  472    H    ASP  66           HN       ASP  66  75.257   4.417   1.942
  473    HA   ASP  66           HA       ASP  66  74.486   4.931   4.736
  474   1HB   ASP  66           HB2      ASP  66  76.649   3.485   3.325
  475   2HB   ASP  66           HB1      ASP  66  77.132   4.258   4.836
  476    H    GLU  67           HN       GLU  67  74.283   7.339   3.908
  477    HA   GLU  67           HA       GLU  67  76.699   8.851   3.502
  478   1HB   GLU  67           HB2      GLU  67  75.298  10.817   3.860
  479   2HB   GLU  67           HB1      GLU  67  74.423   9.655   2.863
  480   1HG   GLU  67           HG2      GLU  67  72.822   9.358   4.435
  481   2HG   GLU  67           HG1      GLU  67  74.009   9.227   5.732
  482    H    ASP  68           HN       ASP  68  75.543   7.291   6.247
  483    HA   ASP  68           HA       ASP  68  76.743   9.280   8.104
  484   1HB   ASP  68           HB2      ASP  68  75.823   6.919   9.463
  485   2HB   ASP  68           HB1      ASP  68  75.197   8.561   9.575
  486    H    GLY  69           HN       GLY  69  77.563   6.453   6.413
  487   1HA   GLY  69           HA2      GLY  69  79.585   5.245   6.424
  488   2HA   GLY  69           HA1      GLY  69  80.179   6.353   7.662
  489    H    SER  70           HN       SER  70  77.173   5.053   8.507
  490    HA   SER  70           HA       SER  70  78.252   3.633  10.762
  491   1HB   SER  70           HB2      SER  70  75.941   2.907  11.146
  492   2HB   SER  70           HB1      SER  70  75.969   4.615  10.720
  493    HG   SER  70           HG       SER  70  75.719   3.665   8.459
  494    H    GLY  71           HN       GLY  71  77.782   2.755   7.470
  495   1HA   GLY  71           HA2      GLY  71  78.328   0.748   6.368
  496   2HA   GLY  71           HA1      GLY  71  78.954   0.143   7.902
  497    H    THR  72           HN       THR  72  75.718   1.353   7.905
  498    HA   THR  72           HA       THR  72  74.619  -1.398   7.596
  499    HB   THR  72           HB       THR  72  73.106  -0.490   9.660
  500    HG1  THR  72           HG1      THR  72  74.550   0.458  11.140
  501   1HG2  THR  72          HG23      THR  72  75.763  -1.933   9.875
  502   2HG2  THR  72          HG22      THR  72  74.486  -1.957  11.091
  503   3HG2  THR  72          HG21      THR  72  74.210  -2.683   9.507
  504    H    ILE  73           HN       ILE  73  72.202  -1.336   7.360
  505    HA   ILE  73           HA       ILE  73  71.329   1.265   6.164
  506    HB   ILE  73           HB       ILE  73  70.548  -1.551   5.351
  507   1HG1  ILE  73          HG12      ILE  73  72.870  -0.711   4.715
  508   2HG1  ILE  73          HG11      ILE  73  71.832  -1.159   3.361
  509   1HG2  ILE  73          HG22      ILE  73  69.417   1.118   4.807
  510   2HG2  ILE  73          HG21      ILE  73  69.714   0.144   3.366
  511   3HG2  ILE  73          HG23      ILE  73  68.674  -0.472   4.650
  512   1HD1  ILE  73          HD11      ILE  73  71.483   1.632   4.172
  513   2HD1  ILE  73          HD13      ILE  73  73.132   1.275   3.658
  514   3HD1  ILE  73          HD12      ILE  73  71.781   0.960   2.568
  515    H    ASP  74           HN       ASP  74  69.319   2.024   6.794
  516    HA   ASP  74           HA       ASP  74  67.825   0.334   8.763
  517   1HB   ASP  74           HB2      ASP  74  69.013   2.846   9.177
  518   2HB   ASP  74           HB1      ASP  74  67.290   3.180   8.999
  519    H    PHE  75           HN       PHE  75  65.433   1.154   8.899
  520    HA   PHE  75           HA       PHE  75  64.154   0.739   6.431
  521   1HB   PHE  75           HB2      PHE  75  63.167   0.765   8.833
  522   2HB   PHE  75           HB1      PHE  75  62.935   2.493   8.558
  523    HD1  PHE  75           HD2      PHE  75  62.678  -0.399   6.202
  524    HD2  PHE  75           HD1      PHE  75  60.639   2.815   8.185
  525    HE1  PHE  75           HE2      PHE  75  60.633  -0.884   4.883
  526    HE2  PHE  75           HE1      PHE  75  58.594   2.335   6.865
  527    HZ   PHE  75           HZ       PHE  75  58.590   0.483   5.216
  528    H    GLU  76           HN       GLU  76  64.852   3.853   8.046
  529    HA   GLU  76           HA       GLU  76  63.722   5.548   6.086
  530   1HB   GLU  76           HB2      GLU  76  66.130   5.960   7.879
  531   2HB   GLU  76           HB1      GLU  76  65.400   7.242   6.913
  532   1HG   GLU  76           HG2      GLU  76  63.202   6.173   8.163
  533   2HG   GLU  76           HG1      GLU  76  64.442   5.994   9.405
  534    H    GLU  77           HN       GLU  77  67.152   4.531   6.360
  535    HA   GLU  77           HA       GLU  77  67.912   5.658   3.835
  536   1HB   GLU  77           HB2      GLU  77  69.178   3.326   5.307
  537   2HB   GLU  77           HB1      GLU  77  69.945   4.316   4.065
  538   1HG   GLU  77           HG2      GLU  77  70.153   6.156   5.463
  539   2HG   GLU  77           HG1      GLU  77  68.785   5.677   6.470
  540    H    PHE  78           HN       PHE  78  66.061   2.892   4.610
  541    HA   PHE  78           HA       PHE  78  66.773   1.205   2.390
  542   1HB   PHE  78           HB2      PHE  78  65.064   1.009   4.580
  543   2HB   PHE  78           HB1      PHE  78  63.970   1.031   3.196
  544    HD1  PHE  78           HD2      PHE  78  64.154  -0.677   1.412
  545    HD2  PHE  78           HD1      PHE  78  66.606  -0.813   4.936
  546    HE1  PHE  78           HE2      PHE  78  64.747  -3.031   0.908
  547    HE2  PHE  78           HE1      PHE  78  67.199  -3.170   4.433
  548    HZ   PHE  78           HZ       PHE  78  66.271  -4.278   2.418
  549    H    LEU  79           HN       LEU  79  63.843   3.217   2.841
  550    HA   LEU  79           HA       LEU  79  62.832   3.081   0.250
  551   1HB   LEU  79           HB2      LEU  79  62.934   5.606   1.931
  552   2HB   LEU  79           HB1      LEU  79  61.766   5.234   0.662
  553    HG   LEU  79           HG       LEU  79  62.113   3.687   3.251
  554   1HD1  LEU  79          HD13      LEU  79  60.010   5.638   2.280
  555   2HD1  LEU  79          HD12      LEU  79  59.779   4.568   3.666
  556   3HD1  LEU  79          HD11      LEU  79  61.046   5.797   3.700
  557   1HD2  LEU  79          HD21      LEU  79  60.139   3.385   0.963
  558   2HD2  LEU  79          HD23      LEU  79  61.414   2.243   1.392
  559   3HD2  LEU  79          HD22      LEU  79  60.060   2.505   2.490
  560    H    VAL  80           HN       VAL  80  65.636   4.825   1.406
  561    HA   VAL  80           HA       VAL  80  65.977   6.506  -0.920
  562    HB   VAL  80           HB       VAL  80  67.850   5.574   1.265
  563   1HG1  VAL  80          HG12      VAL  80  68.450   6.840  -1.324
  564   2HG1  VAL  80          HG11      VAL  80  69.086   7.722   0.065
  565   3HG1  VAL  80          HG13      VAL  80  69.533   6.034  -0.189
  566   1HG2  VAL  80          HG23      VAL  80  66.055   7.853   0.780
  567   2HG2  VAL  80          HG22      VAL  80  66.719   7.251   2.298
  568   3HG2  VAL  80          HG21      VAL  80  67.678   8.328   1.282
  569    H    MET  81           HN       MET  81  67.938   3.689   0.120
  570    HA   MET  81           HA       MET  81  69.328   3.276  -2.256
  571   1HB   MET  81           HB2      MET  81  69.712   2.007  -0.154
  572   2HB   MET  81           HB1      MET  81  68.218   1.113  -0.445
  573   1HG   MET  81           HG2      MET  81  69.117   0.274  -2.570
  574   2HG   MET  81           HG1      MET  81  70.601   1.190  -2.313
  575   1HE   MET  81           HE3      MET  81  71.993   1.016  -0.164
  576   2HE   MET  81           HE2      MET  81  70.665   0.839   0.979
  577   3HE   MET  81           HE1      MET  81  71.978  -0.335   0.976
  578    H    MET  82           HN       MET  82  65.971   2.590  -1.558
  579    HA   MET  82           HA       MET  82  65.542   0.809  -3.794
  580   1HB   MET  82           HB2      MET  82  63.812   0.502  -2.334
  581   2HB   MET  82           HB1      MET  82  63.930   2.139  -1.700
  582   1HG   MET  82           HG2      MET  82  61.793   1.837  -2.856
  583   2HG   MET  82           HG1      MET  82  62.800   2.993  -3.729
  584   1HE   MET  82           HE2      MET  82  62.175  -0.731  -3.237
  585   2HE   MET  82           HE1      MET  82  62.576  -1.472  -4.784
  586   3HE   MET  82           HE3      MET  82  63.850  -0.773  -3.776
  587    H    VAL  83           HN       VAL  83  64.578   4.225  -3.250
  588    HA   VAL  83           HA       VAL  83  63.899   4.607  -6.041
  589    HB   VAL  83           HB       VAL  83  64.519   6.788  -4.042
  590   1HG1  VAL  83          HG12      VAL  83  63.710   6.802  -6.723
  591   2HG1  VAL  83          HG11      VAL  83  62.231   7.109  -5.812
  592   3HG1  VAL  83          HG13      VAL  83  63.632   8.158  -5.599
  593   1HG2  VAL  83          HG21      VAL  83  62.263   4.841  -4.161
  594   2HG2  VAL  83          HG23      VAL  83  62.956   5.673  -2.769
  595   3HG2  VAL  83          HG22      VAL  83  61.847   6.526  -3.843
  596    H    ARG  84           HN       ARG  84  66.843   4.261  -4.547
  597    HA   ARG  84           HA       ARG  84  68.387   6.331  -5.798
  598   1HB   ARG  84           HB2      ARG  84  69.228   5.075  -3.870
  599   2HB   ARG  84           HB1      ARG  84  69.205   3.584  -4.812
  600   1HG   ARG  84           HG2      ARG  84  70.994   4.245  -6.155
  601   2HG   ARG  84           HG1      ARG  84  70.730   5.959  -5.833
  602   1HD   ARG  84           HD2      ARG  84  71.254   5.168  -3.327
  603   2HD   ARG  84           HD1      ARG  84  72.155   3.920  -4.187
  604    HE   ARG  84           HE       ARG  84  73.045   6.587  -3.861
  605   1HH1  ARG  84          HH21      ARG  84  72.217   6.886  -6.692
  606   2HH1  ARG  84          HH22      ARG  84  73.610   6.330  -7.558
  607   1HH2  ARG  84          HH11      ARG  84  74.997   4.719  -4.818
  608   2HH2  ARG  84          HH12      ARG  84  75.183   5.102  -6.497
  609    H    GLN  85           HN       GLN  85  67.190   3.224  -6.904
  610    HA   GLN  85           HA       GLN  85  68.434   3.806  -9.554
  611   1HB   GLN  85           HB2      GLN  85  68.466   1.168  -8.068
  612   2HB   GLN  85           HB1      GLN  85  68.829   1.317  -9.788
  613   1HG   GLN  85           HG2      GLN  85  70.359   3.313  -8.521
  614   2HG   GLN  85           HG1      GLN  85  70.535   1.873  -7.517
  615   1HE2  GLN  85          HE22      GLN  85  72.534   2.049 -10.974
  616   2HE2  GLN  85          HE21      GLN  85  71.813   3.397 -10.236
  617    H    MET  86           HN       MET  86  65.615   3.317  -7.887
  618    HA   MET  86           HA       MET  86  64.256   1.607  -9.822
  619   1HB   MET  86           HB2      MET  86  62.412   1.737  -8.425
  620   2HB   MET  86           HB1      MET  86  63.691   2.113  -7.273
  621   1HG   MET  86           HG2      MET  86  63.294   4.566  -7.789
  622   2HG   MET  86           HG1      MET  86  61.868   4.067  -8.697
  623   1HE   MET  86           HE3      MET  86  60.460   2.236  -7.859
  624   2HE   MET  86           HE2      MET  86  59.739   2.182  -6.253
  625   3HE   MET  86           HE1      MET  86  59.394   3.541  -7.320
  626    H    LYS  87           HN       LYS  87  64.583   5.080  -9.258
  627    HA   LYS  87           HA       LYS  87  62.599   6.001 -11.066
  628   1HB   LYS  87           HB2      LYS  87  65.131   7.123  -9.942
  629   2HB   LYS  87           HB1      LYS  87  64.409   7.947 -11.324
  630   1HG   LYS  87           HG2      LYS  87  62.360   7.254  -9.410
  631   2HG   LYS  87           HG1      LYS  87  63.642   8.171  -8.618
  632   1HD   LYS  87           HD2      LYS  87  62.248   9.003 -11.180
  633   2HD   LYS  87           HD1      LYS  87  61.890   9.654  -9.579
  634   1HE   LYS  87           HE2      LYS  87  63.978  10.718  -9.405
  635   2HE   LYS  87           HE1      LYS  87  64.703   9.703 -10.651
  636   1HZ   LYS  87           HZ3      LYS  87  62.798  10.821 -12.072
  637   2HZ   LYS  87           HZ2      LYS  87  62.998  12.057 -10.924
  638   3HZ   LYS  87           HZ1      LYS  87  64.316  11.553 -11.872
  639    H    GLU  88           HN       GLU  88  66.119   5.924 -11.749
  640    HA   GLU  88           HA       GLU  88  65.887   6.217 -14.546
  641   1HB   GLU  88           HB2      GLU  88  67.976   5.890 -12.764
  642   2HB   GLU  88           HB1      GLU  88  68.057   4.415 -13.729
  643   1HG   GLU  88           HG2      GLU  88  69.319   5.835 -15.058
  644   2HG   GLU  88           HG1      GLU  88  67.717   6.119 -15.739
  645    H    ASP  89           HN       ASP  89  67.037   4.092 -15.836
  646    HA   ASP  89           HA       ASP  89  66.302   2.148 -16.946
  647   1HB   ASP  89           HB2      ASP  89  66.489   1.527 -14.038
  648   2HB   ASP  89           HB1      ASP  89  65.714   0.326 -15.073
  649    H    ALA  90           HN       ALA  90  64.227   1.277 -14.308
  650    HA   ALA  90           HA       ALA  90  61.898   1.003 -14.227
  651   1HB   ALA  90           HB1      ALA  90  62.121   3.537 -14.249
  652   2HB   ALA  90           HB3      ALA  90  61.822   3.465 -15.986
  653   3HB   ALA  90           HB2      ALA  90  60.586   2.913 -14.855
   
  No H/Q in entry =         653
  Start of MODEL   21
    1   1H    ALA   1           HT1      ALA   1  70.597  16.640  12.343
    2   2H    ALA   1           HT3      ALA   1  71.639  15.317  12.143
    3   3H    ALA   1           HT2      ALA   1  72.144  16.872  11.683
    4    HA   ALA   1           HA       ALA   1  71.009  16.852   9.747
    5   1HB   ALA   1           HB2      ALA   1  71.343  13.929  10.471
    6   2HB   ALA   1           HB1      ALA   1  70.901  14.482   8.856
    7   3HB   ALA   1           HB3      ALA   1  72.458  14.938   9.549
    8    H    SER   2           HN       SER   2  69.403  14.834  12.175
    9    HA   SER   2           HA       SER   2  67.117  14.466  12.559
   10   1HB   SER   2           HB2      SER   2  67.244  17.049  11.126
   11   2HB   SER   2           HB1      SER   2  65.694  16.219  11.013
   12    HG   SER   2           HG       SER   2  67.002  16.388  13.492
   13    H    MET   3           HN       MET   3  66.477  15.678   9.323
   14    HA   MET   3           HA       MET   3  66.058  12.853   8.425
   15   1HB   MET   3           HB2      MET   3  64.260  15.225   8.326
   16   2HB   MET   3           HB1      MET   3  64.272  14.184   6.904
   17   1HG   MET   3           HG2      MET   3  63.316  12.426   8.014
   18   2HG   MET   3           HG1      MET   3  64.149  12.796   9.525
   19   1HE   MET   3           HE1      MET   3  61.315  11.794   9.575
   20   2HE   MET   3           HE3      MET   3  62.129  12.373  11.035
   21   3HE   MET   3           HE2      MET   3  60.491  12.905  10.668
   22    H    THR   4           HN       THR   4  67.808  12.574   7.076
   23    HA   THR   4           HA       THR   4  69.043  14.627   5.529
   24    HB   THR   4           HB       THR   4  69.768  12.507   4.116
   25    HG1  THR   4           HG1      THR   4  69.629  10.753   5.860
   26   1HG2  THR   4          HG23      THR   4  70.509  13.359   6.885
   27   2HG2  THR   4          HG22      THR   4  71.238  11.890   6.238
   28   3HG2  THR   4          HG21      THR   4  71.458  13.426   5.401
   29    H    ASP   5           HN       ASP   5  68.824  15.145   3.298
   30    HA   ASP   5           HA       ASP   5  66.150  15.104   2.268
   31   1HB   ASP   5           HB2      ASP   5  68.698  15.536   0.683
   32   2HB   ASP   5           HB1      ASP   5  67.083  16.122   0.283
   33    H    GLN   6           HN       GLN   6  68.692  12.784   2.159
   34    HA   GLN   6           HA       GLN   6  68.152  11.456  -0.286
   35   1HB   GLN   6           HB2      GLN   6  69.280  10.616   2.361
   36   2HB   GLN   6           HB1      GLN   6  68.867   9.368   1.187
   37   1HG   GLN   6           HG2      GLN   6  70.177  11.147  -0.410
   38   2HG   GLN   6           HG1      GLN   6  71.034  11.378   1.115
   39   1HE2  GLN   6          HE22      GLN   6  72.095   7.872   1.209
   40   2HE2  GLN   6          HE21      GLN   6  71.428   9.034   2.253
   41    H    GLN   7           HN       GLN   7  66.830  10.713   2.965
   42    HA   GLN   7           HA       GLN   7  64.850   8.891   1.834
   43   1HB   GLN   7           HB2      GLN   7  64.816  10.085   4.612
   44   2HB   GLN   7           HB1      GLN   7  64.130   8.549   4.082
   45   1HG   GLN   7           HG2      GLN   7  66.215   7.509   3.945
   46   2HG   GLN   7           HG1      GLN   7  67.076   9.037   3.758
   47   1HE2  GLN   7          HE22      GLN   7  67.785   8.104   7.229
   48   2HE2  GLN   7          HE21      GLN   7  68.276   7.671   5.662
   49    H    ALA   8           HN       ALA   8  65.057  12.277   2.333
   50    HA   ALA   8           HA       ALA   8  62.241  12.814   2.708
   51   1HB   ALA   8           HB3      ALA   8  64.269  14.377   3.139
   52   2HB   ALA   8           HB2      ALA   8  64.180  14.726   1.412
   53   3HB   ALA   8           HB1      ALA   8  62.808  15.092   2.458
   54    H    GLU   9           HN       GLU   9  64.347  12.497  -0.120
   55    HA   GLU   9           HA       GLU   9  62.170  13.255  -1.949
   56   1HB   GLU   9           HB2      GLU   9  64.913  13.373  -2.131
   57   2HB   GLU   9           HB1      GLU   9  64.543  11.942  -3.095
   58   1HG   GLU   9           HG2      GLU   9  62.629  13.552  -4.048
   59   2HG   GLU   9           HG1      GLU   9  63.786  14.791  -3.561
   60    H    ALA  10           HN       ALA  10  63.972  10.307  -1.076
   61    HA   ALA  10           HA       ALA  10  62.697   8.547  -2.906
   62   1HB   ALA  10           HB2      ALA  10  64.630   8.270  -0.984
   63   2HB   ALA  10           HB1      ALA  10  63.277   7.417  -0.241
   64   3HB   ALA  10           HB3      ALA  10  63.867   6.920  -1.826
   65    H    ARG  11           HN       ARG  11  61.939   8.910   0.581
   66    HA   ARG  11           HA       ARG  11  59.517   7.454   0.520
   67   1HB   ARG  11           HB2      ARG  11  60.838   8.408   2.543
   68   2HB   ARG  11           HB1      ARG  11  59.889   9.873   2.283
   69   1HG   ARG  11           HG2      ARG  11  57.818   8.660   2.574
   70   2HG   ARG  11           HG1      ARG  11  58.673   7.117   2.618
   71   1HD   ARG  11           HD2      ARG  11  58.555   7.426   4.880
   72   2HD   ARG  11           HD1      ARG  11  59.972   8.437   4.602
   73    HE   ARG  11           HE       ARG  11  57.667  10.055   4.232
   74   1HH1  ARG  11          HH21      ARG  11  59.923  10.782   6.047
   75   2HH1  ARG  11          HH22      ARG  11  59.173  10.725   7.608
   76   1HH2  ARG  11          HH11      ARG  11  56.432   8.901   6.519
   77   2HH2  ARG  11          HH12      ARG  11  57.198   9.660   7.876
   78    H    ALA  12           HN       ALA  12  60.218  10.724  -0.509
   79    HA   ALA  12           HA       ALA  12  57.476  11.644  -0.550
   80   1HB   ALA  12           HB3      ALA  12  60.101  12.637  -1.408
   81   2HB   ALA  12           HB2      ALA  12  58.793  13.113  -2.491
   82   3HB   ALA  12           HB1      ALA  12  58.716  13.527  -0.779
   83    H    PHE  13           HN       PHE  13  59.572  10.000  -2.881
   84    HA   PHE  13           HA       PHE  13  57.499  10.157  -4.973
   85   1HB   PHE  13           HB2      PHE  13  59.784  10.332  -5.734
   86   2HB   PHE  13           HB1      PHE  13  60.234   8.855  -4.880
   87    HD1  PHE  13           HD2      PHE  13  59.523   6.653  -5.695
   88    HD2  PHE  13           HD1      PHE  13  58.499  10.253  -7.803
   89    HE1  PHE  13           HE2      PHE  13  58.882   5.308  -7.679
   90    HE2  PHE  13           HE1      PHE  13  57.859   8.909  -9.787
   91    HZ   PHE  13           HZ       PHE  13  58.051   6.437  -9.725
   92    H    LEU  14           HN       LEU  14  58.318   8.103  -2.373
   93    HA   LEU  14           HA       LEU  14  57.209   5.674  -3.617
   94   1HB   LEU  14           HB2      LEU  14  58.116   6.243  -0.777
   95   2HB   LEU  14           HB1      LEU  14  57.621   4.661  -1.382
   96    HG   LEU  14           HG       LEU  14  59.844   6.275  -2.651
   97   1HD1  LEU  14          HD11      LEU  14  60.054   5.427  -0.123
   98   2HD1  LEU  14          HD13      LEU  14  60.407   3.900  -0.930
   99   3HD1  LEU  14          HD12      LEU  14  61.407   5.316  -1.249
  100   1HD2  LEU  14          HD23      LEU  14  58.508   3.710  -3.145
  101   2HD2  LEU  14          HD22      LEU  14  59.537   4.661  -4.216
  102   3HD2  LEU  14          HD21      LEU  14  60.262   3.562  -3.042
  103    H    SER  15           HN       SER  15  55.221   4.717  -2.983
  104    HA   SER  15           HA       SER  15  53.292   6.648  -1.800
  105   1HB   SER  15           HB2      SER  15  52.577   4.002  -3.056
  106   2HB   SER  15           HB1      SER  15  51.581   5.446  -2.897
  107    HG   SER  15           HG       SER  15  52.437   5.162  -5.019
  108    H    GLU  16           HN       GLU  16  52.217   6.188   0.113
  109    HA   GLU  16           HA       GLU  16  53.365   4.478   2.030
  110   1HB   GLU  16           HB2      GLU  16  51.527   6.364   2.233
  111   2HB   GLU  16           HB1      GLU  16  50.413   5.003   2.103
  112   1HG   GLU  16           HG2      GLU  16  51.912   3.908   3.935
  113   2HG   GLU  16           HG1      GLU  16  52.472   5.554   4.229
  114    H    GLU  17           HN       GLU  17  51.290   3.694  -0.616
  115    HA   GLU  17           HA       GLU  17  50.113   1.294   0.427
  116   1HB   GLU  17           HB2      GLU  17  50.268   2.662  -2.121
  117   2HB   GLU  17           HB1      GLU  17  50.499   0.927  -2.339
  118   1HG   GLU  17           HG2      GLU  17  48.336   0.487  -1.871
  119   2HG   GLU  17           HG1      GLU  17  48.368   1.510  -0.433
  120    H    MET  18           HN       MET  18  53.059   1.826  -1.533
  121    HA   MET  18           HA       MET  18  53.799  -1.004  -1.304
  122   1HB   MET  18           HB2      MET  18  54.511   1.172  -2.990
  123   2HB   MET  18           HB1      MET  18  55.983   0.651  -2.171
  124   1HG   MET  18           HG2      MET  18  56.076  -1.251  -3.379
  125   2HG   MET  18           HG1      MET  18  54.388  -1.625  -3.031
  126   1HE   MET  18           HE2      MET  18  57.008  -0.458  -5.032
  127   2HE   MET  18           HE1      MET  18  56.391  -0.271  -6.672
  128   3HE   MET  18           HE3      MET  18  56.417   1.113  -5.571
  129    H    ILE  19           HN       ILE  19  55.149   2.097  -0.134
  130    HA   ILE  19           HA       ILE  19  57.322   1.208   1.331
  131    HB   ILE  19           HB       ILE  19  55.284   3.249   2.273
  132   1HG1  ILE  19          HG12      ILE  19  57.688   3.430   0.437
  133   2HG1  ILE  19          HG11      ILE  19  56.016   3.848   0.061
  134   1HG2  ILE  19          HG22      ILE  19  56.944   2.481   3.987
  135   2HG2  ILE  19          HG21      ILE  19  58.241   2.977   2.900
  136   3HG2  ILE  19          HG23      ILE  19  57.132   4.182   3.557
  137   1HD1  ILE  19          HD13      ILE  19  56.673   5.354   2.350
  138   2HD1  ILE  19          HD12      ILE  19  58.067   5.487   1.279
  139   3HD1  ILE  19          HD11      ILE  19  56.468   5.957   0.705
  140    H    ALA  20           HN       ALA  20  53.907   1.091   2.345
  141    HA   ALA  20           HA       ALA  20  54.275   0.171   4.984
  142   1HB   ALA  20           HB3      ALA  20  52.087   0.776   3.751
  143   2HB   ALA  20           HB2      ALA  20  52.095  -0.896   3.189
  144   3HB   ALA  20           HB1      ALA  20  52.020  -0.547   4.916
  145    H    GLU  21           HN       GLU  21  53.704  -1.869   2.089
  146    HA   GLU  21           HA       GLU  21  54.281  -4.329   3.442
  147   1HB   GLU  21           HB2      GLU  21  54.059  -3.469   0.582
  148   2HB   GLU  21           HB1      GLU  21  54.782  -5.039   0.936
  149   1HG   GLU  21           HG2      GLU  21  52.648  -5.240   2.533
  150   2HG   GLU  21           HG1      GLU  21  51.980  -4.100   1.364
  151    H    PHE  22           HN       PHE  22  56.330  -1.834   2.247
  152    HA   PHE  22           HA       PHE  22  58.670  -3.454   1.738
  153   1HB   PHE  22           HB2      PHE  22  58.058  -0.558   1.990
  154   2HB   PHE  22           HB1      PHE  22  59.723  -1.033   2.322
  155    HD1  PHE  22           HD1      PHE  22  57.407  -2.774   0.003
  156    HD2  PHE  22           HD2      PHE  22  60.785  -0.144   0.363
  157    HE1  PHE  22           HE1      PHE  22  57.833  -2.987  -2.432
  158    HE2  PHE  22           HE2      PHE  22  61.211  -0.358  -2.071
  159    HZ   PHE  22           HZ       PHE  22  59.735  -1.779  -3.468
  160    H    LYS  23           HN       LYS  23  57.467  -1.668   4.568
  161    HA   LYS  23           HA       LYS  23  59.769  -2.114   6.214
  162   1HB   LYS  23           HB2      LYS  23  57.567  -0.615   6.522
  163   2HB   LYS  23           HB1      LYS  23  57.070  -2.014   7.477
  164   1HG   LYS  23           HG2      LYS  23  59.839  -1.145   7.976
  165   2HG   LYS  23           HG1      LYS  23  58.620   0.047   8.427
  166   1HD   LYS  23           HD2      LYS  23  57.420  -2.053   9.499
  167   2HD   LYS  23           HD1      LYS  23  59.055  -2.714   9.502
  168   1HE   LYS  23           HE2      LYS  23  59.559  -1.490  11.318
  169   2HE   LYS  23           HE1      LYS  23  59.185  -0.012  10.432
  170   1HZ   LYS  23           HZ3      LYS  23  56.972  -1.634  11.466
  171   2HZ   LYS  23           HZ2      LYS  23  57.848  -0.667  12.555
  172   3HZ   LYS  23           HZ1      LYS  23  57.061   0.043  11.226
  173    H    ALA  24           HN       ALA  24  57.093  -4.150   5.304
  174    HA   ALA  24           HA       ALA  24  57.266  -6.031   7.469
  175   1HB   ALA  24           HB1      ALA  24  55.560  -5.718   5.381
  176   2HB   ALA  24           HB3      ALA  24  56.537  -7.060   4.782
  177   3HB   ALA  24           HB2      ALA  24  55.678  -7.209   6.316
  178    H    ALA  25           HN       ALA  25  58.846  -5.872   4.280
  179    HA   ALA  25           HA       ALA  25  60.310  -8.357   4.719
  180   1HB   ALA  25           HB1      ALA  25  59.640  -7.130   2.468
  181   2HB   ALA  25           HB3      ALA  25  61.182  -6.310   2.712
  182   3HB   ALA  25           HB2      ALA  25  61.131  -8.066   2.566
  183    H    PHE  26           HN       PHE  26  60.824  -4.974   5.405
  184    HA   PHE  26           HA       PHE  26  63.651  -4.926   5.584
  185   1HB   PHE  26           HB2      PHE  26  62.435  -2.861   5.719
  186   2HB   PHE  26           HB1      PHE  26  61.509  -3.428   7.109
  187    HD1  PHE  26           HD1      PHE  26  65.084  -3.027   6.060
  188    HD2  PHE  26           HD2      PHE  26  62.188  -2.731   9.207
  189    HE1  PHE  26           HE1      PHE  26  66.838  -2.150   7.584
  190    HE2  PHE  26           HE2      PHE  26  63.936  -1.853  10.739
  191    HZ   PHE  26           HZ       PHE  26  66.262  -1.563   9.925
  192    H    ASP  27           HN       ASP  27  61.351  -5.277   8.318
  193    HA   ASP  27           HA       ASP  27  63.252  -6.036  10.254
  194   1HB   ASP  27           HB2      ASP  27  61.218  -7.356  11.240
  195   2HB   ASP  27           HB1      ASP  27  61.110  -5.600  11.108
  196    H    MET  28           HN       MET  28  62.066  -7.802   7.540
  197    HA   MET  28           HA       MET  28  62.427 -10.477   8.445
  198   1HB   MET  28           HB2      MET  28  61.739  -9.244   6.044
  199   2HB   MET  28           HB1      MET  28  63.255 -10.065   5.675
  200   1HG   MET  28           HG2      MET  28  61.234 -11.584   7.255
  201   2HG   MET  28           HG1      MET  28  60.897 -11.330   5.543
  202   1HE   MET  28           HE2      MET  28  62.687 -11.277   3.934
  203   2HE   MET  28           HE1      MET  28  64.358 -11.481   4.453
  204   3HE   MET  28           HE3      MET  28  63.538 -12.778   3.572
  205    H    PHE  29           HN       PHE  29  64.722  -8.329   6.724
  206    HA   PHE  29           HA       PHE  29  66.915 -10.225   7.177
  207   1HB   PHE  29           HB2      PHE  29  67.184  -7.371   6.218
  208   2HB   PHE  29           HB1      PHE  29  68.251  -8.737   5.891
  209    HD1  PHE  29           HD1      PHE  29  67.605 -10.494   4.296
  210    HD2  PHE  29           HD2      PHE  29  65.083  -7.095   5.026
  211    HE1  PHE  29           HE1      PHE  29  66.295 -11.029   2.259
  212    HE2  PHE  29           HE2      PHE  29  63.773  -7.629   2.989
  213    HZ   PHE  29           HZ       PHE  29  64.379  -9.597   1.605
  214    H    ASP  30           HN       ASP  30  65.573  -7.427   8.754
  215    HA   ASP  30           HA       ASP  30  67.884  -7.466  10.656
  216   1HB   ASP  30           HB2      ASP  30  67.841  -5.332   9.517
  217   2HB   ASP  30           HB1      ASP  30  66.111  -5.160   9.807
  218    H    ALA  31           HN       ALA  31  66.166  -9.317  11.324
  219    HA   ALA  31           HA       ALA  31  63.737  -8.748  12.579
  220   1HB   ALA  31           HB1      ALA  31  65.886 -10.771  13.048
  221   2HB   ALA  31           HB3      ALA  31  64.630 -10.608  14.274
  222   3HB   ALA  31           HB2      ALA  31  64.194 -11.014  12.615
  223    H    ASP  32           HN       ASP  32  66.675  -9.220  14.556
  224    HA   ASP  32           HA       ASP  32  65.582  -7.300  16.519
  225   1HB   ASP  32           HB2      ASP  32  66.483  -9.328  17.457
  226   2HB   ASP  32           HB1      ASP  32  67.987  -9.143  16.555
  227    H    GLY  33           HN       GLY  33  69.041  -7.566  16.129
  228   1HA   GLY  33           HA2      GLY  33  70.627  -5.876  15.791
  229   2HA   GLY  33           HA1      GLY  33  69.650  -5.499  14.371
  230    H    GLY  34           HN       GLY  34  70.652  -3.312  15.244
  231   1HA   GLY  34           HA2      GLY  34  69.047  -2.112  17.408
  232   2HA   GLY  34           HA1      GLY  34  70.360  -1.321  16.536
  233    H    GLY  35           HN       GLY  35  67.986  -2.952  14.630
  234   1HA   GLY  35           HA2      GLY  35  65.964  -2.024  13.661
  235   2HA   GLY  35           HA1      GLY  35  66.496  -0.419  14.169
  236    H    ASP  36           HN       ASP  36  68.475  -2.833  12.492
  237    HA   ASP  36           HA       ASP  36  68.190  -1.561   9.893
  238   1HB   ASP  36           HB2      ASP  36  70.780  -1.009   9.960
  239   2HB   ASP  36           HB1      ASP  36  69.603   0.163  10.555
  240    H    ILE  37           HN       ILE  37  69.219  -2.807   8.255
  241    HA   ILE  37           HA       ILE  37  70.332  -5.392   9.248
  242    HB   ILE  37           HB       ILE  37  68.608  -6.156   7.986
  243   1HG1  ILE  37          HG12      ILE  37  70.830  -6.573   6.655
  244   2HG1  ILE  37          HG11      ILE  37  69.286  -6.935   5.897
  245   1HG2  ILE  37          HG23      ILE  37  68.764  -3.634   6.316
  246   2HG2  ILE  37          HG22      ILE  37  67.524  -4.881   6.166
  247   3HG2  ILE  37          HG21      ILE  37  67.645  -3.931   7.648
  248   1HD1  ILE  37          HD12      ILE  37  69.327  -4.678   4.821
  249   2HD1  ILE  37          HD11      ILE  37  70.936  -4.420   5.491
  250   3HD1  ILE  37          HD13      ILE  37  70.667  -5.704   4.315
  251    H    SER  38           HN       SER  38  72.115  -6.307   8.026
  252    HA   SER  38           HA       SER  38  74.145  -4.338   7.419
  253   1HB   SER  38           HB2      SER  38  73.987  -7.222   7.731
  254   2HB   SER  38           HB1      SER  38  74.992  -6.791   6.350
  255    HG   SER  38           HG       SER  38  75.262  -6.075   9.066
  256    H    THR  39           HN       THR  39  74.823  -3.576   5.428
  257    HA   THR  39           HA       THR  39  73.056  -3.612   3.208
  258    HB   THR  39           HB       THR  39  74.844  -2.568   1.960
  259    HG1  THR  39           HG1      THR  39  76.478  -3.705   3.971
  260   1HG2  THR  39          HG21      THR  39  74.349  -1.856   4.768
  261   2HG2  THR  39          HG23      THR  39  75.852  -1.196   4.121
  262   3HG2  THR  39          HG22      THR  39  74.320  -0.840   3.325
  263    H    LYS  40           HN       LYS  40  75.579  -5.839   4.171
  264    HA   LYS  40           HA       LYS  40  76.077  -7.150   1.715
  265   1HB   LYS  40           HB2      LYS  40  75.854  -8.486   4.428
  266   2HB   LYS  40           HB1      LYS  40  76.785  -9.052   3.041
  267   1HG   LYS  40           HG2      LYS  40  77.674  -6.436   3.432
  268   2HG   LYS  40           HG1      LYS  40  77.507  -7.083   5.064
  269   1HD   LYS  40           HD2      LYS  40  78.667  -9.156   3.550
  270   2HD   LYS  40           HD1      LYS  40  79.516  -7.687   3.068
  271   1HE   LYS  40           HE2      LYS  40  80.742  -7.980   4.950
  272   2HE   LYS  40           HE1      LYS  40  79.318  -7.390   5.807
  273   1HZ   LYS  40           HZ1      LYS  40  79.261 -10.196   5.094
  274   2HZ   LYS  40           HZ3      LYS  40  80.443  -9.775   6.234
  275   3HZ   LYS  40           HZ2      LYS  40  78.808  -9.432   6.542
  276    H    ALA  41           HN       ALA  41  73.504  -7.717   4.118
  277    HA   ALA  41           HA       ALA  41  72.279  -9.839   2.543
  278   1HB   ALA  41           HB3      ALA  41  72.090  -9.475   5.089
  279   2HB   ALA  41           HB2      ALA  41  70.911  -8.223   4.700
  280   3HB   ALA  41           HB1      ALA  41  70.608  -9.895   4.232
  281    H    LEU  42           HN       LEU  42  72.197  -6.401   2.508
  282    HA   LEU  42           HA       LEU  42  69.594  -5.867   1.555
  283   1HB   LEU  42           HB2      LEU  42  71.854  -4.370   1.981
  284   2HB   LEU  42           HB1      LEU  42  71.740  -4.344   0.221
  285    HG   LEU  42           HG       LEU  42  69.472  -3.494   0.321
  286   1HD1  LEU  42          HD12      LEU  42  69.580  -4.601   2.972
  287   2HD1  LEU  42          HD11      LEU  42  69.139  -2.897   3.078
  288   3HD1  LEU  42          HD13      LEU  42  68.176  -3.997   2.092
  289   1HD2  LEU  42          HD23      LEU  42  71.608  -2.016   0.854
  290   2HD2  LEU  42          HD22      LEU  42  69.988  -1.327   0.972
  291   3HD2  LEU  42          HD21      LEU  42  70.830  -1.857   2.429
  292    H    GLY  43           HN       GLY  43  72.510  -6.830  -0.265
  293   1HA   GLY  43           HA2      GLY  43  71.588  -6.634  -2.881
  294   2HA   GLY  43           HA1      GLY  43  72.634  -7.949  -2.337
  295    H    THR  44           HN       THR  44  70.899  -9.240  -0.552
  296    HA   THR  44           HA       THR  44  69.223 -10.711  -2.419
  297    HB   THR  44           HB       THR  44  69.634 -10.863   0.574
  298    HG1  THR  44           HG1      THR  44  71.295 -11.822  -0.368
  299   1HG2  THR  44          HG21      THR  44  67.704 -12.326  -1.214
  300   2HG2  THR  44          HG23      THR  44  68.364 -13.109   0.222
  301   3HG2  THR  44          HG22      THR  44  67.422 -11.626   0.380
  302    H    VAL  45           HN       VAL  45  68.706  -8.226   0.027
  303    HA   VAL  45           HA       VAL  45  65.899  -8.458   0.333
  304    HB   VAL  45           HB       VAL  45  67.706  -6.027   0.385
  305   1HG1  VAL  45          HG11      VAL  45  64.783  -6.317   1.133
  306   2HG1  VAL  45          HG13      VAL  45  65.789  -4.944   1.596
  307   3HG1  VAL  45          HG12      VAL  45  65.457  -5.260  -0.107
  308   1HG2  VAL  45          HG22      VAL  45  67.088  -8.181   2.215
  309   2HG2  VAL  45          HG21      VAL  45  68.257  -6.875   2.401
  310   3HG2  VAL  45          HG23      VAL  45  66.582  -6.639   2.903
  311    H    MET  46           HN       MET  46  67.787  -6.632  -2.080
  312    HA   MET  46           HA       MET  46  65.581  -5.457  -3.435
  313   1HB   MET  46           HB2      MET  46  68.247  -6.362  -4.568
  314   2HB   MET  46           HB1      MET  46  67.125  -5.253  -5.359
  315   1HG   MET  46           HG2      MET  46  67.349  -3.660  -3.517
  316   2HG   MET  46           HG1      MET  46  68.394  -4.780  -2.645
  317   1HE   MET  46           HE1      MET  46  67.814  -2.312  -5.308
  318   2HE   MET  46           HE3      MET  46  69.284  -2.197  -6.287
  319   3HE   MET  46           HE2      MET  46  68.190  -3.563  -6.492
  320    H    ARG  47           HN       ARG  47  67.368  -8.453  -4.268
  321    HA   ARG  47           HA       ARG  47  65.866  -9.317  -6.435
  322   1HB   ARG  47           HB2      ARG  47  67.841 -10.502  -5.356
  323   2HB   ARG  47           HB1      ARG  47  66.698 -11.168  -4.189
  324   1HG   ARG  47           HG2      ARG  47  65.426 -12.231  -5.972
  325   2HG   ARG  47           HG1      ARG  47  66.448 -11.474  -7.195
  326   1HD   ARG  47           HD2      ARG  47  68.415 -12.677  -6.250
  327   2HD   ARG  47           HD1      ARG  47  67.339 -13.490  -5.113
  328    HE   ARG  47           HE       ARG  47  67.226 -13.858  -8.078
  329   1HH1  ARG  47          HH11      ARG  47  65.074 -14.453  -5.749
  330   2HH1  ARG  47          HH12      ARG  47  65.171 -16.183  -5.767
  331   1HH2  ARG  47          HH21      ARG  47  68.037 -16.265  -7.718
  332   2HH2  ARG  47          HH22      ARG  47  66.849 -17.209  -6.882
  333    H    MET  48           HN       MET  48  64.969  -9.437  -3.014
  334    HA   MET  48           HA       MET  48  62.580 -11.019  -3.435
  335   1HB   MET  48           HB2      MET  48  63.927  -9.716  -1.207
  336   2HB   MET  48           HB1      MET  48  62.179  -9.486  -1.128
  337   1HG   MET  48           HG2      MET  48  62.663 -12.189  -1.906
  338   2HG   MET  48           HG1      MET  48  63.678 -11.841  -0.505
  339   1HE   MET  48           HE3      MET  48  63.298 -11.606   1.416
  340   2HE   MET  48           HE2      MET  48  61.961 -10.722   2.149
  341   3HE   MET  48           HE1      MET  48  61.967 -12.483   2.181
  342    H    LEU  49           HN       LEU  49  62.853  -7.575  -2.462
  343    HA   LEU  49           HA       LEU  49  60.242  -6.776  -2.900
  344   1HB   LEU  49           HB2      LEU  49  62.526  -5.080  -3.907
  345   2HB   LEU  49           HB1      LEU  49  61.029  -4.557  -3.137
  346    HG   LEU  49           HG       LEU  49  63.414  -5.899  -1.860
  347   1HD1  LEU  49          HD12      LEU  49  61.893  -3.318  -1.467
  348   2HD1  LEU  49          HD11      LEU  49  63.015  -3.940  -0.257
  349   3HD1  LEU  49          HD13      LEU  49  63.598  -3.526  -1.869
  350   1HD2  LEU  49          HD22      LEU  49  60.541  -5.835  -0.994
  351   2HD2  LEU  49          HD21      LEU  49  61.734  -7.119  -0.806
  352   3HD2  LEU  49          HD23      LEU  49  61.802  -5.696   0.232
  353    H    GLY  50           HN       GLY  50  62.698  -6.172  -5.432
  354   1HA   GLY  50           HA2      GLY  50  60.630  -6.973  -7.439
  355   2HA   GLY  50           HA1      GLY  50  61.622  -5.534  -7.666
  356    H    GLN  51           HN       GLN  51  63.793  -5.778  -8.309
  357    HA   GLN  51           HA       GLN  51  64.587  -8.577  -9.011
  358   1HB   GLN  51           HB2      GLN  51  65.817  -7.587 -10.930
  359   2HB   GLN  51           HB1      GLN  51  64.086  -7.255 -11.019
  360   1HG   GLN  51           HG2      GLN  51  65.637  -5.242  -9.520
  361   2HG   GLN  51           HG1      GLN  51  66.032  -5.340 -11.235
  362   1HE2  GLN  51          HE22      GLN  51  63.184  -2.993 -11.031
  363   2HE2  GLN  51          HE21      GLN  51  64.821  -3.005 -10.582
  364    H    ASN  52           HN       ASN  52  67.233  -7.952  -9.774
  365    HA   ASN  52           HA       ASN  52  68.439  -6.624  -7.419
  366   1HB   ASN  52           HB2      ASN  52  69.960  -8.570  -7.055
  367   2HB   ASN  52           HB1      ASN  52  68.269  -8.965  -6.738
  368   1HD2  ASN  52          HD22      ASN  52  70.197 -10.710  -9.894
  369   2HD2  ASN  52          HD21      ASN  52  70.928  -9.430  -9.050
  370    HA   PRO  53           HA       PRO  53  71.039  -5.348 -10.796
  371   1HB   PRO  53           HB2      PRO  53  72.666  -3.725  -9.287
  372   2HB   PRO  53           HB1      PRO  53  71.045  -3.256  -9.828
  373   1HG   PRO  53           HG2      PRO  53  71.950  -4.071  -7.107
  374   2HG   PRO  53           HG1      PRO  53  70.591  -3.035  -7.574
  375   1HD   PRO  53           HD2      PRO  53  70.414  -5.749  -6.782
  376   2HD   PRO  53           HD1      PRO  53  69.128  -4.800  -7.558
  377    H    THR  54           HN       THR  54  73.673  -4.995 -10.823
  378    HA   THR  54           HA       THR  54  74.756  -7.650 -10.244
  379    HB   THR  54           HB       THR  54  76.870  -6.626 -11.229
  380    HG1  THR  54           HG1      THR  54  76.880  -4.567 -11.576
  381   1HG2  THR  54          HG22      THR  54  74.488  -7.478 -12.437
  382   2HG2  THR  54          HG21      THR  54  74.940  -6.012 -13.307
  383   3HG2  THR  54          HG23      THR  54  76.073  -7.360 -13.202
  384    H    LYS  55           HN       LYS  55  76.281  -8.150  -8.662
  385    HA   LYS  55           HA       LYS  55  76.293  -6.869  -6.204
  386   1HB   LYS  55           HB2      LYS  55  77.344  -9.097  -6.715
  387   2HB   LYS  55           HB1      LYS  55  78.720  -8.234  -7.401
  388   1HG   LYS  55           HG2      LYS  55  78.857  -6.995  -5.154
  389   2HG   LYS  55           HG1      LYS  55  77.760  -8.232  -4.537
  390   1HD   LYS  55           HD2      LYS  55  79.547  -9.840  -5.729
  391   2HD   LYS  55           HD1      LYS  55  80.609  -8.475  -5.381
  392   1HE   LYS  55           HE2      LYS  55  79.537  -8.575  -2.997
  393   2HE   LYS  55           HE1      LYS  55  79.081 -10.216  -3.460
  394   1HZ   LYS  55           HZ2      LYS  55  81.850  -9.227  -3.772
  395   2HZ   LYS  55           HZ1      LYS  55  81.308  -9.903  -2.311
  396   3HZ   LYS  55           HZ3      LYS  55  81.298 -10.834  -3.728
  397    H    GLU  56           HN       GLU  56  78.168  -6.029  -9.060
  398    HA   GLU  56           HA       GLU  56  80.069  -4.294  -7.863
  399   1HB   GLU  56           HB2      GLU  56  79.074  -4.844 -10.532
  400   2HB   GLU  56           HB1      GLU  56  79.350  -3.116 -10.314
  401   1HG   GLU  56           HG2      GLU  56  81.461  -4.877  -9.217
  402   2HG   GLU  56           HG1      GLU  56  81.315  -4.880 -10.975
  403    H    GLU  57           HN       GLU  57  76.986  -3.347  -9.441
  404    HA   GLU  57           HA       GLU  57  77.051  -0.663  -8.454
  405   1HB   GLU  57           HB2      GLU  57  75.247  -2.326  -9.979
  406   2HB   GLU  57           HB1      GLU  57  74.343  -1.408  -8.775
  407   1HG   GLU  57           HG2      GLU  57  76.424  -0.096 -10.524
  408   2HG   GLU  57           HG1      GLU  57  74.748  -0.264 -11.048
  409    H    LEU  58           HN       LEU  58  76.268  -3.651  -6.928
  410    HA   LEU  58           HA       LEU  58  74.444  -2.684  -4.933
  411   1HB   LEU  58           HB2      LEU  58  75.387  -5.148  -5.615
  412   2HB   LEU  58           HB1      LEU  58  76.310  -4.844  -4.144
  413    HG   LEU  58           HG       LEU  58  73.814  -3.997  -3.398
  414   1HD1  LEU  58          HD11      LEU  58  73.378  -5.389  -5.781
  415   2HD1  LEU  58          HD13      LEU  58  72.992  -6.558  -4.519
  416   3HD1  LEU  58          HD12      LEU  58  72.163  -5.002  -4.563
  417   1HD2  LEU  58          HD23      LEU  58  75.586  -5.741  -2.457
  418   2HD2  LEU  58          HD22      LEU  58  73.910  -5.779  -1.912
  419   3HD2  LEU  58          HD21      LEU  58  74.461  -6.911  -3.147
  420    H    ASP  59           HN       ASP  59  77.956  -3.377  -4.672
  421    HA   ASP  59           HA       ASP  59  78.298  -2.243  -2.098
  422   1HB   ASP  59           HB2      ASP  59  80.006  -3.143  -4.270
  423   2HB   ASP  59           HB1      ASP  59  80.674  -1.710  -3.488
  424    H    ALA  60           HN       ALA  60  78.849  -0.714  -5.294
  425    HA   ALA  60           HA       ALA  60  79.517   1.862  -4.352
  426   1HB   ALA  60           HB2      ALA  60  78.535   0.702  -6.868
  427   2HB   ALA  60           HB1      ALA  60  78.046   2.379  -6.633
  428   3HB   ALA  60           HB3      ALA  60  79.756   1.947  -6.608
  429    H    ILE  61           HN       ILE  61  76.390   0.287  -4.669
  430    HA   ILE  61           HA       ILE  61  74.770   2.629  -4.288
  431    HB   ILE  61           HB       ILE  61  74.376  -0.331  -4.113
  432   1HG1  ILE  61          HG12      ILE  61  73.008   1.979  -5.517
  433   2HG1  ILE  61          HG11      ILE  61  74.070   0.772  -6.243
  434   1HG2  ILE  61          HG23      ILE  61  73.249   0.586  -2.065
  435   2HG2  ILE  61          HG22      ILE  61  72.294   1.635  -3.114
  436   3HG2  ILE  61          HG21      ILE  61  72.126  -0.117  -3.229
  437   1HD1  ILE  61          HD12      ILE  61  71.428   0.130  -4.903
  438   2HD1  ILE  61          HD11      ILE  61  71.641   0.310  -6.643
  439   3HD1  ILE  61          HD13      ILE  61  72.462  -0.994  -5.786
  440    H    ILE  62           HN       ILE  62  76.164   0.255  -2.030
  441    HA   ILE  62           HA       ILE  62  74.958   1.312   0.337
  442    HB   ILE  62           HB       ILE  62  77.663  -0.038   0.096
  443   1HG1  ILE  62          HG12      ILE  62  74.943  -1.306   0.543
  444   2HG1  ILE  62          HG11      ILE  62  75.769  -1.281  -1.017
  445   1HG2  ILE  62          HG23      ILE  62  75.813   0.666   2.327
  446   2HG2  ILE  62          HG22      ILE  62  76.639  -0.890   2.422
  447   3HG2  ILE  62          HG21      ILE  62  77.574   0.600   2.307
  448   1HD1  ILE  62          HD12      ILE  62  77.336  -2.258   1.321
  449   2HD1  ILE  62          HD11      ILE  62  76.057  -3.313   0.720
  450   3HD1  ILE  62          HD13      ILE  62  77.359  -2.804  -0.356
  451    H    GLU  63           HN       GLU  63  77.881   2.197  -1.444
  452    HA   GLU  63           HA       GLU  63  78.960   3.956   0.558
  453   1HB   GLU  63           HB2      GLU  63  79.552   3.213  -2.181
  454   2HB   GLU  63           HB1      GLU  63  79.715   4.956  -1.963
  455   1HG   GLU  63           HG2      GLU  63  80.838   3.558   0.307
  456   2HG   GLU  63           HG1      GLU  63  81.564   2.972  -1.190
  457    H    GLU  64           HN       GLU  64  76.294   4.256  -1.610
  458    HA   GLU  64           HA       GLU  64  76.272   7.217  -1.251
  459   1HB   GLU  64           HB2      GLU  64  74.419   5.613  -3.018
  460   2HB   GLU  64           HB1      GLU  64  74.802   7.332  -3.118
  461   1HG   GLU  64           HG2      GLU  64  77.291   6.255  -3.357
  462   2HG   GLU  64           HG1      GLU  64  76.319   5.000  -4.127
  463    H    VAL  65           HN       VAL  65  74.769   4.309  -0.187
  464    HA   VAL  65           HA       VAL  65  72.319   5.695   0.714
  465    HB   VAL  65           HB       VAL  65  73.205   2.835   1.207
  466   1HG1  VAL  65          HG12      VAL  65  71.064   4.396   2.233
  467   2HG1  VAL  65          HG11      VAL  65  70.367   3.269   1.067
  468   3HG1  VAL  65          HG13      VAL  65  71.320   2.661   2.422
  469   1HG2  VAL  65          HG21      VAL  65  72.310   4.152  -1.197
  470   2HG2  VAL  65          HG23      VAL  65  72.743   2.457  -0.964
  471   3HG2  VAL  65          HG22      VAL  65  71.089   2.994  -0.671
  472    H    ASP  66           HN       ASP  66  75.445   4.866   1.911
  473    HA   ASP  66           HA       ASP  66  74.599   5.059   4.738
  474   1HB   ASP  66           HB2      ASP  66  76.946   4.080   3.286
  475   2HB   ASP  66           HB1      ASP  66  77.373   5.050   4.696
  476    H    GLU  67           HN       GLU  67  73.823   7.361   4.147
  477    HA   GLU  67           HA       GLU  67  75.753   9.425   3.625
  478   1HB   GLU  67           HB2      GLU  67  72.907   9.261   4.367
  479   2HB   GLU  67           HB1      GLU  67  73.726  10.695   4.990
  480   1HG   GLU  67           HG2      GLU  67  74.690  10.897   2.572
  481   2HG   GLU  67           HG1      GLU  67  73.357   9.829   2.131
  482    H    ASP  68           HN       ASP  68  74.656   7.835   6.558
  483    HA   ASP  68           HA       ASP  68  76.097   9.789   8.250
  484   1HB   ASP  68           HB2      ASP  68  75.271   8.215  10.104
  485   2HB   ASP  68           HB1      ASP  68  74.031   9.087   9.204
  486    H    GLY  69           HN       GLY  69  77.029   7.273   6.386
  487   1HA   GLY  69           HA2      GLY  69  78.780   5.699   6.488
  488   2HA   GLY  69           HA1      GLY  69  79.612   6.992   7.352
  489    H    SER  70           HN       SER  70  76.731   5.221   8.428
  490    HA   SER  70           HA       SER  70  78.013   4.696  11.005
  491   1HB   SER  70           HB2      SER  70  75.806   3.438  11.409
  492   2HB   SER  70           HB1      SER  70  75.689   5.174  11.133
  493    HG   SER  70           HG       SER  70  74.288   3.594   9.880
  494    H    GLY  71           HN       GLY  71  77.550   2.997   8.013
  495   1HA   GLY  71           HA2      GLY  71  78.852   1.032   7.462
  496   2HA   GLY  71           HA1      GLY  71  78.975   0.666   9.182
  497    H    THR  72           HN       THR  72  75.837   1.566   8.682
  498    HA   THR  72           HA       THR  72  74.951  -1.147   7.839
  499    HB   THR  72           HB       THR  72  73.192  -0.418   9.896
  500    HG1  THR  72           HG1      THR  72  74.445   0.181  11.558
  501   1HG2  THR  72          HG22      THR  72  74.317  -2.660   9.124
  502   2HG2  THR  72          HG21      THR  72  75.513  -2.263  10.359
  503   3HG2  THR  72          HG23      THR  72  73.820  -2.470  10.805
  504    H    ILE  73           HN       ILE  73  72.442  -1.098   7.595
  505    HA   ILE  73           HA       ILE  73  71.656   1.570   6.489
  506    HB   ILE  73           HB       ILE  73  70.854  -1.180   5.494
  507   1HG1  ILE  73          HG12      ILE  73  73.260  -0.365   5.076
  508   2HG1  ILE  73          HG11      ILE  73  72.322  -0.823   3.656
  509   1HG2  ILE  73          HG22      ILE  73  69.138   0.627   5.233
  510   2HG2  ILE  73          HG21      ILE  73  70.317   1.560   4.313
  511   3HG2  ILE  73          HG23      ILE  73  69.741   0.012   3.695
  512   1HD1  ILE  73          HD12      ILE  73  71.860   1.959   4.296
  513   2HD1  ILE  73          HD11      ILE  73  73.589   1.653   4.132
  514   3HD1  ILE  73          HD13      ILE  73  72.494   1.256   2.807
  515    H    ASP  74           HN       ASP  74  69.636   2.329   7.074
  516    HA   ASP  74           HA       ASP  74  68.105   0.631   9.000
  517   1HB   ASP  74           HB2      ASP  74  67.655   3.583   8.695
  518   2HB   ASP  74           HB1      ASP  74  67.463   2.569  10.126
  519    H    PHE  75           HN       PHE  75  65.737   0.700   8.800
  520    HA   PHE  75           HA       PHE  75  64.668   0.147   6.342
  521   1HB   PHE  75           HB2      PHE  75  63.476   0.043   8.569
  522   2HB   PHE  75           HB1      PHE  75  63.176   1.774   8.413
  523    HD1  PHE  75           HD2      PHE  75  63.223  -0.818   5.742
  524    HD2  PHE  75           HD1      PHE  75  60.842   1.906   8.050
  525    HE1  PHE  75           HE2      PHE  75  61.274  -1.284   4.279
  526    HE2  PHE  75           HE1      PHE  75  58.891   1.441   6.590
  527    HZ   PHE  75           HZ       PHE  75  59.106  -0.154   4.702
  528    H    GLU  76           HN       GLU  76  65.486   3.334   7.539
  529    HA   GLU  76           HA       GLU  76  63.992   4.747   5.470
  530   1HB   GLU  76           HB2      GLU  76  66.259   5.759   7.211
  531   2HB   GLU  76           HB1      GLU  76  65.092   6.742   6.325
  532   1HG   GLU  76           HG2      GLU  76  63.284   5.502   7.679
  533   2HG   GLU  76           HG1      GLU  76  64.604   4.972   8.723
  534    H    GLU  77           HN       GLU  77  67.431   3.951   6.009
  535    HA   GLU  77           HA       GLU  77  68.359   5.195   3.591
  536   1HB   GLU  77           HB2      GLU  77  69.551   2.977   5.277
  537   2HB   GLU  77           HB1      GLU  77  70.398   3.782   3.956
  538   1HG   GLU  77           HG2      GLU  77  70.181   5.940   5.091
  539   2HG   GLU  77           HG1      GLU  77  69.256   5.185   6.391
  540    H    PHE  78           HN       PHE  78  66.918   2.072   4.252
  541    HA   PHE  78           HA       PHE  78  67.840   0.755   1.871
  542   1HB   PHE  78           HB2      PHE  78  67.004  -0.855   3.256
  543   2HB   PHE  78           HB1      PHE  78  65.870   0.255   4.018
  544    HD1  PHE  78           HD2      PHE  78  66.438  -1.905   1.051
  545    HD2  PHE  78           HD1      PHE  78  63.614   0.435   3.280
  546    HE1  PHE  78           HE2      PHE  78  64.587  -2.860  -0.298
  547    HE2  PHE  78           HE1      PHE  78  61.758  -0.520   1.934
  548    HZ   PHE  78           HZ       PHE  78  62.245  -2.167   0.144
  549    H    LEU  79           HN       LEU  79  64.799   2.473   2.649
  550    HA   LEU  79           HA       LEU  79  63.495   2.183   0.183
  551   1HB   LEU  79           HB2      LEU  79  63.569   4.611   2.001
  552   2HB   LEU  79           HB1      LEU  79  62.398   4.364   0.705
  553    HG   LEU  79           HG       LEU  79  62.802   2.373   2.948
  554   1HD1  LEU  79          HD11      LEU  79  60.932   4.742   2.732
  555   2HD1  LEU  79          HD13      LEU  79  60.609   3.375   3.800
  556   3HD1  LEU  79          HD12      LEU  79  62.052   4.362   4.042
  557   1HD2  LEU  79          HD22      LEU  79  60.927   2.721   0.640
  558   2HD2  LEU  79          HD21      LEU  79  61.653   1.246   1.277
  559   3HD2  LEU  79          HD23      LEU  79  60.298   1.998   2.120
  560    H    VAL  80           HN       VAL  80  66.221   4.223   1.041
  561    HA   VAL  80           HA       VAL  80  66.146   5.887  -1.318
  562    HB   VAL  80           HB       VAL  80  68.382   5.146   0.589
  563   1HG1  VAL  80          HG11      VAL  80  68.337   6.956  -1.826
  564   2HG1  VAL  80          HG13      VAL  80  69.460   7.233  -0.495
  565   3HG1  VAL  80          HG12      VAL  80  69.523   5.722  -1.402
  566   1HG2  VAL  80          HG23      VAL  80  66.221   6.728   1.028
  567   2HG2  VAL  80          HG22      VAL  80  67.796   7.017   1.771
  568   3HG2  VAL  80          HG21      VAL  80  67.326   7.907   0.323
  569    H    MET  81           HN       MET  81  67.773   2.841  -0.494
  570    HA   MET  81           HA       MET  81  69.403   2.558  -2.768
  571   1HB   MET  81           HB2      MET  81  69.275   1.044  -0.713
  572   2HB   MET  81           HB1      MET  81  67.887   0.274  -1.487
  573   1HG   MET  81           HG2      MET  81  69.166  -0.572  -3.245
  574   2HG   MET  81           HG1      MET  81  70.436   0.629  -3.028
  575   1HE   MET  81           HE3      MET  81  71.561   1.002  -1.038
  576   2HE   MET  81           HE2      MET  81  71.114   0.181   0.455
  577   3HE   MET  81           HE1      MET  81  72.594  -0.277  -0.383
  578    H    MET  82           HN       MET  82  66.003   1.526  -2.333
  579    HA   MET  82           HA       MET  82  65.687   0.410  -4.937
  580   1HB   MET  82           HB2      MET  82  63.646   1.692  -3.097
  581   2HB   MET  82           HB1      MET  82  63.243   0.757  -4.538
  582   1HG   MET  82           HG2      MET  82  65.102  -0.498  -2.573
  583   2HG   MET  82           HG1      MET  82  63.402  -0.384  -2.120
  584   1HE   MET  82           HE3      MET  82  66.089  -1.851  -3.700
  585   2HE   MET  82           HE2      MET  82  65.523  -3.302  -4.523
  586   3HE   MET  82           HE1      MET  82  65.661  -1.789  -5.415
  587    H    VAL  83           HN       VAL  83  64.373   3.554  -3.820
  588    HA   VAL  83           HA       VAL  83  63.724   4.554  -6.367
  589    HB   VAL  83           HB       VAL  83  64.708   6.112  -3.958
  590   1HG1  VAL  83          HG11      VAL  83  63.826   6.890  -6.638
  591   2HG1  VAL  83          HG13      VAL  83  62.852   7.629  -5.366
  592   3HG1  VAL  83          HG12      VAL  83  64.600   7.863  -5.387
  593   1HG2  VAL  83          HG23      VAL  83  62.655   4.505  -3.799
  594   2HG2  VAL  83          HG22      VAL  83  62.475   6.161  -3.219
  595   3HG2  VAL  83          HG21      VAL  83  61.843   5.707  -4.802
  596    H    ARG  84           HN       ARG  84  66.842   4.072  -4.967
  597    HA   ARG  84           HA       ARG  84  68.303   6.070  -6.417
  598   1HB   ARG  84           HB2      ARG  84  68.951   4.230  -4.498
  599   2HB   ARG  84           HB1      ARG  84  69.687   3.507  -5.929
  600   1HG   ARG  84           HG2      ARG  84  71.379   4.979  -5.787
  601   2HG   ARG  84           HG1      ARG  84  70.231   6.297  -6.021
  602   1HD   ARG  84           HD2      ARG  84  69.930   5.408  -3.341
  603   2HD   ARG  84           HD1      ARG  84  71.660   5.579  -3.635
  604    HE   ARG  84           HE       ARG  84  69.697   7.759  -3.595
  605   1HH1  ARG  84          HH11      ARG  84  72.308   6.875  -5.541
  606   2HH1  ARG  84          HH12      ARG  84  73.205   8.334  -5.292
  607   1HH2  ARG  84          HH21      ARG  84  71.058   9.550  -2.855
  608   2HH2  ARG  84          HH22      ARG  84  72.497   9.850  -3.772
  609    H    GLN  85           HN       GLN  85  68.106   2.548  -7.073
  610    HA   GLN  85           HA       GLN  85  69.174   2.826  -9.735
  611   1HB   GLN  85           HB2      GLN  85  67.796   0.631  -8.214
  612   2HB   GLN  85           HB1      GLN  85  68.054   0.458  -9.950
  613   1HG   GLN  85           HG2      GLN  85  70.315   1.276  -8.133
  614   2HG   GLN  85           HG1      GLN  85  69.902  -0.425  -8.351
  615   1HE2  GLN  85          HE22      GLN  85  71.674  -0.590 -11.377
  616   2HE2  GLN  85          HE21      GLN  85  71.119  -1.378  -9.980
  617    H    MET  86           HN       MET  86  66.175   3.677  -8.477
  618    HA   MET  86           HA       MET  86  64.726   3.128 -11.010
  619   1HB   MET  86           HB2      MET  86  63.809   4.227  -8.338
  620   2HB   MET  86           HB1      MET  86  62.754   4.042  -9.739
  621   1HG   MET  86           HG2      MET  86  62.775   1.732  -9.626
  622   2HG   MET  86           HG1      MET  86  64.370   1.678  -8.877
  623   1HE   MET  86           HE2      MET  86  61.146   3.584  -8.343
  624   2HE   MET  86           HE1      MET  86  60.479   1.954  -8.270
  625   3HE   MET  86           HE3      MET  86  60.474   2.983  -6.831
  626    H    LYS  87           HN       LYS  87  66.931   5.175 -10.673
  627    HA   LYS  87           HA       LYS  87  65.513   7.360 -12.036
  628   1HB   LYS  87           HB2      LYS  87  66.821   7.688  -9.333
  629   2HB   LYS  87           HB1      LYS  87  66.637   9.047 -10.442
  630   1HG   LYS  87           HG2      LYS  87  64.186   8.574 -10.551
  631   2HG   LYS  87           HG1      LYS  87  64.411   7.313  -9.336
  632   1HD   LYS  87           HD2      LYS  87  63.947   9.020  -7.885
  633   2HD   LYS  87           HD1      LYS  87  65.661   9.378  -8.102
  634   1HE   LYS  87           HE2      LYS  87  64.921  11.439  -8.720
  635   2HE   LYS  87           HE1      LYS  87  64.577  10.658 -10.263
  636   1HZ   LYS  87           HZ1      LYS  87  62.343  10.155  -9.440
  637   2HZ   LYS  87           HZ3      LYS  87  62.682  10.984  -8.000
  638   3HZ   LYS  87           HZ2      LYS  87  62.641  11.826  -9.474
  639    H    GLU  88           HN       GLU  88  67.600   5.403 -12.710
  640    HA   GLU  88           HA       GLU  88  69.753   7.346 -13.427
  641   1HB   GLU  88           HB2      GLU  88  70.260   5.536 -11.563
  642   2HB   GLU  88           HB1      GLU  88  70.425   4.463 -12.952
  643   1HG   GLU  88           HG2      GLU  88  72.478   5.284 -13.352
  644   2HG   GLU  88           HG1      GLU  88  71.792   6.897 -13.557
  645    H    ASP  89           HN       ASP  89  68.857   7.565 -15.535
  646    HA   ASP  89           HA       ASP  89  68.388   6.924 -17.749
  647   1HB   ASP  89           HB2      ASP  89  70.712   5.112 -17.054
  648   2HB   ASP  89           HB1      ASP  89  70.085   5.319 -18.690
  649    H    ALA  90           HN       ALA  90  69.465   3.674 -17.231
  650    HA   ALA  90           HA       ALA  90  66.751   2.699 -17.810
  651   1HB   ALA  90           HB1      ALA  90  69.499   1.564 -17.820
  652   2HB   ALA  90           HB3      ALA  90  68.193   0.439 -17.451
  653   3HB   ALA  90           HB2      ALA  90  68.183   1.333 -18.970
   
  No H/Q in entry =         653
  Start of MODEL   22
    1   1H    ALA   1           HT3      ALA   1  73.766  15.843   7.698
    2   2H    ALA   1           HT2      ALA   1  74.819  17.126   7.338
    3   3H    ALA   1           HT1      ALA   1  75.258  15.963   8.495
    4    HA   ALA   1           HA       ALA   1  74.077  16.914  10.127
    5   1HB   ALA   1           HB1      ALA   1  74.494  19.029   8.034
    6   2HB   ALA   1           HB3      ALA   1  73.625  19.433   9.515
    7   3HB   ALA   1           HB2      ALA   1  75.285  18.842   9.599
    8    H    SER   2           HN       SER   2  71.995  17.311  10.934
    9    HA   SER   2           HA       SER   2  69.649  17.294  10.921
   10   1HB   SER   2           HB2      SER   2  70.268  19.380   9.432
   11   2HB   SER   2           HB1      SER   2  69.678  18.367   8.117
   12    HG   SER   2           HG       SER   2  68.277  19.004  10.507
   13    H    MET   3           HN       MET   3  67.937  16.905   8.617
   14    HA   MET   3           HA       MET   3  68.414  14.011   8.235
   15   1HB   MET   3           HB2      MET   3  66.102  14.140   7.155
   16   2HB   MET   3           HB1      MET   3  66.169  14.541   8.872
   17   1HG   MET   3           HG2      MET   3  66.658  16.867   7.169
   18   2HG   MET   3           HG1      MET   3  65.077  16.138   6.874
   19   1HE   MET   3           HE2      MET   3  66.435  18.698   7.945
   20   2HE   MET   3           HE1      MET   3  64.835  19.231   8.455
   21   3HE   MET   3           HE3      MET   3  66.155  19.132   9.628
   22    H    THR   4           HN       THR   4  69.489  13.352   6.445
   23    HA   THR   4           HA       THR   4  70.301  15.018   4.317
   24    HB   THR   4           HB       THR   4  70.777  12.925   3.088
   25    HG1  THR   4           HG1      THR   4  68.863  11.836   3.721
   26   1HG2  THR   4          HG23      THR   4  71.837  13.730   5.520
   27   2HG2  THR   4          HG22      THR   4  71.508  12.015   5.770
   28   3HG2  THR   4          HG21      THR   4  72.543  12.529   4.439
   29    H    ASP   5           HN       ASP   5  69.278  15.745   2.495
   30    HA   ASP   5           HA       ASP   5  66.427  15.427   2.223
   31   1HB   ASP   5           HB2      ASP   5  68.477  16.485   0.252
   32   2HB   ASP   5           HB1      ASP   5  66.730  16.669   0.096
   33    H    GLN   6           HN       GLN   6  69.021  13.431   1.335
   34    HA   GLN   6           HA       GLN   6  68.183  12.333  -1.135
   35   1HB   GLN   6           HB2      GLN   6  69.389  10.737   1.139
   36   2HB   GLN   6           HB1      GLN   6  69.542  10.431  -0.594
   37   1HG   GLN   6           HG2      GLN   6  70.665  12.707  -0.777
   38   2HG   GLN   6           HG1      GLN   6  70.724  12.727   0.986
   39   1HE2  GLN   6          HE22      GLN   6  72.763   9.516   0.698
   40   2HE2  GLN   6          HE21      GLN   6  71.161   9.784   1.192
   41    H    GLN   7           HN       GLN   7  67.342  11.289   2.183
   42    HA   GLN   7           HA       GLN   7  65.450   9.300   1.231
   43   1HB   GLN   7           HB2      GLN   7  64.809   9.120   3.613
   44   2HB   GLN   7           HB1      GLN   7  66.564   9.076   3.422
   45   1HG   GLN   7           HG2      GLN   7  66.108  11.769   3.663
   46   2HG   GLN   7           HG1      GLN   7  64.866  11.104   4.725
   47   1HE2  GLN   7          HE22      GLN   7  67.790   9.209   6.355
   48   2HE2  GLN   7          HE21      GLN   7  66.616   8.663   5.257
   49    H    ALA   8           HN       ALA   8  65.319  12.703   1.906
   50    HA   ALA   8           HA       ALA   8  62.481  12.898   2.375
   51   1HB   ALA   8           HB2      ALA   8  64.637  14.832   1.568
   52   2HB   ALA   8           HB1      ALA   8  62.946  15.329   1.511
   53   3HB   ALA   8           HB3      ALA   8  63.661  14.809   3.037
   54    H    GLU   9           HN       GLU   9  64.439  12.610  -0.503
   55    HA   GLU   9           HA       GLU   9  62.237  13.433  -2.275
   56   1HB   GLU   9           HB2      GLU   9  64.506  13.966  -2.975
   57   2HB   GLU   9           HB1      GLU   9  64.980  12.270  -2.848
   58   1HG   GLU   9           HG2      GLU   9  63.962  11.699  -4.813
   59   2HG   GLU   9           HG1      GLU   9  62.626  12.824  -4.567
   60    H    ALA  10           HN       ALA  10  64.052  10.419  -1.611
   61    HA   ALA  10           HA       ALA  10  62.589   8.693  -3.283
   62   1HB   ALA  10           HB2      ALA  10  64.649   8.232  -1.734
   63   2HB   ALA  10           HB1      ALA  10  63.429   7.809  -0.532
   64   3HB   ALA  10           HB3      ALA  10  63.512   6.922  -2.055
   65    H    ARG  11           HN       ARG  11  61.965   9.340   0.187
   66    HA   ARG  11           HA       ARG  11  59.517   7.892   0.304
   67   1HB   ARG  11           HB2      ARG  11  60.465  10.280   1.914
   68   2HB   ARG  11           HB1      ARG  11  59.045   9.313   2.317
   69   1HG   ARG  11           HG2      ARG  11  60.370   7.348   2.669
   70   2HG   ARG  11           HG1      ARG  11  61.796   8.107   1.963
   71   1HD   ARG  11           HD2      ARG  11  61.868   8.058   4.460
   72   2HD   ARG  11           HD1      ARG  11  61.919   9.695   3.809
   73    HE   ARG  11           HE       ARG  11  59.651  10.027   4.574
   74   1HH1  ARG  11          HH11      ARG  11  57.719   8.448   4.842
   75   2HH1  ARG  11          HH12      ARG  11  57.931   7.357   6.170
   76   1HH2  ARG  11          HH21      ARG  11  61.335   7.951   6.459
   77   2HH2  ARG  11          HH22      ARG  11  59.978   7.075   7.086
   78    H    ALA  12           HN       ALA  12  60.274  11.086  -0.901
   79    HA   ALA  12           HA       ALA  12  57.629  12.183  -0.857
   80   1HB   ALA  12           HB1      ALA  12  60.179  12.988  -1.775
   81   2HB   ALA  12           HB3      ALA  12  59.109  13.064  -3.173
   82   3HB   ALA  12           HB2      ALA  12  58.711  13.963  -1.710
   83    H    PHE  13           HN       PHE  13  59.347  10.178  -3.233
   84    HA   PHE  13           HA       PHE  13  57.012  10.205  -5.036
   85   1HB   PHE  13           HB2      PHE  13  59.173  10.206  -6.112
   86   2HB   PHE  13           HB1      PHE  13  59.701   8.814  -5.165
   87    HD1  PHE  13           HD1      PHE  13  56.876   9.800  -7.439
   88    HD2  PHE  13           HD2      PHE  13  59.578   6.714  -6.161
   89    HE1  PHE  13           HE1      PHE  13  55.946   8.274  -9.158
   90    HE2  PHE  13           HE2      PHE  13  58.646   5.188  -7.880
   91    HZ   PHE  13           HZ       PHE  13  56.829   5.967  -9.378
   92    H    LEU  14           HN       LEU  14  58.182   8.373  -2.391
   93    HA   LEU  14           HA       LEU  14  56.694   5.941  -3.194
   94   1HB   LEU  14           HB2      LEU  14  58.308   6.532  -0.693
   95   2HB   LEU  14           HB1      LEU  14  57.636   4.963  -1.137
   96    HG   LEU  14           HG       LEU  14  59.564   6.494  -2.898
   97   1HD1  LEU  14          HD13      LEU  14  60.359   5.669  -0.517
   98   2HD1  LEU  14          HD12      LEU  14  60.348   4.084  -1.291
   99   3HD1  LEU  14          HD11      LEU  14  61.364   5.373  -1.936
  100   1HD2  LEU  14          HD23      LEU  14  57.883   4.431  -3.513
  101   2HD2  LEU  14          HD22      LEU  14  59.428   4.707  -4.315
  102   3HD2  LEU  14          HD21      LEU  14  59.315   3.546  -2.993
  103    H    SER  15           HN       SER  15  54.612   5.648  -2.567
  104    HA   SER  15           HA       SER  15  53.400   7.560  -0.682
  105   1HB   SER  15           HB2      SER  15  51.470   5.662  -1.329
  106   2HB   SER  15           HB1      SER  15  51.705   7.210  -2.138
  107    HG   SER  15           HG       SER  15  51.812   5.568  -3.657
  108    H    GLU  16           HN       GLU  16  52.286   6.867   1.256
  109    HA   GLU  16           HA       GLU  16  53.700   4.966   2.829
  110   1HB   GLU  16           HB2      GLU  16  50.821   5.662   3.371
  111   2HB   GLU  16           HB1      GLU  16  52.133   5.415   4.523
  112   1HG   GLU  16           HG2      GLU  16  53.208   7.486   3.308
  113   2HG   GLU  16           HG1      GLU  16  51.548   7.809   2.809
  114    H    GLU  17           HN       GLU  17  51.211   4.538   0.480
  115    HA   GLU  17           HA       GLU  17  50.119   2.063   1.479
  116   1HB   GLU  17           HB2      GLU  17  49.606   3.785  -0.675
  117   2HB   GLU  17           HB1      GLU  17  50.089   2.261  -1.420
  118   1HG   GLU  17           HG2      GLU  17  48.375   1.048  -0.306
  119   2HG   GLU  17           HG1      GLU  17  48.071   2.366   0.826
  120    H    MET  18           HN       MET  18  52.872   2.864  -0.593
  121    HA   MET  18           HA       MET  18  53.411  -0.007  -1.073
  122   1HB   MET  18           HB2      MET  18  54.357   2.570  -2.203
  123   2HB   MET  18           HB1      MET  18  55.543   1.266  -2.156
  124   1HG   MET  18           HG2      MET  18  53.247  -0.004  -3.053
  125   2HG   MET  18           HG1      MET  18  53.176   1.565  -3.854
  126   1HE   MET  18           HE2      MET  18  53.430   1.502  -5.777
  127   2HE   MET  18           HE1      MET  18  55.043   1.797  -6.419
  128   3HE   MET  18           HE3      MET  18  54.213   0.272  -6.765
  129    H    ILE  19           HN       ILE  19  55.132   2.796   0.348
  130    HA   ILE  19           HA       ILE  19  57.416   1.561   1.309
  131    HB   ILE  19           HB       ILE  19  55.681   3.574   2.769
  132   1HG1  ILE  19          HG12      ILE  19  58.032   3.842   0.872
  133   2HG1  ILE  19          HG11      ILE  19  56.377   4.378   0.584
  134   1HG2  ILE  19          HG21      ILE  19  57.348   2.382   4.219
  135   2HG2  ILE  19          HG23      ILE  19  58.624   2.939   3.136
  136   3HG2  ILE  19          HG22      ILE  19  57.673   4.106   4.054
  137   1HD1  ILE  19          HD12      ILE  19  56.692   5.790   2.741
  138   2HD1  ILE  19          HD11      ILE  19  58.415   5.515   2.486
  139   3HD1  ILE  19          HD13      ILE  19  57.464   6.351   1.259
  140    H    ALA  20           HN       ALA  20  54.131   1.137   2.454
  141    HA   ALA  20           HA       ALA  20  54.791  -0.107   4.967
  142   1HB   ALA  20           HB1      ALA  20  52.457   0.698   3.739
  143   2HB   ALA  20           HB3      ALA  20  52.336  -1.059   3.657
  144   3HB   ALA  20           HB2      ALA  20  52.540  -0.262   5.217
  145    H    GLU  21           HN       GLU  21  53.957  -1.464   1.765
  146    HA   GLU  21           HA       GLU  21  54.224  -4.200   2.474
  147   1HB   GLU  21           HB2      GLU  21  54.470  -2.664  -0.095
  148   2HB   GLU  21           HB1      GLU  21  54.921  -4.368  -0.063
  149   1HG   GLU  21           HG2      GLU  21  52.765  -5.077   0.297
  150   2HG   GLU  21           HG1      GLU  21  52.334  -3.636   1.219
  151    H    PHE  22           HN       PHE  22  56.657  -1.849   1.376
  152    HA   PHE  22           HA       PHE  22  58.824  -3.728   1.214
  153   1HB   PHE  22           HB2      PHE  22  58.767  -0.729   1.640
  154   2HB   PHE  22           HB1      PHE  22  60.255  -1.649   1.424
  155    HD1  PHE  22           HD1      PHE  22  60.221  -3.322  -0.659
  156    HD2  PHE  22           HD2      PHE  22  57.755   0.172  -0.255
  157    HE1  PHE  22           HE1      PHE  22  59.902  -3.264  -3.118
  158    HE2  PHE  22           HE2      PHE  22  57.436   0.230  -2.714
  159    HZ   PHE  22           HZ       PHE  22  58.510  -1.487  -4.146
  160    H    LYS  23           HN       LYS  23  57.367  -1.959   3.866
  161    HA   LYS  23           HA       LYS  23  59.513  -2.265   5.751
  162   1HB   LYS  23           HB2      LYS  23  57.337  -0.805   5.870
  163   2HB   LYS  23           HB1      LYS  23  56.623  -2.252   6.583
  164   1HG   LYS  23           HG2      LYS  23  59.263  -1.514   7.681
  165   2HG   LYS  23           HG1      LYS  23  57.975  -0.355   8.013
  166   1HD   LYS  23           HD2      LYS  23  56.770  -1.844   9.292
  167   2HD   LYS  23           HD1      LYS  23  57.352  -3.247   8.393
  168   1HE   LYS  23           HE2      LYS  23  59.092  -3.550   9.803
  169   2HE   LYS  23           HE1      LYS  23  59.509  -1.838   9.773
  170   1HZ   LYS  23           HZ2      LYS  23  57.641  -1.448  11.316
  171   2HZ   LYS  23           HZ1      LYS  23  57.406  -3.128  11.423
  172   3HZ   LYS  23           HZ3      LYS  23  58.853  -2.438  11.977
  173    H    ALA  24           HN       ALA  24  57.521  -4.573   4.303
  174    HA   ALA  24           HA       ALA  24  57.417  -6.392   6.607
  175   1HB   ALA  24           HB3      ALA  24  55.777  -6.176   4.520
  176   2HB   ALA  24           HB2      ALA  24  56.913  -7.322   3.807
  177   3HB   ALA  24           HB1      ALA  24  56.061  -7.737   5.295
  178    H    ALA  25           HN       ALA  25  59.311  -6.005   3.638
  179    HA   ALA  25           HA       ALA  25  60.788  -8.489   4.045
  180   1HB   ALA  25           HB3      ALA  25  61.320  -6.104   2.248
  181   2HB   ALA  25           HB2      ALA  25  62.233  -7.611   2.206
  182   3HB   ALA  25           HB1      ALA  25  60.520  -7.606   1.784
  183    H    PHE  26           HN       PHE  26  61.100  -5.174   5.072
  184    HA   PHE  26           HA       PHE  26  63.886  -5.084   5.621
  185   1HB   PHE  26           HB2      PHE  26  62.091  -3.212   5.792
  186   2HB   PHE  26           HB1      PHE  26  61.833  -3.815   7.430
  187    HD1  PHE  26           HD1      PHE  26  64.645  -2.860   5.130
  188    HD2  PHE  26           HD2      PHE  26  63.137  -2.943   9.152
  189    HE1  PHE  26           HE1      PHE  26  66.645  -1.616   5.907
  190    HE2  PHE  26           HE2      PHE  26  65.138  -1.699   9.927
  191    HZ   PHE  26           HZ       PHE  26  66.891  -1.035   8.304
  192    H    ASP  27           HN       ASP  27  61.240  -5.816   7.927
  193    HA   ASP  27           HA       ASP  27  62.894  -6.652  10.061
  194   1HB   ASP  27           HB2      ASP  27  60.850  -8.017  10.756
  195   2HB   ASP  27           HB1      ASP  27  60.576  -6.292  10.507
  196    H    MET  28           HN       MET  28  62.323  -8.205   7.051
  197    HA   MET  28           HA       MET  28  62.682 -10.934   7.931
  198   1HB   MET  28           HB2      MET  28  63.143  -9.665   5.214
  199   2HB   MET  28           HB1      MET  28  63.107 -11.401   5.528
  200   1HG   MET  28           HG2      MET  28  60.777 -10.937   6.585
  201   2HG   MET  28           HG1      MET  28  60.850  -9.415   5.696
  202   1HE   MET  28           HE3      MET  28  62.284  -9.631   3.504
  203   2HE   MET  28           HE2      MET  28  62.852 -11.257   3.137
  204   3HE   MET  28           HE1      MET  28  61.608 -10.520   2.132
  205    H    PHE  29           HN       PHE  29  64.900  -8.377   6.887
  206    HA   PHE  29           HA       PHE  29  67.175 -10.269   7.265
  207   1HB   PHE  29           HB2      PHE  29  67.661  -7.496   6.299
  208   2HB   PHE  29           HB1      PHE  29  68.384  -9.013   5.770
  209    HD1  PHE  29           HD1      PHE  29  66.763 -10.686   4.544
  210    HD2  PHE  29           HD2      PHE  29  66.047  -6.472   4.958
  211    HE1  PHE  29           HE1      PHE  29  65.191 -10.767   2.627
  212    HE2  PHE  29           HE2      PHE  29  64.474  -6.551   3.039
  213    HZ   PHE  29           HZ       PHE  29  64.047  -8.698   1.874
  214    H    ASP  30           HN       ASP  30  65.459  -8.517   9.276
  215    HA   ASP  30           HA       ASP  30  67.609  -6.913  10.496
  216   1HB   ASP  30           HB2      ASP  30  65.922  -6.225  12.105
  217   2HB   ASP  30           HB1      ASP  30  65.225  -6.136  10.487
  218    H    ALA  31           HN       ALA  31  68.759  -9.206  10.585
  219    HA   ALA  31           HA       ALA  31  68.036 -11.162  12.487
  220   1HB   ALA  31           HB2      ALA  31  69.957 -11.270  10.830
  221   2HB   ALA  31           HB1      ALA  31  70.874 -10.254  11.944
  222   3HB   ALA  31           HB3      ALA  31  70.338 -11.855  12.449
  223    H    ASP  32           HN       ASP  32  70.039  -8.231  12.952
  224    HA   ASP  32           HA       ASP  32  70.386  -8.674  15.783
  225   1HB   ASP  32           HB2      ASP  32  71.025  -6.563  13.830
  226   2HB   ASP  32           HB1      ASP  32  70.679  -5.957  15.450
  227    H    GLY  33           HN       GLY  33  67.940  -7.067  13.834
  228   1HA   GLY  33           HA2      GLY  33  65.750  -6.460  14.492
  229   2HA   GLY  33           HA1      GLY  33  66.134  -6.996  16.128
  230    H    GLY  34           HN       GLY  34  68.567  -4.961  15.053
  231   1HA   GLY  34           HA2      GLY  34  67.772  -2.861  16.893
  232   2HA   GLY  34           HA1      GLY  34  69.192  -2.832  15.847
  233    H    GLY  35           HN       GLY  35  66.800  -3.572  13.774
  234   1HA   GLY  35           HA2      GLY  35  65.212  -2.250  12.547
  235   2HA   GLY  35           HA1      GLY  35  65.753  -0.824  13.433
  236    H    ASP  36           HN       ASP  36  68.076  -3.019  12.024
  237    HA   ASP  36           HA       ASP  36  68.374  -1.543   9.535
  238   1HB   ASP  36           HB2      ASP  36  70.758  -0.798  10.179
  239   2HB   ASP  36           HB1      ASP  36  69.422   0.149  10.831
  240    H    ILE  37           HN       ILE  37  69.266  -2.965   8.098
  241    HA   ILE  37           HA       ILE  37  70.727  -5.299   9.245
  242    HB   ILE  37           HB       ILE  37  69.445  -6.592   7.931
  243   1HG1  ILE  37          HG12      ILE  37  71.215  -6.115   6.168
  244   2HG1  ILE  37          HG11      ILE  37  69.643  -6.607   5.540
  245   1HG2  ILE  37          HG23      ILE  37  67.788  -4.718   8.260
  246   2HG2  ILE  37          HG22      ILE  37  68.259  -4.110   6.673
  247   3HG2  ILE  37          HG21      ILE  37  67.509  -5.699   6.821
  248   1HD1  ILE  37          HD13      ILE  37  69.543  -3.791   5.838
  249   2HD1  ILE  37          HD12      ILE  37  71.083  -4.160   5.065
  250   3HD1  ILE  37          HD11      ILE  37  69.574  -4.711   4.333
  251    H    SER  38           HN       SER  38  72.749  -5.871   8.393
  252    HA   SER  38           HA       SER  38  74.427  -3.782   7.460
  253   1HB   SER  38           HB2      SER  38  75.249  -5.893   8.510
  254   2HB   SER  38           HB1      SER  38  74.806  -6.765   7.047
  255    HG   SER  38           HG       SER  38  76.837  -6.240   6.615
  256    H    THR  39           HN       THR  39  75.193  -3.280   5.350
  257    HA   THR  39           HA       THR  39  73.286  -3.639   3.229
  258    HB   THR  39           HB       THR  39  74.709  -2.316   1.914
  259    HG1  THR  39           HG1      THR  39  76.892  -3.048   3.555
  260   1HG2  THR  39          HG22      THR  39  74.468  -1.687   4.692
  261   2HG2  THR  39          HG21      THR  39  76.053  -1.144   4.141
  262   3HG2  THR  39          HG23      THR  39  74.595  -0.577   3.329
  263    H    LYS  40           HN       LYS  40  75.694  -5.683   4.462
  264    HA   LYS  40           HA       LYS  40  76.557  -7.001   2.067
  265   1HB   LYS  40           HB2      LYS  40  77.330  -8.766   3.510
  266   2HB   LYS  40           HB1      LYS  40  77.575  -7.253   4.383
  267   1HG   LYS  40           HG2      LYS  40  75.255  -7.664   5.413
  268   2HG   LYS  40           HG1      LYS  40  75.402  -9.309   4.794
  269   1HD   LYS  40           HD2      LYS  40  77.771  -8.300   6.251
  270   2HD   LYS  40           HD1      LYS  40  76.324  -8.530   7.236
  271   1HE   LYS  40           HE2      LYS  40  76.918 -10.712   7.323
  272   2HE   LYS  40           HE1      LYS  40  76.367 -10.802   5.650
  273   1HZ   LYS  40           HZ2      LYS  40  78.978  -9.715   5.784
  274   2HZ   LYS  40           HZ1      LYS  40  78.929 -11.212   6.585
  275   3HZ   LYS  40           HZ3      LYS  40  78.436 -11.102   4.966
  276    H    ALA  41           HN       ALA  41  73.728  -7.380   4.145
  277    HA   ALA  41           HA       ALA  41  72.789  -9.707   2.589
  278   1HB   ALA  41           HB2      ALA  41  72.480  -9.240   5.168
  279   2HB   ALA  41           HB1      ALA  41  71.107  -8.276   4.624
  280   3HB   ALA  41           HB3      ALA  41  71.178  -9.998   4.252
  281    H    LEU  42           HN       LEU  42  72.636  -6.329   2.374
  282    HA   LEU  42           HA       LEU  42  70.035  -5.755   1.522
  283   1HB   LEU  42           HB2      LEU  42  72.642  -4.555   1.229
  284   2HB   LEU  42           HB1      LEU  42  71.766  -4.425  -0.294
  285    HG   LEU  42           HG       LEU  42  71.157  -2.482   0.929
  286   1HD1  LEU  42          HD12      LEU  42  69.260  -4.282   0.162
  287   2HD1  LEU  42          HD11      LEU  42  68.845  -4.073   1.864
  288   3HD1  LEU  42          HD13      LEU  42  68.893  -2.676   0.789
  289   1HD2  LEU  42          HD23      LEU  42  71.376  -4.331   3.215
  290   2HD2  LEU  42          HD22      LEU  42  71.691  -2.597   3.133
  291   3HD2  LEU  42          HD21      LEU  42  70.041  -3.185   3.336
  292    H    GLY  43           HN       GLY  43  72.742  -6.797  -0.585
  293   1HA   GLY  43           HA2      GLY  43  71.463  -7.025  -3.018
  294   2HA   GLY  43           HA1      GLY  43  72.664  -8.202  -2.484
  295    H    THR  44           HN       THR  44  71.208  -9.288  -0.291
  296    HA   THR  44           HA       THR  44  69.565 -11.213  -1.668
  297    HB   THR  44           HB       THR  44  69.654 -10.598   1.301
  298    HG1  THR  44           HG1      THR  44  71.455 -11.702   1.363
  299   1HG2  THR  44          HG21      THR  44  68.161 -12.462  -0.283
  300   2HG2  THR  44          HG23      THR  44  69.319 -13.357   0.701
  301   3HG2  THR  44          HG22      THR  44  68.164 -12.269   1.469
  302    H    VAL  45           HN       VAL  45  68.825  -8.458   0.461
  303    HA   VAL  45           HA       VAL  45  66.040  -8.694   0.615
  304    HB   VAL  45           HB       VAL  45  67.655  -6.149   0.255
  305   1HG1  VAL  45          HG11      VAL  45  64.807  -6.727   0.869
  306   2HG1  VAL  45          HG13      VAL  45  65.582  -5.490   1.860
  307   3HG1  VAL  45          HG12      VAL  45  65.531  -5.310   0.107
  308   1HG2  VAL  45          HG21      VAL  45  67.133  -7.989   2.551
  309   2HG2  VAL  45          HG23      VAL  45  68.577  -7.050   2.174
  310   3HG2  VAL  45          HG22      VAL  45  67.169  -6.257   2.879
  311    H    MET  46           HN       MET  46  67.773  -6.678  -1.782
  312    HA   MET  46           HA       MET  46  65.573  -6.118  -3.439
  313   1HB   MET  46           HB2      MET  46  68.474  -6.552  -4.212
  314   2HB   MET  46           HB1      MET  46  67.260  -5.818  -5.261
  315   1HG   MET  46           HG2      MET  46  66.933  -3.987  -3.719
  316   2HG   MET  46           HG1      MET  46  67.949  -4.766  -2.505
  317   1HE   MET  46           HE3      MET  46  67.684  -2.028  -4.180
  318   2HE   MET  46           HE2      MET  46  68.974  -1.831  -2.996
  319   3HE   MET  46           HE1      MET  46  69.282  -1.472  -4.694
  320    H    ARG  47           HN       ARG  47  67.399  -9.078  -3.115
  321    HA   ARG  47           HA       ARG  47  66.625 -10.283  -5.605
  322   1HB   ARG  47           HB2      ARG  47  68.459 -11.120  -4.102
  323   2HB   ARG  47           HB1      ARG  47  67.218 -11.687  -2.984
  324   1HG   ARG  47           HG2      ARG  47  67.273 -13.610  -4.184
  325   2HG   ARG  47           HG1      ARG  47  66.350 -12.715  -5.390
  326   1HD   ARG  47           HD2      ARG  47  68.151 -12.461  -6.783
  327   2HD   ARG  47           HD1      ARG  47  69.297 -12.343  -5.449
  328    HE   ARG  47           HE       ARG  47  68.084 -14.984  -6.116
  329   1HH1  ARG  47          HH11      ARG  47  70.523 -13.648  -4.371
  330   2HH1  ARG  47          HH12      ARG  47  71.817 -14.544  -5.095
  331   1HH2  ARG  47          HH21      ARG  47  69.859 -15.814  -7.660
  332   2HH2  ARG  47          HH22      ARG  47  71.441 -15.769  -6.957
  333    H    MET  48           HN       MET  48  65.185 -10.384  -2.340
  334    HA   MET  48           HA       MET  48  63.006 -12.112  -3.134
  335   1HB   MET  48           HB2      MET  48  63.980 -10.987  -0.720
  336   2HB   MET  48           HB1      MET  48  62.306 -10.453  -0.890
  337   1HG   MET  48           HG2      MET  48  61.570 -12.762  -1.225
  338   2HG   MET  48           HG1      MET  48  63.239 -13.326  -1.154
  339   1HE   MET  48           HE1      MET  48  64.740 -13.307   0.819
  340   2HE   MET  48           HE3      MET  48  64.550 -11.559   1.028
  341   3HE   MET  48           HE2      MET  48  64.378 -12.640   2.408
  342    H    LEU  49           HN       LEU  49  63.159  -8.589  -2.465
  343    HA   LEU  49           HA       LEU  49  60.540  -7.876  -3.024
  344   1HB   LEU  49           HB2      LEU  49  62.821  -6.297  -4.214
  345   2HB   LEU  49           HB1      LEU  49  61.310  -5.697  -3.532
  346    HG   LEU  49           HG       LEU  49  63.700  -6.827  -2.072
  347   1HD1  LEU  49          HD12      LEU  49  63.627  -4.398  -2.558
  348   2HD1  LEU  49          HD11      LEU  49  62.066  -4.293  -1.743
  349   3HD1  LEU  49          HD13      LEU  49  63.512  -4.717  -0.827
  350   1HD2  LEU  49          HD22      LEU  49  61.594  -7.897  -1.227
  351   2HD2  LEU  49          HD21      LEU  49  62.369  -6.858  -0.030
  352   3HD2  LEU  49          HD23      LEU  49  60.950  -6.287  -0.908
  353    H    GLY  50           HN       GLY  50  63.135  -8.220  -5.472
  354   1HA   GLY  50           HA2      GLY  50  61.854  -9.641  -7.413
  355   2HA   GLY  50           HA1      GLY  50  61.166  -8.033  -7.641
  356    H    GLN  51           HN       GLN  51  62.840  -6.231  -7.850
  357    HA   GLN  51           HA       GLN  51  64.510  -6.603 -10.047
  358   1HB   GLN  51           HB2      GLN  51  65.545  -4.514  -9.495
  359   2HB   GLN  51           HB1      GLN  51  63.881  -4.403  -8.922
  360   1HG   GLN  51           HG2      GLN  51  65.154  -5.510  -6.749
  361   2HG   GLN  51           HG1      GLN  51  66.392  -4.426  -7.386
  362   1HE2  GLN  51          HE21      GLN  51  65.471  -3.588  -4.996
  363   2HE2  GLN  51          HE22      GLN  51  64.353  -2.319  -5.147
  364    H    ASN  52           HN       ASN  52  66.782  -6.972 -10.282
  365    HA   ASN  52           HA       ASN  52  68.253  -7.924  -7.888
  366   1HB   ASN  52           HB2      ASN  52  67.067  -9.879  -9.036
  367   2HB   ASN  52           HB1      ASN  52  68.135  -9.592 -10.411
  368   1HD2  ASN  52          HD22      ASN  52  69.799 -10.943  -6.895
  369   2HD2  ASN  52          HD21      ASN  52  68.344 -10.072  -6.837
  370    HA   PRO  53           HA       PRO  53  70.920  -5.421 -10.597
  371   1HB   PRO  53           HB2      PRO  53  72.180  -4.165  -8.502
  372   2HB   PRO  53           HB1      PRO  53  70.656  -3.600  -9.209
  373   1HG   PRO  53           HG2      PRO  53  71.117  -5.004  -6.617
  374   2HG   PRO  53           HG1      PRO  53  69.814  -3.897  -7.077
  375   1HD   PRO  53           HD2      PRO  53  69.622  -6.717  -6.948
  376   2HD   PRO  53           HD1      PRO  53  68.452  -5.625  -7.721
  377    H    THR  54           HN       THR  54  73.451  -5.162 -10.351
  378    HA   THR  54           HA       THR  54  74.513  -7.853  -9.727
  379    HB   THR  54           HB       THR  54  75.043  -6.700 -11.904
  380    HG1  THR  54           HG1      THR  54  76.582  -8.100 -11.578
  381   1HG2  THR  54          HG21      THR  54  75.522  -4.520 -10.221
  382   2HG2  THR  54          HG23      THR  54  77.123  -5.014 -10.769
  383   3HG2  THR  54          HG22      THR  54  75.874  -4.607 -11.947
  384    H    LYS  55           HN       LYS  55  76.149  -8.203  -8.191
  385    HA   LYS  55           HA       LYS  55  76.175  -6.632  -5.852
  386   1HB   LYS  55           HB2      LYS  55  77.585  -8.933  -6.855
  387   2HB   LYS  55           HB1      LYS  55  78.725  -7.854  -6.050
  388   1HG   LYS  55           HG2      LYS  55  77.229  -7.770  -4.073
  389   2HG   LYS  55           HG1      LYS  55  76.131  -8.897  -4.874
  390   1HD   LYS  55           HD2      LYS  55  77.435 -10.680  -4.384
  391   2HD   LYS  55           HD1      LYS  55  78.907  -9.833  -4.860
  392   1HE   LYS  55           HE2      LYS  55  79.429  -9.591  -2.687
  393   2HE   LYS  55           HE1      LYS  55  77.994  -8.585  -2.485
  394   1HZ   LYS  55           HZ1      LYS  55  76.864 -10.961  -2.456
  395   2HZ   LYS  55           HZ3      LYS  55  78.392 -11.408  -1.865
  396   3HZ   LYS  55           HZ2      LYS  55  77.476 -10.233  -1.048
  397    H    GLU  56           HN       GLU  56  77.921  -6.211  -8.839
  398    HA   GLU  56           HA       GLU  56  80.061  -4.576  -7.906
  399   1HB   GLU  56           HB2      GLU  56  78.958  -5.357 -10.432
  400   2HB   GLU  56           HB1      GLU  56  79.183  -3.608 -10.443
  401   1HG   GLU  56           HG2      GLU  56  81.511  -4.312  -9.301
  402   2HG   GLU  56           HG1      GLU  56  81.213  -5.777 -10.239
  403    H    GLU  57           HN       GLU  57  77.253  -3.295  -9.708
  404    HA   GLU  57           HA       GLU  57  77.548  -0.649  -8.685
  405   1HB   GLU  57           HB2      GLU  57  75.420  -2.155 -10.135
  406   2HB   GLU  57           HB1      GLU  57  74.942  -0.661  -9.329
  407   1HG   GLU  57           HG2      GLU  57  75.596   0.027 -11.501
  408   2HG   GLU  57           HG1      GLU  57  76.986   0.404 -10.481
  409    H    LEU  58           HN       LEU  58  76.366  -3.485  -7.198
  410    HA   LEU  58           HA       LEU  58  74.430  -2.293  -5.420
  411   1HB   LEU  58           HB2      LEU  58  74.885  -4.816  -5.982
  412   2HB   LEU  58           HB1      LEU  58  76.060  -4.706  -4.671
  413    HG   LEU  58           HG       LEU  58  73.966  -3.511  -3.468
  414   1HD1  LEU  58          HD13      LEU  58  72.804  -5.460  -5.479
  415   2HD1  LEU  58          HD12      LEU  58  71.930  -4.882  -4.059
  416   3HD1  LEU  58          HD11      LEU  58  72.424  -3.745  -5.315
  417   1HD2  LEU  58          HD21      LEU  58  75.367  -5.648  -2.914
  418   2HD2  LEU  58          HD23      LEU  58  73.757  -5.491  -2.214
  419   3HD2  LEU  58          HD22      LEU  58  74.009  -6.521  -3.623
  420    H    ASP  59           HN       ASP  59  77.883  -3.136  -5.035
  421    HA   ASP  59           HA       ASP  59  78.147  -2.206  -2.356
  422   1HB   ASP  59           HB2      ASP  59  79.822  -3.457  -4.054
  423   2HB   ASP  59           HB1      ASP  59  80.441  -1.813  -4.214
  424    H    ALA  60           HN       ALA  60  78.822  -0.505  -5.436
  425    HA   ALA  60           HA       ALA  60  79.530   1.989  -4.257
  426   1HB   ALA  60           HB3      ALA  60  79.131   0.966  -6.882
  427   2HB   ALA  60           HB2      ALA  60  78.145   2.421  -6.737
  428   3HB   ALA  60           HB1      ALA  60  79.880   2.496  -6.422
  429    H    ILE  61           HN       ILE  61  76.401   0.591  -5.097
  430    HA   ILE  61           HA       ILE  61  74.835   2.957  -4.724
  431    HB   ILE  61           HB       ILE  61  74.227   0.003  -4.568
  432   1HG1  ILE  61          HG12      ILE  61  73.112   2.100  -6.435
  433   2HG1  ILE  61          HG11      ILE  61  74.658   1.313  -6.751
  434   1HG2  ILE  61          HG23      ILE  61  72.690   2.183  -3.433
  435   2HG2  ILE  61          HG22      ILE  61  71.800   1.415  -4.748
  436   3HG2  ILE  61          HG21      ILE  61  72.366   0.450  -3.384
  437   1HD1  ILE  61          HD11      ILE  61  72.697  -0.674  -6.034
  438   2HD1  ILE  61          HD13      ILE  61  72.075   0.323  -7.351
  439   3HD1  ILE  61          HD12      ILE  61  73.615  -0.519  -7.532
  440    H    ILE  62           HN       ILE  62  75.865   0.396  -2.479
  441    HA   ILE  62           HA       ILE  62  74.396   1.331  -0.212
  442    HB   ILE  62           HB       ILE  62  76.993  -0.221  -0.416
  443   1HG1  ILE  62          HG12      ILE  62  74.277  -1.222   0.440
  444   2HG1  ILE  62          HG11      ILE  62  74.723  -1.150  -1.265
  445   1HG2  ILE  62          HG23      ILE  62  75.277   0.505   1.969
  446   2HG2  ILE  62          HG22      ILE  62  76.407  -0.849   1.988
  447   3HG2  ILE  62          HG21      ILE  62  77.003   0.793   1.752
  448   1HD1  ILE  62          HD12      ILE  62  76.637  -2.419   0.654
  449   2HD1  ILE  62          HD11      ILE  62  75.207  -3.330   0.169
  450   3HD1  ILE  62          HD13      ILE  62  76.358  -2.780  -1.049
  451    H    GLU  63           HN       GLU  63  77.391   2.374  -1.687
  452    HA   GLU  63           HA       GLU  63  78.421   3.860   0.549
  453   1HB   GLU  63           HB2      GLU  63  79.067   3.482  -2.258
  454   2HB   GLU  63           HB1      GLU  63  79.249   5.173  -1.792
  455   1HG   GLU  63           HG2      GLU  63  80.310   3.200   0.147
  456   2HG   GLU  63           HG1      GLU  63  81.173   3.297  -1.388
  457    H    GLU  64           HN       GLU  64  75.931   4.513  -1.804
  458    HA   GLU  64           HA       GLU  64  75.858   7.379  -1.021
  459   1HB   GLU  64           HB2      GLU  64  74.455   5.781  -3.174
  460   2HB   GLU  64           HB1      GLU  64  74.021   7.450  -2.799
  461   1HG   GLU  64           HG2      GLU  64  76.745   6.453  -3.684
  462   2HG   GLU  64           HG1      GLU  64  75.632   7.446  -4.627
  463    H    VAL  65           HN       VAL  65  74.432   4.412  -0.164
  464    HA   VAL  65           HA       VAL  65  71.865   5.600   0.670
  465    HB   VAL  65           HB       VAL  65  73.013   2.823   1.088
  466   1HG1  VAL  65          HG13      VAL  65  71.251   3.680   2.751
  467   2HG1  VAL  65          HG12      VAL  65  70.135   3.703   1.386
  468   3HG1  VAL  65          HG11      VAL  65  70.867   2.183   1.901
  469   1HG2  VAL  65          HG21      VAL  65  72.529   3.521  -1.287
  470   2HG2  VAL  65          HG23      VAL  65  71.546   2.170  -0.730
  471   3HG2  VAL  65          HG22      VAL  65  70.852   3.788  -0.810
  472    H    ASP  66           HN       ASP  66  74.816   4.306   2.188
  473    HA   ASP  66           HA       ASP  66  73.856   4.872   4.884
  474   1HB   ASP  66           HB2      ASP  66  75.949   3.372   3.769
  475   2HB   ASP  66           HB1      ASP  66  76.747   4.676   4.650
  476    H    GLU  67           HN       GLU  67  73.280   7.163   4.486
  477    HA   GLU  67           HA       GLU  67  75.263   9.120   3.776
  478   1HB   GLU  67           HB2      GLU  67  73.645  10.759   4.466
  479   2HB   GLU  67           HB1      GLU  67  72.742   9.435   3.729
  480   1HG   GLU  67           HG2      GLU  67  72.856   8.591   6.321
  481   2HG   GLU  67           HG1      GLU  67  72.797  10.341   6.543
  482    H    ASP  68           HN       ASP  68  74.564   7.429   6.719
  483    HA   ASP  68           HA       ASP  68  76.153   9.382   8.302
  484   1HB   ASP  68           HB2      ASP  68  75.470   7.754  10.205
  485   2HB   ASP  68           HB1      ASP  68  74.212   8.769   9.496
  486    H    GLY  69           HN       GLY  69  76.567   6.522   6.547
  487   1HA   GLY  69           HA2      GLY  69  78.349   5.001   6.408
  488   2HA   GLY  69           HA1      GLY  69  79.323   6.270   7.152
  489    H    SER  70           HN       SER  70  76.527   5.116   8.853
  490    HA   SER  70           HA       SER  70  78.052   4.395  11.169
  491   1HB   SER  70           HB2      SER  70  75.930   3.486  12.027
  492   2HB   SER  70           HB1      SER  70  75.666   5.052  11.265
  493    HG   SER  70           HG       SER  70  74.374   2.923  10.721
  494    H    GLY  71           HN       GLY  71  77.552   2.754   8.242
  495   1HA   GLY  71           HA2      GLY  71  78.553   0.676   7.637
  496   2HA   GLY  71           HA1      GLY  71  78.836   0.344   9.345
  497    H    THR  72           HN       THR  72  75.683   1.405   8.962
  498    HA   THR  72           HA       THR  72  74.630  -1.330   8.437
  499    HB   THR  72           HB       THR  72  72.988  -0.437  10.464
  500    HG1  THR  72           HG1      THR  72  75.679   0.237  11.050
  501   1HG2  THR  72          HG21      THR  72  75.380  -2.267  10.399
  502   2HG2  THR  72          HG23      THR  72  74.448  -2.048  11.879
  503   3HG2  THR  72          HG22      THR  72  73.669  -2.690  10.433
  504    H    ILE  73           HN       ILE  73  72.580  -1.318   7.467
  505    HA   ILE  73           HA       ILE  73  71.654   1.354   6.546
  506    HB   ILE  73           HB       ILE  73  71.018  -1.457   5.614
  507   1HG1  ILE  73          HG12      ILE  73  73.271  -0.309   5.078
  508   2HG1  ILE  73          HG11      ILE  73  72.347  -0.943   3.717
  509   1HG2  ILE  73          HG23      ILE  73  69.694   1.145   5.122
  510   2HG2  ILE  73          HG22      ILE  73  70.044   0.192   3.679
  511   3HG2  ILE  73          HG21      ILE  73  69.054  -0.492   4.969
  512   1HD1  ILE  73          HD13      ILE  73  71.556   1.784   4.363
  513   2HD1  ILE  73          HD12      ILE  73  73.280   1.678   4.008
  514   3HD1  ILE  73          HD11      ILE  73  72.100   1.114   2.825
  515    H    ASP  74           HN       ASP  74  69.536   2.064   6.940
  516    HA   ASP  74           HA       ASP  74  67.977   0.412   8.889
  517   1HB   ASP  74           HB2      ASP  74  68.098   3.435   8.649
  518   2HB   ASP  74           HB1      ASP  74  67.124   2.536   9.812
  519    H    PHE  75           HN       PHE  75  65.560   0.970   8.792
  520    HA   PHE  75           HA       PHE  75  64.508   0.428   6.245
  521   1HB   PHE  75           HB2      PHE  75  63.347   0.341   8.554
  522   2HB   PHE  75           HB1      PHE  75  62.988   2.047   8.287
  523    HD1  PHE  75           HD2      PHE  75  63.127  -0.869   5.948
  524    HD2  PHE  75           HD1      PHE  75  60.731   2.242   7.686
  525    HE1  PHE  75           HE2      PHE  75  61.237  -1.496   4.467
  526    HE2  PHE  75           HE1      PHE  75  58.841   1.616   6.207
  527    HZ   PHE  75           HZ       PHE  75  59.096  -0.253   4.595
  528    H    GLU  76           HN       GLU  76  64.776   3.607   7.867
  529    HA   GLU  76           HA       GLU  76  63.615   5.153   5.798
  530   1HB   GLU  76           HB2      GLU  76  65.872   5.933   7.668
  531   2HB   GLU  76           HB1      GLU  76  64.853   7.053   6.762
  532   1HG   GLU  76           HG2      GLU  76  62.895   5.727   7.954
  533   2HG   GLU  76           HG1      GLU  76  64.158   5.346   9.124
  534    H    GLU  77           HN       GLU  77  66.808   3.733   6.070
  535    HA   GLU  77           HA       GLU  77  67.828   5.256   3.763
  536   1HB   GLU  77           HB2      GLU  77  69.027   2.995   5.392
  537   2HB   GLU  77           HB1      GLU  77  69.867   3.843   4.093
  538   1HG   GLU  77           HG2      GLU  77  69.598   5.975   5.306
  539   2HG   GLU  77           HG1      GLU  77  68.760   5.130   6.607
  540    H    PHE  78           HN       PHE  78  66.194   2.270   4.366
  541    HA   PHE  78           HA       PHE  78  67.115   0.824   2.055
  542   1HB   PHE  78           HB2      PHE  78  66.070  -0.635   3.495
  543   2HB   PHE  78           HB1      PHE  78  64.918   0.574   4.051
  544    HD1  PHE  78           HD2      PHE  78  63.044   1.273   2.459
  545    HD2  PHE  78           HD1      PHE  78  65.451  -2.230   1.861
  546    HE1  PHE  78           HE2      PHE  78  61.312   0.344   0.942
  547    HE2  PHE  78           HE1      PHE  78  63.723  -3.162   0.343
  548    HZ   PHE  78           HZ       PHE  78  61.655  -1.875  -0.116
  549    H    LEU  79           HN       LEU  79  64.340   2.979   2.655
  550    HA   LEU  79           HA       LEU  79  63.084   2.713   0.128
  551   1HB   LEU  79           HB2      LEU  79  63.299   5.230   1.812
  552   2HB   LEU  79           HB1      LEU  79  62.077   4.897   0.584
  553    HG   LEU  79           HG       LEU  79  62.494   3.120   2.997
  554   1HD1  LEU  79          HD12      LEU  79  61.651   5.722   3.167
  555   2HD1  LEU  79          HD11      LEU  79  60.124   4.877   2.912
  556   3HD1  LEU  79          HD13      LEU  79  61.153   4.443   4.276
  557   1HD2  LEU  79          HD21      LEU  79  61.078   2.778   0.622
  558   2HD2  LEU  79          HD23      LEU  79  60.816   1.879   2.118
  559   3HD2  LEU  79          HD22      LEU  79  59.847   3.311   1.767
  560    H    VAL  80           HN       VAL  80  65.880   4.609   1.139
  561    HA   VAL  80           HA       VAL  80  66.095   6.174  -1.272
  562    HB   VAL  80           HB       VAL  80  68.039   5.412   0.916
  563   1HG1  VAL  80          HG13      VAL  80  68.572   6.622  -1.751
  564   2HG1  VAL  80          HG12      VAL  80  69.347   7.394  -0.366
  565   3HG1  VAL  80          HG11      VAL  80  69.641   5.686  -0.706
  566   1HG2  VAL  80          HG21      VAL  80  66.643   7.956   0.042
  567   2HG2  VAL  80          HG23      VAL  80  66.423   7.078   1.556
  568   3HG2  VAL  80          HG22      VAL  80  67.935   7.930   1.242
  569    H    MET  81           HN       MET  81  68.069   3.392  -0.171
  570    HA   MET  81           HA       MET  81  69.408   2.923  -2.603
  571   1HB   MET  81           HB2      MET  81  69.756   1.799  -0.312
  572   2HB   MET  81           HB1      MET  81  68.469   0.695  -0.793
  573   1HG   MET  81           HG2      MET  81  69.764   0.196  -2.884
  574   2HG   MET  81           HG1      MET  81  71.085   1.170  -2.239
  575   1HE   MET  81           HE1      MET  81  71.131   0.890   0.573
  576   2HE   MET  81           HE3      MET  81  71.951  -0.594   1.077
  577   3HE   MET  81           HE2      MET  81  72.653   0.423  -0.179
  578    H    MET  82           HN       MET  82  66.106   2.289  -1.733
  579    HA   MET  82           HA       MET  82  65.589   0.308  -3.773
  580   1HB   MET  82           HB2      MET  82  63.922   0.167  -2.214
  581   2HB   MET  82           HB1      MET  82  64.053   1.865  -1.774
  582   1HG   MET  82           HG2      MET  82  61.895   1.536  -2.793
  583   2HG   MET  82           HG1      MET  82  62.893   2.429  -3.938
  584   1HE   MET  82           HE3      MET  82  62.204  -0.900  -2.547
  585   2HE   MET  82           HE2      MET  82  61.924  -2.013  -3.884
  586   3HE   MET  82           HE1      MET  82  63.572  -1.587  -3.432
  587    H    VAL  83           HN       VAL  83  64.707   3.776  -3.515
  588    HA   VAL  83           HA       VAL  83  63.933   3.917  -6.309
  589    HB   VAL  83           HB       VAL  83  64.651   6.291  -4.594
  590   1HG1  VAL  83          HG12      VAL  83  63.207   5.760  -7.093
  591   2HG1  VAL  83          HG11      VAL  83  62.294   6.759  -5.963
  592   3HG1  VAL  83          HG13      VAL  83  63.896   7.269  -6.492
  593   1HG2  VAL  83          HG21      VAL  83  62.437   4.320  -4.270
  594   2HG2  VAL  83          HG23      VAL  83  63.240   5.318  -3.056
  595   3HG2  VAL  83          HG22      VAL  83  62.019   6.027  -4.114
  596    H    ARG  84           HN       ARG  84  66.920   3.601  -4.933
  597    HA   ARG  84           HA       ARG  84  68.457   5.576  -6.341
  598   1HB   ARG  84           HB2      ARG  84  68.979   3.579  -4.462
  599   2HB   ARG  84           HB1      ARG  84  69.876   3.071  -5.894
  600   1HG   ARG  84           HG2      ARG  84  71.460   4.519  -5.141
  601   2HG   ARG  84           HG1      ARG  84  70.418   5.752  -5.854
  602   1HD   ARG  84           HD2      ARG  84  69.720   4.862  -3.105
  603   2HD   ARG  84           HD1      ARG  84  71.192   5.819  -3.270
  604    HE   ARG  84           HE       ARG  84  68.446   6.752  -3.893
  605   1HH1  ARG  84          HH21      ARG  84  70.155   7.968  -5.914
  606   2HH1  ARG  84          HH22      ARG  84  70.791   9.371  -5.123
  607   1HH2  ARG  84          HH11      ARG  84  69.994   8.265  -1.936
  608   2HH2  ARG  84          HH12      ARG  84  70.700   9.539  -2.873
  609    H    GLN  85           HN       GLN  85  67.003   2.578  -7.347
  610    HA   GLN  85           HA       GLN  85  68.291   2.962 -10.011
  611   1HB   GLN  85           HB2      GLN  85  68.479   0.503 -10.250
  612   2HB   GLN  85           HB1      GLN  85  69.449   1.104  -8.906
  613   1HG   GLN  85           HG2      GLN  85  66.911   0.597  -7.809
  614   2HG   GLN  85           HG1      GLN  85  67.244  -0.777  -8.864
  615   1HE2  GLN  85          HE22      GLN  85  70.078  -0.066  -5.962
  616   2HE2  GLN  85          HE21      GLN  85  69.419   1.248  -6.812
  617    H    MET  86           HN       MET  86  65.524   1.787  -8.150
  618    HA   MET  86           HA       MET  86  63.988   0.896 -10.414
  619   1HB   MET  86           HB2      MET  86  62.132   0.795  -8.918
  620   2HB   MET  86           HB1      MET  86  63.543   0.401  -7.938
  621   1HG   MET  86           HG2      MET  86  63.032   2.106  -6.563
  622   2HG   MET  86           HG1      MET  86  63.281   3.228  -7.902
  623   1HE   MET  86           HE2      MET  86  61.512   2.391  -5.300
  624   2HE   MET  86           HE1      MET  86  60.769   3.962  -5.586
  625   3HE   MET  86           HE3      MET  86  59.770   2.503  -5.542
  626    H    LYS  87           HN       LYS  87  64.770   4.023  -9.178
  627    HA   LYS  87           HA       LYS  87  62.557   5.564 -10.021
  628   1HB   LYS  87           HB2      LYS  87  65.032   6.116  -8.952
  629   2HB   LYS  87           HB1      LYS  87  65.178   6.784 -10.579
  630   1HG   LYS  87           HG2      LYS  87  62.632   7.571  -9.762
  631   2HG   LYS  87           HG1      LYS  87  63.620   7.764  -8.315
  632   1HD   LYS  87           HD2      LYS  87  65.308   8.991  -9.761
  633   2HD   LYS  87           HD1      LYS  87  64.098   8.982 -11.044
  634   1HE   LYS  87           HE2      LYS  87  62.807  10.557 -10.017
  635   2HE   LYS  87           HE1      LYS  87  63.128   9.912  -8.407
  636   1HZ   LYS  87           HZ3      LYS  87  65.212  11.324  -9.954
  637   2HZ   LYS  87           HZ2      LYS  87  64.107  12.168  -8.977
  638   3HZ   LYS  87           HZ1      LYS  87  65.156  11.024  -8.287
  639    H    GLU  88           HN       GLU  88  65.613   5.365 -11.873
  640    HA   GLU  88           HA       GLU  88  64.064   5.835 -14.350
  641   1HB   GLU  88           HB2      GLU  88  66.192   6.254 -15.399
  642   2HB   GLU  88           HB1      GLU  88  66.221   7.064 -13.832
  643   1HG   GLU  88           HG2      GLU  88  68.254   5.960 -13.741
  644   2HG   GLU  88           HG1      GLU  88  67.209   4.730 -13.031
  645    H    ASP  89           HN       ASP  89  64.647   4.450 -16.286
  646    HA   ASP  89           HA       ASP  89  65.003   1.610 -15.413
  647   1HB   ASP  89           HB2      ASP  89  62.775   2.479 -16.513
  648   2HB   ASP  89           HB1      ASP  89  63.702   2.375 -18.010
  649    H    ALA  90           HN       ALA  90  67.057   0.989 -15.906
  650    HA   ALA  90           HA       ALA  90  68.882   0.448 -17.298
  651   1HB   ALA  90           HB3      ALA  90  66.930   0.484 -19.088
  652   2HB   ALA  90           HB2      ALA  90  67.700   1.993 -19.580
  653   3HB   ALA  90           HB1      ALA  90  68.615   0.485 -19.608
   
  No H/Q in entry =         653
  Start of MODEL   23
    1   1H    ALA   1           HT2      ALA   1  71.113   8.338  14.618
    2   2H    ALA   1           HT1      ALA   1  72.525   7.879  13.792
    3   3H    ALA   1           HT3      ALA   1  72.338   9.479  14.326
    4    HA   ALA   1           HA       ALA   1  71.956   9.327  11.947
    5   1HB   ALA   1           HB3      ALA   1  70.556   6.961  12.781
    6   2HB   ALA   1           HB2      ALA   1  69.430   8.021  11.935
    7   3HB   ALA   1           HB1      ALA   1  70.917   7.500  11.142
    8    H    SER   2           HN       SER   2  70.220  10.638  10.949
    9    HA   SER   2           HA       SER   2  68.325  11.840  12.907
   10   1HB   SER   2           HB2      SER   2  70.322  13.303  12.812
   11   2HB   SER   2           HB1      SER   2  70.150  13.416  11.063
   12    HG   SER   2           HG       SER   2  67.842  14.068  11.812
   13    H    MET   3           HN       MET   3  69.221  12.742   9.578
   14    HA   MET   3           HA       MET   3  67.103  11.397   8.250
   15   1HB   MET   3           HB2      MET   3  65.752  12.936   9.760
   16   2HB   MET   3           HB1      MET   3  66.416  14.287   8.839
   17   1HG   MET   3           HG2      MET   3  65.382  13.562   6.825
   18   2HG   MET   3           HG1      MET   3  65.029  11.967   7.489
   19   1HE   MET   3           HE2      MET   3  63.064  11.275   8.549
   20   2HE   MET   3           HE1      MET   3  63.685  11.982  10.038
   21   3HE   MET   3           HE3      MET   3  62.000  12.240   9.569
   22    H    THR   4           HN       THR   4  68.834  11.256   6.718
   23    HA   THR   4           HA       THR   4  70.114  13.611   5.627
   24    HB   THR   4           HB       THR   4  70.452  11.715   3.691
   25    HG1  THR   4           HG1      THR   4  69.286  10.127   4.628
   26   1HG2  THR   4          HG21      THR   4  71.863  12.621   6.089
   27   2HG2  THR   4          HG23      THR   4  72.305  10.979   5.618
   28   3HG2  THR   4          HG22      THR   4  72.489  12.307   4.470
   29    H    ASP   5           HN       ASP   5  69.872  14.263   3.305
   30    HA   ASP   5           HA       ASP   5  67.105  14.788   2.683
   31   1HB   ASP   5           HB2      ASP   5  69.699  15.207   1.193
   32   2HB   ASP   5           HB1      ASP   5  68.142  15.593   0.460
   33    H    GLN   6           HN       GLN   6  69.337  12.256   1.822
   34    HA   GLN   6           HA       GLN   6  68.149  11.328  -0.584
   35   1HB   GLN   6           HB2      GLN   6  69.240   9.225  -0.136
   36   2HB   GLN   6           HB1      GLN   6  70.306  10.501   0.457
   37   1HG   GLN   6           HG2      GLN   6  69.176  10.184   2.733
   38   2HG   GLN   6           HG1      GLN   6  68.487   8.702   2.068
   39   1HE2  GLN   6          HE22      GLN   6  72.117   7.644   1.464
   40   2HE2  GLN   6          HE21      GLN   6  70.927   8.188   0.380
   41    H    GLN   7           HN       GLN   7  67.220  10.873   2.790
   42    HA   GLN   7           HA       GLN   7  65.177   8.885   2.167
   43   1HB   GLN   7           HB2      GLN   7  65.829  10.514   4.630
   44   2HB   GLN   7           HB1      GLN   7  64.438   9.430   4.561
   45   1HG   GLN   7           HG2      GLN   7  65.781   7.515   4.327
   46   2HG   GLN   7           HG1      GLN   7  67.180   8.449   3.794
   47   1HE2  GLN   7          HE22      GLN   7  68.287   8.005   7.155
   48   2HE2  GLN   7          HE21      GLN   7  68.485   7.483   5.552
   49    H    ALA   8           HN       ALA   8  65.347  12.373   2.377
   50    HA   ALA   8           HA       ALA   8  62.500  12.826   2.595
   51   1HB   ALA   8           HB3      ALA   8  64.784  14.416   2.685
   52   2HB   ALA   8           HB2      ALA   8  63.983  14.922   1.197
   53   3HB   ALA   8           HB1      ALA   8  63.119  14.997   2.733
   54    H    GLU   9           HN       GLU   9  64.737  12.376  -0.097
   55    HA   GLU   9           HA       GLU   9  62.664  13.027  -2.082
   56   1HB   GLU   9           HB2      GLU   9  65.566  12.485  -2.096
   57   2HB   GLU   9           HB1      GLU   9  64.698  11.854  -3.496
   58   1HG   GLU   9           HG2      GLU   9  64.737  13.936  -4.357
   59   2HG   GLU   9           HG1      GLU   9  63.633  14.419  -3.068
   60    H    ALA  10           HN       ALA  10  64.210  10.158  -0.708
   61    HA   ALA  10           HA       ALA  10  63.065   8.280  -2.571
   62   1HB   ALA  10           HB2      ALA  10  65.017   7.826  -1.029
   63   2HB   ALA  10           HB1      ALA  10  63.865   7.747   0.302
   64   3HB   ALA  10           HB3      ALA  10  63.772   6.577  -1.014
   65    H    ARG  11           HN       ARG  11  62.201   8.855   0.863
   66    HA   ARG  11           HA       ARG  11  59.728   7.448   0.734
   67   1HB   ARG  11           HB2      ARG  11  61.140   8.527   2.757
   68   2HB   ARG  11           HB1      ARG  11  59.926   9.794   2.559
   69   1HG   ARG  11           HG2      ARG  11  58.286   8.500   3.424
   70   2HG   ARG  11           HG1      ARG  11  58.775   7.103   2.466
   71   1HD   ARG  11           HD2      ARG  11  59.582   6.199   4.366
   72   2HD   ARG  11           HD1      ARG  11  60.836   7.439   4.336
   73    HE   ARG  11           HE       ARG  11  58.682   7.324   6.218
   74   1HH1  ARG  11          HH11      ARG  11  61.220   9.194   5.080
   75   2HH1  ARG  11          HH12      ARG  11  60.620  10.700   5.691
   76   1HH2  ARG  11          HH21      ARG  11  57.546   9.397   6.630
   77   2HH2  ARG  11          HH22      ARG  11  58.540  10.815   6.566
   78    H    ALA  12           HN       ALA  12  60.604  10.696  -0.220
   79    HA   ALA  12           HA       ALA  12  57.913  11.749  -0.312
   80   1HB   ALA  12           HB2      ALA  12  60.526  12.571  -1.586
   81   2HB   ALA  12           HB1      ALA  12  59.022  13.428  -1.923
   82   3HB   ALA  12           HB3      ALA  12  59.651  13.366  -0.277
   83    H    PHE  13           HN       PHE  13  59.943   9.958  -2.574
   84    HA   PHE  13           HA       PHE  13  57.993  10.304  -4.756
   85   1HB   PHE  13           HB2      PHE  13  60.379  10.233  -5.316
   86   2HB   PHE  13           HB1      PHE  13  60.524   8.643  -4.566
   87    HD1  PHE  13           HD1      PHE  13  58.513  10.440  -7.173
   88    HD2  PHE  13           HD2      PHE  13  60.264   6.737  -5.885
   89    HE1  PHE  13           HE1      PHE  13  57.809   9.369  -9.296
   90    HE2  PHE  13           HE2      PHE  13  59.560   5.665  -8.008
   91    HZ   PHE  13           HZ       PHE  13  58.333   6.981  -9.714
   92    H    LEU  14           HN       LEU  14  58.663   8.072  -2.196
   93    HA   LEU  14           HA       LEU  14  57.099   5.915  -3.491
   94   1HB   LEU  14           HB2      LEU  14  58.364   5.995  -0.735
   95   2HB   LEU  14           HB1      LEU  14  57.719   4.571  -1.550
   96    HG   LEU  14           HG       LEU  14  59.946   6.254  -2.715
   97   1HD1  LEU  14          HD11      LEU  14  60.480   5.185  -0.450
   98   2HD1  LEU  14          HD13      LEU  14  60.273   3.628  -1.251
   99   3HD1  LEU  14          HD12      LEU  14  61.536   4.735  -1.789
  100   1HD2  LEU  14          HD23      LEU  14  58.565   4.748  -4.206
  101   2HD2  LEU  14          HD22      LEU  14  60.280   4.341  -4.158
  102   3HD2  LEU  14          HD21      LEU  14  59.120   3.383  -3.237
  103    H    SER  15           HN       SER  15  55.018   5.373  -2.863
  104    HA   SER  15           HA       SER  15  53.585   7.359  -1.236
  105   1HB   SER  15           HB2      SER  15  52.904   5.495  -3.303
  106   2HB   SER  15           HB1      SER  15  51.916   5.140  -1.888
  107    HG   SER  15           HG       SER  15  51.425   6.973  -3.585
  108    H    GLU  16           HN       GLU  16  52.102   6.571   0.528
  109    HA   GLU  16           HA       GLU  16  53.533   5.171   2.541
  110   1HB   GLU  16           HB2      GLU  16  51.352   5.061   3.729
  111   2HB   GLU  16           HB1      GLU  16  51.661   6.667   3.069
  112   1HG   GLU  16           HG2      GLU  16  50.394   5.472   0.962
  113   2HG   GLU  16           HG1      GLU  16  49.591   4.696   2.328
  114    H    GLU  17           HN       GLU  17  51.251   4.025   0.097
  115    HA   GLU  17           HA       GLU  17  50.940   1.378   1.196
  116   1HB   GLU  17           HB2      GLU  17  49.966   2.837  -1.052
  117   2HB   GLU  17           HB1      GLU  17  50.675   1.339  -1.656
  118   1HG   GLU  17           HG2      GLU  17  49.327   0.033  -0.083
  119   2HG   GLU  17           HG1      GLU  17  48.657   1.513   0.599
  120    H    MET  18           HN       MET  18  53.301   2.862  -0.958
  121    HA   MET  18           HA       MET  18  54.498   0.349  -1.784
  122   1HB   MET  18           HB2      MET  18  54.882   3.171  -2.312
  123   2HB   MET  18           HB1      MET  18  56.431   2.384  -2.008
  124   1HG   MET  18           HG2      MET  18  56.281   1.059  -3.875
  125   2HG   MET  18           HG1      MET  18  54.527   0.917  -3.759
  126   1HE   MET  18           HE1      MET  18  57.280   1.880  -5.454
  127   2HE   MET  18           HE3      MET  18  56.112   1.672  -6.767
  128   3HE   MET  18           HE2      MET  18  56.924   3.218  -6.543
  129    H    ILE  19           HN       ILE  19  55.621   2.927   0.444
  130    HA   ILE  19           HA       ILE  19  57.886   1.553   1.427
  131    HB   ILE  19           HB       ILE  19  56.052   3.558   2.762
  132   1HG1  ILE  19          HG12      ILE  19  58.769   4.389   2.228
  133   2HG1  ILE  19          HG11      ILE  19  58.036   3.755   0.756
  134   1HG2  ILE  19          HG21      ILE  19  58.405   2.050   3.786
  135   2HG2  ILE  19          HG23      ILE  19  58.357   3.776   4.143
  136   3HG2  ILE  19          HG22      ILE  19  57.037   2.730   4.666
  137   1HD1  ILE  19          HD12      ILE  19  56.806   5.865   2.552
  138   2HD1  ILE  19          HD11      ILE  19  57.598   6.179   1.009
  139   3HD1  ILE  19          HD13      ILE  19  56.102   5.245   1.058
  140    H    ALA  20           HN       ALA  20  54.635   1.718   2.933
  141    HA   ALA  20           HA       ALA  20  55.098  -0.090   5.032
  142   1HB   ALA  20           HB3      ALA  20  52.901   1.261   4.065
  143   2HB   ALA  20           HB2      ALA  20  52.469  -0.420   3.754
  144   3HB   ALA  20           HB1      ALA  20  52.866   0.101   5.392
  145    H    GLU  21           HN       GLU  21  54.844  -0.719   1.631
  146    HA   GLU  21           HA       GLU  21  54.172  -3.536   1.881
  147   1HB   GLU  21           HB2      GLU  21  54.642  -1.639  -0.257
  148   2HB   GLU  21           HB1      GLU  21  55.515  -3.141  -0.564
  149   1HG   GLU  21           HG2      GLU  21  53.556  -4.436  -0.544
  150   2HG   GLU  21           HG1      GLU  21  52.645  -3.212   0.343
  151    H    PHE  22           HN       PHE  22  57.205  -1.742   1.278
  152    HA   PHE  22           HA       PHE  22  58.847  -4.118   1.234
  153   1HB   PHE  22           HB2      PHE  22  59.706  -1.290   1.904
  154   2HB   PHE  22           HB1      PHE  22  60.724  -2.595   1.298
  155    HD1  PHE  22           HD1      PHE  22  59.781  -3.732  -0.953
  156    HD2  PHE  22           HD2      PHE  22  58.940   0.271   0.358
  157    HE1  PHE  22           HE1      PHE  22  59.226  -3.087  -3.282
  158    HE2  PHE  22           HE2      PHE  22  58.384   0.917  -1.973
  159    HZ   PHE  22           HZ       PHE  22  58.527  -0.763  -3.792
  160    H    LYS  23           HN       LYS  23  57.588  -2.079   3.777
  161    HA   LYS  23           HA       LYS  23  59.359  -2.522   5.884
  162   1HB   LYS  23           HB2      LYS  23  56.689  -1.641   5.621
  163   2HB   LYS  23           HB1      LYS  23  56.656  -2.933   6.822
  164   1HG   LYS  23           HG2      LYS  23  58.376  -0.440   6.864
  165   2HG   LYS  23           HG1      LYS  23  57.100  -0.876   7.999
  166   1HD   LYS  23           HD2      LYS  23  58.536  -3.019   8.408
  167   2HD   LYS  23           HD1      LYS  23  59.844  -2.072   7.697
  168   1HE   LYS  23           HE2      LYS  23  59.346  -0.257   9.361
  169   2HE   LYS  23           HE1      LYS  23  58.186  -1.341  10.127
  170   1HZ   LYS  23           HZ2      LYS  23  60.974  -2.186   9.658
  171   2HZ   LYS  23           HZ1      LYS  23  60.560  -1.275  11.032
  172   3HZ   LYS  23           HZ3      LYS  23  59.850  -2.795  10.778
  173    H    ALA  24           HN       ALA  24  56.938  -4.755   4.569
  174    HA   ALA  24           HA       ALA  24  57.134  -6.775   6.557
  175   1HB   ALA  24           HB3      ALA  24  55.816  -6.471   4.116
  176   2HB   ALA  24           HB2      ALA  24  56.879  -7.855   3.860
  177   3HB   ALA  24           HB1      ALA  24  55.714  -7.870   5.184
  178    H    ALA  25           HN       ALA  25  58.965  -6.408   3.506
  179    HA   ALA  25           HA       ALA  25  60.617  -8.696   3.846
  180   1HB   ALA  25           HB2      ALA  25  60.453  -7.403   1.731
  181   2HB   ALA  25           HB1      ALA  25  61.323  -6.072   2.496
  182   3HB   ALA  25           HB3      ALA  25  62.127  -7.621   2.239
  183    H    PHE  26           HN       PHE  26  60.939  -5.389   5.078
  184    HA   PHE  26           HA       PHE  26  63.608  -5.573   6.032
  185   1HB   PHE  26           HB2      PHE  26  61.948  -3.545   5.969
  186   2HB   PHE  26           HB1      PHE  26  61.494  -4.101   7.581
  187    HD1  PHE  26           HD1      PHE  26  64.560  -3.396   5.532
  188    HD2  PHE  26           HD2      PHE  26  62.722  -3.345   9.414
  189    HE1  PHE  26           HE1      PHE  26  66.584  -2.317   6.477
  190    HE2  PHE  26           HE2      PHE  26  64.746  -2.266  10.358
  191    HZ   PHE  26           HZ       PHE  26  66.677  -1.753   8.890
  192    H    ASP  27           HN       ASP  27  60.537  -6.333   7.702
  193    HA   ASP  27           HA       ASP  27  61.645  -7.098  10.187
  194   1HB   ASP  27           HB2      ASP  27  59.131  -6.949   9.271
  195   2HB   ASP  27           HB1      ASP  27  59.359  -8.694   9.133
  196    H    MET  28           HN       MET  28  61.858  -8.663   7.127
  197    HA   MET  28           HA       MET  28  62.323 -11.343   8.180
  198   1HB   MET  28           HB2      MET  28  62.278 -10.035   5.529
  199   2HB   MET  28           HB1      MET  28  63.403 -11.386   5.674
  200   1HG   MET  28           HG2      MET  28  61.730 -12.928   5.947
  201   2HG   MET  28           HG1      MET  28  60.700 -11.804   6.836
  202   1HE   MET  28           HE1      MET  28  62.720 -11.684   3.840
  203   2HE   MET  28           HE3      MET  28  61.657 -11.767   2.428
  204   3HE   MET  28           HE2      MET  28  61.946 -10.224   3.229
  205    H    PHE  29           HN       PHE  29  64.328  -8.581   7.267
  206    HA   PHE  29           HA       PHE  29  66.778 -10.182   7.753
  207   1HB   PHE  29           HB2      PHE  29  66.874  -7.267   7.085
  208   2HB   PHE  29           HB1      PHE  29  67.943  -8.570   6.568
  209    HD1  PHE  29           HD1      PHE  29  66.780 -10.444   5.085
  210    HD2  PHE  29           HD2      PHE  29  65.316  -6.436   5.565
  211    HE1  PHE  29           HE1      PHE  29  65.489 -10.665   2.980
  212    HE2  PHE  29           HE2      PHE  29  64.022  -6.657   3.460
  213    HZ   PHE  29           HZ       PHE  29  64.109  -8.771   2.167
  214    H    ASP  30           HN       ASP  30  64.645  -8.335   9.555
  215    HA   ASP  30           HA       ASP  30  66.793  -7.322  11.353
  216   1HB   ASP  30           HB2      ASP  30  65.175  -5.859  12.299
  217   2HB   ASP  30           HB1      ASP  30  64.859  -5.827  10.564
  218    H    ALA  31           HN       ALA  31  66.388 -10.121  11.299
  219    HA   ALA  31           HA       ALA  31  64.581 -11.098  13.269
  220   1HB   ALA  31           HB2      ALA  31  66.901 -12.103  11.800
  221   2HB   ALA  31           HB1      ALA  31  66.807 -12.757  13.436
  222   3HB   ALA  31           HB3      ALA  31  65.452 -12.961  12.326
  223    H    ASP  32           HN       ASP  32  67.506  -9.291  13.571
  224    HA   ASP  32           HA       ASP  32  68.005 -10.114  16.346
  225   1HB   ASP  32           HB2      ASP  32  69.305  -8.324  14.353
  226   2HB   ASP  32           HB1      ASP  32  69.541  -7.920  16.054
  227    H    GLY  33           HN       GLY  33  66.563  -7.371  14.629
  228   1HA   GLY  33           HA2      GLY  33  64.771  -6.060  15.598
  229   2HA   GLY  33           HA1      GLY  33  65.340  -6.524  17.201
  230    H    GLY  34           HN       GLY  34  67.837  -5.649  15.040
  231   1HA   GLY  34           HA2      GLY  34  68.496  -3.316  16.658
  232   2HA   GLY  34           HA1      GLY  34  69.398  -3.887  15.254
  233    H    GLY  35           HN       GLY  35  66.647  -3.880  13.809
  234   1HA   GLY  35           HA2      GLY  35  65.320  -2.324  12.619
  235   2HA   GLY  35           HA1      GLY  35  65.999  -1.038  13.618
  236    H    ASP  36           HN       ASP  36  68.285  -3.151  12.155
  237    HA   ASP  36           HA       ASP  36  68.580  -1.671   9.667
  238   1HB   ASP  36           HB2      ASP  36  70.821  -0.720  10.246
  239   2HB   ASP  36           HB1      ASP  36  69.512   0.010  11.174
  240    H    ILE  37           HN       ILE  37  69.387  -3.173   8.277
  241    HA   ILE  37           HA       ILE  37  71.021  -5.384   9.436
  242    HB   ILE  37           HB       ILE  37  70.166  -6.818   7.804
  243   1HG1  ILE  37          HG12      ILE  37  70.791  -5.328   5.878
  244   2HG1  ILE  37          HG11      ILE  37  69.228  -6.115   5.670
  245   1HG2  ILE  37          HG21      ILE  37  68.341  -5.174   9.170
  246   2HG2  ILE  37          HG23      ILE  37  67.717  -5.301   7.523
  247   3HG2  ILE  37          HG22      ILE  37  68.020  -6.760   8.469
  248   1HD1  ILE  37          HD12      ILE  37  68.293  -3.941   6.811
  249   2HD1  ILE  37          HD11      ILE  37  69.826  -3.240   6.296
  250   3HD1  ILE  37          HD13      ILE  37  68.719  -3.913   5.101
  251    H    SER  38           HN       SER  38  73.114  -5.656   8.738
  252    HA   SER  38           HA       SER  38  74.612  -3.647   7.550
  253   1HB   SER  38           HB2      SER  38  75.227  -6.109   8.457
  254   2HB   SER  38           HB1      SER  38  75.325  -6.421   6.727
  255    HG   SER  38           HG       SER  38  76.560  -4.237   6.897
  256    H    THR  39           HN       THR  39  75.263  -3.190   5.357
  257    HA   THR  39           HA       THR  39  73.194  -3.509   3.413
  258    HB   THR  39           HB       THR  39  74.521  -2.284   1.969
  259    HG1  THR  39           HG1      THR  39  76.621  -3.722   3.165
  260   1HG2  THR  39          HG21      THR  39  74.600  -1.581   4.672
  261   2HG2  THR  39          HG23      THR  39  76.264  -1.386   4.120
  262   3HG2  THR  39          HG22      THR  39  74.957  -0.524   3.306
  263    H    LYS  40           HN       LYS  40  75.833  -5.555   4.332
  264    HA   LYS  40           HA       LYS  40  76.215  -7.043   1.951
  265   1HB   LYS  40           HB2      LYS  40  76.328  -7.818   4.873
  266   2HB   LYS  40           HB1      LYS  40  76.676  -8.979   3.591
  267   1HG   LYS  40           HG2      LYS  40  78.083  -6.522   3.063
  268   2HG   LYS  40           HG1      LYS  40  78.444  -7.066   4.702
  269   1HD   LYS  40           HD2      LYS  40  79.068  -9.279   3.865
  270   2HD   LYS  40           HD1      LYS  40  78.633  -8.802   2.222
  271   1HE   LYS  40           HE2      LYS  40  80.958  -8.474   2.254
  272   2HE   LYS  40           HE1      LYS  40  80.334  -6.860   2.593
  273   1HZ   LYS  40           HZ2      LYS  40  80.483  -7.608   5.029
  274   2HZ   LYS  40           HZ1      LYS  40  81.539  -8.805   4.449
  275   3HZ   LYS  40           HZ3      LYS  40  81.914  -7.166   4.228
  276    H    ALA  41           HN       ALA  41  73.631  -7.076   4.325
  277    HA   ALA  41           HA       ALA  41  72.336  -9.412   3.066
  278   1HB   ALA  41           HB2      ALA  41  72.353  -8.787   5.612
  279   2HB   ALA  41           HB1      ALA  41  71.058  -7.675   5.166
  280   3HB   ALA  41           HB3      ALA  41  70.867  -9.408   4.893
  281    H    LEU  42           HN       LEU  42  72.233  -5.942   2.940
  282    HA   LEU  42           HA       LEU  42  69.613  -5.420   2.122
  283   1HB   LEU  42           HB2      LEU  42  72.233  -4.154   1.738
  284   2HB   LEU  42           HB1      LEU  42  71.137  -3.853   0.394
  285    HG   LEU  42           HG       LEU  42  70.678  -2.077   1.860
  286   1HD1  LEU  42          HD12      LEU  42  68.710  -3.938   1.424
  287   2HD1  LEU  42          HD11      LEU  42  68.648  -3.742   3.178
  288   3HD1  LEU  42          HD13      LEU  42  68.450  -2.341   2.125
  289   1HD2  LEU  42          HD22      LEU  42  71.301  -4.095   3.953
  290   2HD2  LEU  42          HD21      LEU  42  71.768  -2.396   3.848
  291   3HD2  LEU  42          HD23      LEU  42  70.145  -2.835   4.383
  292    H    GLY  43           HN       GLY  43  72.343  -6.480   0.083
  293   1HA   GLY  43           HA2      GLY  43  71.112  -6.522  -2.417
  294   2HA   GLY  43           HA1      GLY  43  72.312  -7.715  -1.918
  295    H    THR  44           HN       THR  44  70.803  -8.929   0.185
  296    HA   THR  44           HA       THR  44  69.233 -10.795  -1.345
  297    HB   THR  44           HB       THR  44  69.371 -10.307   1.645
  298    HG1  THR  44           HG1      THR  44  70.447 -12.529   0.367
  299   1HG2  THR  44          HG23      THR  44  68.021 -12.430  -0.016
  300   2HG2  THR  44          HG22      THR  44  68.525 -12.748   1.644
  301   3HG2  THR  44          HG21      THR  44  67.348 -11.478   1.307
  302    H    VAL  45           HN       VAL  45  68.380  -8.134   0.851
  303    HA   VAL  45           HA       VAL  45  65.583  -8.448   0.874
  304    HB   VAL  45           HB       VAL  45  67.077  -5.813   0.749
  305   1HG1  VAL  45          HG13      VAL  45  64.339  -6.694   1.604
  306   2HG1  VAL  45          HG12      VAL  45  65.093  -5.317   2.408
  307   3HG1  VAL  45          HG11      VAL  45  64.812  -5.276   0.667
  308   1HG2  VAL  45          HG21      VAL  45  66.909  -7.930   2.823
  309   2HG2  VAL  45          HG23      VAL  45  68.148  -6.701   2.567
  310   3HG2  VAL  45          HG22      VAL  45  66.648  -6.280   3.390
  311    H    MET  46           HN       MET  46  67.456  -6.316  -1.312
  312    HA   MET  46           HA       MET  46  65.335  -5.552  -2.992
  313   1HB   MET  46           HB2      MET  46  68.123  -6.122  -4.010
  314   2HB   MET  46           HB1      MET  46  66.985  -4.898  -4.578
  315   1HG   MET  46           HG2      MET  46  67.268  -4.342  -1.859
  316   2HG   MET  46           HG1      MET  46  68.900  -4.760  -2.381
  317   1HE   MET  46           HE2      MET  46  68.846  -4.312  -5.206
  318   2HE   MET  46           HE1      MET  46  69.035  -2.630  -5.700
  319   3HE   MET  46           HE3      MET  46  70.171  -3.352  -4.553
  320    H    ARG  47           HN       ARG  47  66.912  -8.633  -2.749
  321    HA   ARG  47           HA       ARG  47  66.168  -9.567  -5.400
  322   1HB   ARG  47           HB2      ARG  47  67.832 -10.491  -3.376
  323   2HB   ARG  47           HB1      ARG  47  66.501 -11.649  -3.373
  324   1HG   ARG  47           HG2      ARG  47  68.094 -10.816  -5.817
  325   2HG   ARG  47           HG1      ARG  47  68.282 -12.337  -4.947
  326   1HD   ARG  47           HD2      ARG  47  66.163 -13.123  -5.608
  327   2HD   ARG  47           HD1      ARG  47  65.591 -11.506  -6.019
  328    HE   ARG  47           HE       ARG  47  67.715 -11.955  -7.760
  329   1HH1  ARG  47          HH21      ARG  47  66.492 -14.806  -7.254
  330   2HH1  ARG  47          HH22      ARG  47  65.498 -14.943  -8.665
  331   1HH2  ARG  47          HH11      ARG  47  65.689 -11.572  -9.454
  332   2HH2  ARG  47          HH12      ARG  47  65.044 -13.114  -9.912
  333    H    MET  48           HN       MET  48  64.778  -9.915  -2.136
  334    HA   MET  48           HA       MET  48  62.609 -11.615  -3.015
  335   1HB   MET  48           HB2      MET  48  63.398 -10.224  -0.523
  336   2HB   MET  48           HB1      MET  48  61.668 -10.501  -0.721
  337   1HG   MET  48           HG2      MET  48  62.168 -12.549   0.160
  338   2HG   MET  48           HG1      MET  48  62.627 -12.915  -1.503
  339   1HE   MET  48           HE3      MET  48  63.450 -12.717   2.009
  340   2HE   MET  48           HE2      MET  48  65.183 -12.463   2.193
  341   3HE   MET  48           HE1      MET  48  64.145 -11.111   1.746
  342    H    LEU  49           HN       LEU  49  63.222  -8.413  -3.684
  343    HA   LEU  49           HA       LEU  49  60.316  -7.723  -3.730
  344   1HB   LEU  49           HB2      LEU  49  62.233  -5.598  -4.431
  345   2HB   LEU  49           HB1      LEU  49  60.867  -5.556  -3.318
  346    HG   LEU  49           HG       LEU  49  63.629  -6.673  -2.770
  347   1HD1  LEU  49          HD11      LEU  49  62.112  -4.212  -2.022
  348   2HD1  LEU  49          HD13      LEU  49  63.166  -4.925  -0.800
  349   3HD1  LEU  49          HD12      LEU  49  63.834  -4.414  -2.349
  350   1HD2  LEU  49          HD22      LEU  49  61.057  -7.355  -1.624
  351   2HD2  LEU  49          HD21      LEU  49  62.645  -8.031  -1.262
  352   3HD2  LEU  49          HD23      LEU  49  62.084  -6.593  -0.409
  353    H    GLY  50           HN       GLY  50  63.129  -8.284  -5.715
  354   1HA   GLY  50           HA2      GLY  50  62.514  -9.052  -8.050
  355   2HA   GLY  50           HA1      GLY  50  61.483  -7.624  -8.127
  356    H    GLN  51           HN       GLN  51  63.425  -5.921  -6.716
  357    HA   GLN  51           HA       GLN  51  64.998  -5.126  -9.031
  358   1HB   GLN  51           HB2      GLN  51  64.100  -3.893  -6.663
  359   2HB   GLN  51           HB1      GLN  51  65.861  -3.893  -6.553
  360   1HG   GLN  51           HG2      GLN  51  65.942  -2.193  -8.022
  361   2HG   GLN  51           HG1      GLN  51  65.175  -3.219  -9.235
  362   1HE2  GLN  51          HE22      GLN  51  62.747  -0.540  -9.011
  363   2HE2  GLN  51          HE21      GLN  51  64.193  -0.950  -9.799
  364    H    ASN  52           HN       ASN  52  66.838  -6.196  -9.572
  365    HA   ASN  52           HA       ASN  52  68.796  -6.804  -7.433
  366   1HB   ASN  52           HB2      ASN  52  69.144  -9.102  -8.474
  367   2HB   ASN  52           HB1      ASN  52  67.643  -8.902  -7.568
  368   1HD2  ASN  52          HD22      ASN  52  65.567  -9.344 -10.395
  369   2HD2  ASN  52          HD21      ASN  52  65.647  -9.001  -8.734
  370    HA   PRO  53           HA       PRO  53  70.791  -5.096 -11.166
  371   1HB   PRO  53           HB2      PRO  53  72.436  -3.411  -9.747
  372   2HB   PRO  53           HB1      PRO  53  70.794  -2.977 -10.255
  373   1HG   PRO  53           HG2      PRO  53  71.787  -3.709  -7.540
  374   2HG   PRO  53           HG1      PRO  53  70.402  -2.704  -7.994
  375   1HD   PRO  53           HD2      PRO  53  70.286  -5.398  -7.127
  376   2HD   PRO  53           HD1      PRO  53  68.963  -4.487  -7.888
  377    H    THR  54           HN       THR  54  73.412  -4.730 -11.301
  378    HA   THR  54           HA       THR  54  74.551  -7.347 -10.759
  379    HB   THR  54           HB       THR  54  75.152  -5.940 -12.749
  380    HG1  THR  54           HG1      THR  54  77.560  -6.155 -12.179
  381   1HG2  THR  54          HG21      THR  54  75.657  -4.023 -10.684
  382   2HG2  THR  54          HG23      THR  54  77.163  -4.326 -11.548
  383   3HG2  THR  54          HG22      THR  54  75.732  -3.795 -12.431
  384    H    LYS  55           HN       LYS  55  76.321  -7.797  -9.328
  385    HA   LYS  55           HA       LYS  55  76.164  -6.728  -6.738
  386   1HB   LYS  55           HB2      LYS  55  77.328  -8.841  -7.276
  387   2HB   LYS  55           HB1      LYS  55  78.608  -7.928  -8.077
  388   1HG   LYS  55           HG2      LYS  55  79.644  -7.735  -6.089
  389   2HG   LYS  55           HG1      LYS  55  78.292  -6.750  -5.530
  390   1HD   LYS  55           HD2      LYS  55  77.686  -9.617  -5.535
  391   2HD   LYS  55           HD1      LYS  55  79.030  -9.199  -4.470
  392   1HE   LYS  55           HE2      LYS  55  77.679  -7.549  -3.317
  393   2HE   LYS  55           HE1      LYS  55  76.356  -7.771  -4.462
  394   1HZ   LYS  55           HZ2      LYS  55  77.431  -9.895  -2.687
  395   2HZ   LYS  55           HZ1      LYS  55  76.028  -8.990  -2.372
  396   3HZ   LYS  55           HZ3      LYS  55  76.084 -10.020  -3.717
  397    H    GLU  56           HN       GLU  56  78.479  -5.855  -9.319
  398    HA   GLU  56           HA       GLU  56  80.007  -3.956  -7.956
  399   1HB   GLU  56           HB2      GLU  56  80.107  -4.748 -10.444
  400   2HB   GLU  56           HB1      GLU  56  79.033  -3.381 -10.746
  401   1HG   GLU  56           HG2      GLU  56  80.800  -2.051  -9.314
  402   2HG   GLU  56           HG1      GLU  56  81.871  -3.377  -9.769
  403    H    GLU  57           HN       GLU  57  77.168  -3.100  -9.975
  404    HA   GLU  57           HA       GLU  57  76.900  -0.444  -9.143
  405   1HB   GLU  57           HB2      GLU  57  75.540  -1.598 -10.927
  406   2HB   GLU  57           HB1      GLU  57  74.576  -2.323  -9.641
  407   1HG   GLU  57           HG2      GLU  57  73.335  -0.453  -9.527
  408   2HG   GLU  57           HG1      GLU  57  74.776   0.466  -9.091
  409    H    LEU  58           HN       LEU  58  75.988  -3.381  -7.435
  410    HA   LEU  58           HA       LEU  58  74.325  -2.155  -5.446
  411   1HB   LEU  58           HB2      LEU  58  74.628  -4.661  -5.944
  412   2HB   LEU  58           HB1      LEU  58  76.091  -4.561  -4.964
  413    HG   LEU  58           HG       LEU  58  74.342  -3.304  -3.319
  414   1HD1  LEU  58          HD11      LEU  58  72.697  -4.414  -5.313
  415   2HD1  LEU  58          HD13      LEU  58  72.541  -5.494  -3.927
  416   3HD1  LEU  58          HD12      LEU  58  72.181  -3.776  -3.752
  417   1HD2  LEU  58          HD22      LEU  58  75.791  -5.655  -3.332
  418   2HD2  LEU  58          HD21      LEU  58  74.835  -5.065  -1.973
  419   3HD2  LEU  58          HD23      LEU  58  74.140  -6.230  -3.100
  420    H    ASP  59           HN       ASP  59  77.828  -2.827  -5.536
  421    HA   ASP  59           HA       ASP  59  78.423  -1.923  -2.902
  422   1HB   ASP  59           HB2      ASP  59  79.888  -2.967  -4.967
  423   2HB   ASP  59           HB1      ASP  59  80.440  -1.292  -4.963
  424    H    ALA  60           HN       ALA  60  78.482  -0.128  -6.002
  425    HA   ALA  60           HA       ALA  60  79.221   2.385  -4.875
  426   1HB   ALA  60           HB2      ALA  60  78.106   1.420  -7.428
  427   2HB   ALA  60           HB1      ALA  60  77.657   3.077  -7.022
  428   3HB   ALA  60           HB3      ALA  60  79.358   2.628  -7.132
  429    H    ILE  61           HN       ILE  61  76.225   0.646  -4.871
  430    HA   ILE  61           HA       ILE  61  74.529   2.952  -4.334
  431    HB   ILE  61           HB       ILE  61  74.166  -0.041  -4.155
  432   1HG1  ILE  61          HG12      ILE  61  72.503   1.910  -5.724
  433   2HG1  ILE  61          HG11      ILE  61  74.099   1.453  -6.319
  434   1HG2  ILE  61          HG21      ILE  61  72.374   2.156  -3.140
  435   2HG2  ILE  61          HG23      ILE  61  71.691   0.646  -3.740
  436   3HG2  ILE  61          HG22      ILE  61  72.797   0.629  -2.367
  437   1HD1  ILE  61          HD13      ILE  61  72.242  -0.717  -5.423
  438   2HD1  ILE  61          HD12      ILE  61  71.954   0.042  -6.989
  439   3HD1  ILE  61          HD11      ILE  61  73.492  -0.758  -6.667
  440    H    ILE  62           HN       ILE  62  75.845   0.299  -2.333
  441    HA   ILE  62           HA       ILE  62  74.854   0.951   0.168
  442    HB   ILE  62           HB       ILE  62  77.644   0.064  -0.614
  443   1HG1  ILE  62          HG12      ILE  62  75.923  -1.768   0.862
  444   2HG1  ILE  62          HG11      ILE  62  75.170  -1.232  -0.639
  445   1HG2  ILE  62          HG21      ILE  62  76.412   0.614   2.063
  446   2HG2  ILE  62          HG23      ILE  62  77.515  -0.752   1.903
  447   3HG2  ILE  62          HG22      ILE  62  78.069   0.878   1.519
  448   1HD1  ILE  62          HD12      ILE  62  78.049  -2.021  -0.735
  449   2HD1  ILE  62          HD11      ILE  62  76.851  -3.306  -0.583
  450   3HD1  ILE  62          HD13      ILE  62  76.794  -2.204  -1.959
  451    H    GLU  63           HN       GLU  63  77.519   2.543  -1.558
  452    HA   GLU  63           HA       GLU  63  78.269   4.290   0.598
  453   1HB   GLU  63           HB2      GLU  63  78.879   4.008  -2.268
  454   2HB   GLU  63           HB1      GLU  63  78.947   5.671  -1.682
  455   1HG   GLU  63           HG2      GLU  63  80.182   4.006   0.281
  456   2HG   GLU  63           HG1      GLU  63  80.863   3.584  -1.291
  457    H    GLU  64           HN       GLU  64  76.078   4.736  -2.190
  458    HA   GLU  64           HA       GLU  64  75.390   7.449  -1.361
  459   1HB   GLU  64           HB2      GLU  64  75.014   5.829  -3.676
  460   2HB   GLU  64           HB1      GLU  64  73.421   6.349  -3.123
  461   1HG   GLU  64           HG2      GLU  64  73.920   8.612  -3.380
  462   2HG   GLU  64           HG1      GLU  64  75.657   8.347  -3.240
  463    H    VAL  65           HN       VAL  65  74.563   4.466  -0.130
  464    HA   VAL  65           HA       VAL  65  71.780   5.255   0.541
  465    HB   VAL  65           HB       VAL  65  73.203   2.713   1.354
  466   1HG1  VAL  65          HG11      VAL  65  70.799   3.708   2.142
  467   2HG1  VAL  65          HG13      VAL  65  70.313   2.823   0.695
  468   3HG1  VAL  65          HG12      VAL  65  71.138   1.981   2.009
  469   1HG2  VAL  65          HG21      VAL  65  72.686   3.580  -1.283
  470   2HG2  VAL  65          HG23      VAL  65  73.101   1.947  -0.765
  471   3HG2  VAL  65          HG22      VAL  65  71.410   2.425  -0.900
  472    H    ASP  66           HN       ASP  66  74.812   4.327   2.190
  473    HA   ASP  66           HA       ASP  66  73.691   5.224   4.770
  474   1HB   ASP  66           HB2      ASP  66  75.469   3.244   4.123
  475   2HB   ASP  66           HB1      ASP  66  76.558   4.536   4.628
  476    H    GLU  67           HN       GLU  67  73.530   7.484   3.723
  477    HA   GLU  67           HA       GLU  67  75.927   8.987   3.205
  478   1HB   GLU  67           HB2      GLU  67  73.053   9.521   3.442
  479   2HB   GLU  67           HB1      GLU  67  74.051  10.848   4.039
  480   1HG   GLU  67           HG2      GLU  67  74.465   9.514   1.349
  481   2HG   GLU  67           HG1      GLU  67  73.527  10.989   1.576
  482    H    ASP  68           HN       ASP  68  74.630   7.768   6.084
  483    HA   ASP  68           HA       ASP  68  75.581   9.938   7.816
  484   1HB   ASP  68           HB2      ASP  68  74.955   7.190   8.840
  485   2HB   ASP  68           HB1      ASP  68  74.613   8.758   9.571
  486    H    GLY  69           HN       GLY  69  76.580   6.594   7.058
  487   1HA   GLY  69           HA2      GLY  69  78.924   5.987   6.827
  488   2HA   GLY  69           HA1      GLY  69  79.344   7.352   7.865
  489    H    SER  70           HN       SER  70  76.640   5.678   9.030
  490    HA   SER  70           HA       SER  70  78.061   4.788  11.385
  491   1HB   SER  70           HB2      SER  70  75.848   3.671  11.918
  492   2HB   SER  70           HB1      SER  70  75.746   5.404  11.616
  493    HG   SER  70           HG       SER  70  74.455   3.481  10.386
  494    H    GLY  71           HN       GLY  71  77.807   3.472   8.294
  495   1HA   GLY  71           HA2      GLY  71  78.601   1.416   7.466
  496   2HA   GLY  71           HA1      GLY  71  79.126   1.022   9.104
  497    H    THR  72           HN       THR  72  75.842   1.976   8.812
  498    HA   THR  72           HA       THR  72  74.936  -0.854   8.624
  499    HB   THR  72           HB       THR  72  73.284  -0.163  10.545
  500    HG1  THR  72           HG1      THR  72  74.342   1.288  11.988
  501   1HG2  THR  72          HG22      THR  72  75.478  -1.725  10.454
  502   2HG2  THR  72          HG21      THR  72  76.035  -0.518  11.613
  503   3HG2  THR  72          HG23      THR  72  74.571  -1.444  11.940
  504    H    ILE  73           HN       ILE  73  72.838  -1.065   7.749
  505    HA   ILE  73           HA       ILE  73  71.718   1.466   6.626
  506    HB   ILE  73           HB       ILE  73  71.460  -1.407   5.698
  507   1HG1  ILE  73          HG12      ILE  73  73.622  -0.099   5.273
  508   2HG1  ILE  73          HG11      ILE  73  72.810  -0.734   3.842
  509   1HG2  ILE  73          HG21      ILE  73  69.949   1.068   5.045
  510   2HG2  ILE  73          HG23      ILE  73  70.439   0.066   3.678
  511   3HG2  ILE  73          HG22      ILE  73  69.439  -0.617   4.961
  512   1HD1  ILE  73          HD12      ILE  73  71.729   1.857   4.461
  513   2HD1  ILE  73          HD11      ILE  73  73.488   1.966   4.388
  514   3HD1  ILE  73          HD13      ILE  73  72.585   1.340   3.009
  515    H    ASP  74           HN       ASP  74  69.524   1.921   6.927
  516    HA   ASP  74           HA       ASP  74  68.035   0.044   8.722
  517   1HB   ASP  74           HB2      ASP  74  67.635   3.038   8.730
  518   2HB   ASP  74           HB1      ASP  74  67.167   1.865   9.963
  519    H    PHE  75           HN       PHE  75  65.588   0.459   8.553
  520    HA   PHE  75           HA       PHE  75  64.648   0.004   5.964
  521   1HB   PHE  75           HB2      PHE  75  63.395  -0.166   8.216
  522   2HB   PHE  75           HB1      PHE  75  63.024   1.544   7.992
  523    HD1  PHE  75           HD2      PHE  75  63.140  -1.504   5.807
  524    HD2  PHE  75           HD1      PHE  75  60.921   1.939   7.085
  525    HE1  PHE  75           HE2      PHE  75  61.302  -2.114   4.253
  526    HE2  PHE  75           HE1      PHE  75  59.083   1.335   5.533
  527    HZ   PHE  75           HZ       PHE  75  59.274  -0.692   4.116
  528    H    GLU  76           HN       GLU  76  64.829   3.142   7.667
  529    HA   GLU  76           HA       GLU  76  63.683   4.746   5.647
  530   1HB   GLU  76           HB2      GLU  76  66.024   5.576   7.380
  531   2HB   GLU  76           HB1      GLU  76  64.772   6.614   6.697
  532   1HG   GLU  76           HG2      GLU  76  63.416   6.230   8.452
  533   2HG   GLU  76           HG1      GLU  76  63.568   4.484   8.240
  534    H    GLU  77           HN       GLU  77  67.003   3.533   5.963
  535    HA   GLU  77           HA       GLU  77  67.905   5.028   3.609
  536   1HB   GLU  77           HB2      GLU  77  69.231   2.815   5.205
  537   2HB   GLU  77           HB1      GLU  77  70.015   3.754   3.934
  538   1HG   GLU  77           HG2      GLU  77  69.938   5.748   5.190
  539   2HG   GLU  77           HG1      GLU  77  68.701   5.119   6.278
  540    H    PHE  78           HN       PHE  78  66.370   2.000   4.209
  541    HA   PHE  78           HA       PHE  78  67.371   0.559   1.931
  542   1HB   PHE  78           HB2      PHE  78  66.342  -0.917   3.361
  543   2HB   PHE  78           HB1      PHE  78  65.154   0.268   3.894
  544    HD1  PHE  78           HD2      PHE  78  63.284   0.909   2.269
  545    HD2  PHE  78           HD1      PHE  78  65.782  -2.541   1.738
  546    HE1  PHE  78           HE2      PHE  78  61.597  -0.073   0.733
  547    HE2  PHE  78           HE1      PHE  78  64.100  -3.525   0.201
  548    HZ   PHE  78           HZ       PHE  78  62.009  -2.290  -0.301
  549    H    LEU  79           HN       LEU  79  64.525   2.634   2.452
  550    HA   LEU  79           HA       LEU  79  63.269   2.312  -0.044
  551   1HB   LEU  79           HB2      LEU  79  63.549   4.901   1.513
  552   2HB   LEU  79           HB1      LEU  79  62.301   4.527   0.322
  553    HG   LEU  79           HG       LEU  79  62.661   2.650   2.622
  554   1HD1  LEU  79          HD11      LEU  79  61.512   5.432   2.763
  555   2HD1  LEU  79          HD13      LEU  79  60.897   4.149   3.805
  556   3HD1  LEU  79          HD12      LEU  79  62.592   4.626   3.900
  557   1HD2  LEU  79          HD21      LEU  79  60.326   3.680   0.983
  558   2HD2  LEU  79          HD23      LEU  79  61.053   2.075   0.902
  559   3HD2  LEU  79          HD22      LEU  79  60.156   2.565   2.339
  560    H    VAL  80           HN       VAL  80  66.226   3.987   0.763
  561    HA   VAL  80           HA       VAL  80  66.388   5.583  -1.638
  562    HB   VAL  80           HB       VAL  80  68.530   4.580   0.259
  563   1HG1  VAL  80          HG13      VAL  80  68.868   5.573  -2.340
  564   2HG1  VAL  80          HG12      VAL  80  69.172   6.956  -1.290
  565   3HG1  VAL  80          HG11      VAL  80  70.104   5.473  -1.086
  566   1HG2  VAL  80          HG23      VAL  80  66.614   6.790   0.257
  567   2HG2  VAL  80          HG22      VAL  80  67.623   6.184   1.572
  568   3HG2  VAL  80          HG21      VAL  80  68.279   7.349   0.421
  569    H    MET  81           HN       MET  81  67.759   2.415  -0.720
  570    HA   MET  81           HA       MET  81  69.237   1.865  -3.035
  571   1HB   MET  81           HB2      MET  81  67.491  -0.142  -1.578
  572   2HB   MET  81           HB1      MET  81  68.941  -0.486  -2.522
  573   1HG   MET  81           HG2      MET  81  69.870   1.380  -0.735
  574   2HG   MET  81           HG1      MET  81  68.696   0.501   0.241
  575   1HE   MET  81           HE3      MET  81  71.732   0.861   0.557
  576   2HE   MET  81           HE2      MET  81  71.034  -0.217   1.763
  577   3HE   MET  81           HE1      MET  81  72.471  -0.714   0.874
  578    H    MET  82           HN       MET  82  65.740   1.522  -2.507
  579    HA   MET  82           HA       MET  82  65.221   0.355  -5.101
  580   1HB   MET  82           HB2      MET  82  63.251   1.935  -3.436
  581   2HB   MET  82           HB1      MET  82  62.910   0.628  -4.571
  582   1HG   MET  82           HG2      MET  82  64.790  -0.257  -2.556
  583   2HG   MET  82           HG1      MET  82  63.334   0.386  -1.798
  584   1HE   MET  82           HE3      MET  82  65.028  -2.523  -3.024
  585   2HE   MET  82           HE2      MET  82  63.952  -3.457  -4.061
  586   3HE   MET  82           HE1      MET  82  64.660  -1.958  -4.659
  587    H    VAL  83           HN       VAL  83  64.683   3.658  -3.813
  588    HA   VAL  83           HA       VAL  83  63.836   4.832  -6.245
  589    HB   VAL  83           HB       VAL  83  65.514   6.188  -4.117
  590   1HG1  VAL  83          HG11      VAL  83  64.488   7.121  -6.534
  591   2HG1  VAL  83          HG13      VAL  83  63.300   7.648  -5.341
  592   3HG1  VAL  83          HG12      VAL  83  64.992   8.118  -5.170
  593   1HG2  VAL  83          HG22      VAL  83  62.890   4.962  -3.963
  594   2HG2  VAL  83          HG21      VAL  83  63.829   5.732  -2.684
  595   3HG2  VAL  83          HG23      VAL  83  62.772   6.704  -3.711
  596    H    ARG  84           HN       ARG  84  66.934   3.654  -5.342
  597    HA   ARG  84           HA       ARG  84  68.581   5.363  -6.958
  598   1HB   ARG  84           HB2      ARG  84  68.929   3.038  -5.331
  599   2HB   ARG  84           HB1      ARG  84  69.665   2.717  -6.902
  600   1HG   ARG  84           HG2      ARG  84  71.361   3.763  -5.570
  601   2HG   ARG  84           HG1      ARG  84  70.792   4.990  -6.703
  602   1HD   ARG  84           HD2      ARG  84  69.541   4.728  -3.975
  603   2HD   ARG  84           HD1      ARG  84  71.029   5.650  -4.198
  604    HE   ARG  84           HE       ARG  84  68.366   6.444  -5.105
  605   1HH1  ARG  84          HH21      ARG  84  69.491   6.896  -7.615
  606   2HH1  ARG  84          HH22      ARG  84  70.417   8.353  -7.476
  607   1HH2  ARG  84          HH11      ARG  84  70.550   8.251  -4.013
  608   2HH2  ARG  84          HH12      ARG  84  71.017   9.120  -5.437
  609    H    GLN  85           HN       GLN  85  67.700   1.957  -7.653
  610    HA   GLN  85           HA       GLN  85  68.333   2.154 -10.436
  611   1HB   GLN  85           HB2      GLN  85  67.027   0.197  -8.657
  612   2HB   GLN  85           HB1      GLN  85  66.470   0.142 -10.331
  613   1HG   GLN  85           HG2      GLN  85  68.346  -1.326 -10.244
  614   2HG   GLN  85           HG1      GLN  85  68.939   0.153 -11.003
  615   1HE2  GLN  85          HE22      GLN  85  69.922  -0.243  -7.027
  616   2HE2  GLN  85          HE21      GLN  85  68.337  -0.593  -7.525
  617    H    MET  86           HN       MET  86  65.252   2.494  -8.677
  618    HA   MET  86           HA       MET  86  63.421   2.670 -10.742
  619   1HB   MET  86           HB2      MET  86  63.697   4.285  -8.211
  620   2HB   MET  86           HB1      MET  86  62.364   4.577  -9.329
  621   1HG   MET  86           HG2      MET  86  62.527   1.772  -9.014
  622   2HG   MET  86           HG1      MET  86  62.661   2.459  -7.395
  623   1HE   MET  86           HE3      MET  86  61.222   4.386  -6.579
  624   2HE   MET  86           HE2      MET  86  59.484   4.101  -6.571
  625   3HE   MET  86           HE1      MET  86  60.580   2.840  -6.010
  626    H    LYS  87           HN       LYS  87  65.029   5.602  -9.451
  627    HA   LYS  87           HA       LYS  87  64.998   6.674 -12.246
  628   1HB   LYS  87           HB2      LYS  87  64.743   8.918 -11.260
  629   2HB   LYS  87           HB1      LYS  87  63.414   7.867 -10.765
  630   1HG   LYS  87           HG2      LYS  87  63.979   8.056  -8.591
  631   2HG   LYS  87           HG1      LYS  87  65.657   7.635  -8.934
  632   1HD   LYS  87           HD2      LYS  87  65.791  10.081  -9.877
  633   2HD   LYS  87           HD1      LYS  87  64.365  10.347  -8.874
  634   1HE   LYS  87           HE2      LYS  87  65.598   9.488  -6.907
  635   2HE   LYS  87           HE1      LYS  87  67.031   9.265  -7.912
  636   1HZ   LYS  87           HZ3      LYS  87  65.700  11.889  -7.790
  637   2HZ   LYS  87           HZ2      LYS  87  66.775  11.423  -6.560
  638   3HZ   LYS  87           HZ1      LYS  87  67.313  11.524  -8.169
  639    H    GLU  88           HN       GLU  88  67.176   5.198 -11.533
  640    HA   GLU  88           HA       GLU  88  69.254   6.680 -10.207
  641   1HB   GLU  88           HB2      GLU  88  68.982   4.104 -11.169
  642   2HB   GLU  88           HB1      GLU  88  70.154   4.807 -12.284
  643   1HG   GLU  88           HG2      GLU  88  70.674   5.543  -9.500
  644   2HG   GLU  88           HG1      GLU  88  70.734   3.799  -9.765
  645    H    ASP  89           HN       ASP  89  68.387   6.279 -13.641
  646    HA   ASP  89           HA       ASP  89  69.297   8.906 -14.341
  647   1HB   ASP  89           HB2      ASP  89  71.295   6.760 -14.356
  648   2HB   ASP  89           HB1      ASP  89  71.144   7.570 -15.917
  649    H    ALA  90           HN       ALA  90  67.264   8.837 -15.435
  650    HA   ALA  90           HA       ALA  90  65.796   8.346 -17.205
  651   1HB   ALA  90           HB1      ALA  90  68.478   7.937 -18.563
  652   2HB   ALA  90           HB3      ALA  90  66.939   8.068 -19.412
  653   3HB   ALA  90           HB2      ALA  90  67.558   9.440 -18.492
   
  No H/Q in entry =         653
  Start of MODEL   24
    1   1H    ALA   1           HT2      ALA   1  71.488  11.579  14.421
    2   2H    ALA   1           HT1      ALA   1  70.479  10.477  13.612
    3   3H    ALA   1           HT3      ALA   1  71.902   9.933  14.356
    4    HA   ALA   1           HA       ALA   1  73.273  11.026  12.788
    5   1HB   ALA   1           HB2      ALA   1  71.803   8.895  12.160
    6   2HB   ALA   1           HB1      ALA   1  71.097  10.021  11.000
    7   3HB   ALA   1           HB3      ALA   1  72.828   9.682  10.959
    8    H    SER   2           HN       SER   2  72.305  11.682  10.126
    9    HA   SER   2           HA       SER   2  71.029  14.329  10.703
   10   1HB   SER   2           HB2      SER   2  73.343  13.576   8.952
   11   2HB   SER   2           HB1      SER   2  72.320  14.926   8.473
   12    HG   SER   2           HG       SER   2  73.630  14.589  10.974
   13    H    MET   3           HN       MET   3  70.299  15.209   8.308
   14    HA   MET   3           HA       MET   3  68.741  12.971   7.076
   15   1HB   MET   3           HB2      MET   3  67.533  14.824   8.538
   16   2HB   MET   3           HB1      MET   3  67.692  15.777   7.062
   17   1HG   MET   3           HG2      MET   3  65.717  14.756   6.526
   18   2HG   MET   3           HG1      MET   3  66.788  13.451   6.012
   19   1HE   MET   3           HE2      MET   3  65.868  14.874   9.514
   20   2HE   MET   3           HE1      MET   3  64.346  14.836   8.627
   21   3HE   MET   3           HE3      MET   3  64.582  13.786  10.032
   22    H    THR   4           HN       THR   4  68.402  13.144   4.791
   23    HA   THR   4           HA       THR   4  69.958  15.287   3.420
   24    HB   THR   4           HB       THR   4  70.632  13.406   1.766
   25    HG1  THR   4           HG1      THR   4  69.996  11.925   4.100
   26   1HG2  THR   4          HG22      THR   4  71.763  14.280   4.298
   27   2HG2  THR   4          HG21      THR   4  72.286  12.647   3.886
   28   3HG2  THR   4          HG23      THR   4  72.571  13.974   2.762
   29    H    ASP   5           HN       ASP   5  69.175  15.771   1.288
   30    HA   ASP   5           HA       ASP   5  66.354  15.585   0.950
   31   1HB   ASP   5           HB2      ASP   5  68.640  16.331  -0.853
   32   2HB   ASP   5           HB1      ASP   5  67.019  16.160  -1.527
   33    H    GLN   6           HN       GLN   6  68.857  13.322   0.273
   34    HA   GLN   6           HA       GLN   6  67.758  11.884  -1.907
   35   1HB   GLN   6           HB2      GLN   6  69.471  11.077   0.440
   36   2HB   GLN   6           HB1      GLN   6  68.931   9.882  -0.739
   37   1HG   GLN   6           HG2      GLN   6  70.414  10.600  -2.283
   38   2HG   GLN   6           HG1      GLN   6  69.972  12.287  -2.022
   39   1HE2  GLN   6          HE21      GLN   6  71.684   9.695  -0.167
   40   2HE2  GLN   6          HE22      GLN   6  72.930  10.712   0.377
   41    H    GLN   7           HN       GLN   7  67.229  11.419   1.602
   42    HA   GLN   7           HA       GLN   7  65.247   9.341   1.186
   43   1HB   GLN   7           HB2      GLN   7  65.340  10.987   3.691
   44   2HB   GLN   7           HB1      GLN   7  65.089   9.252   3.505
   45   1HG   GLN   7           HG2      GLN   7  67.542   9.279   2.564
   46   2HG   GLN   7           HG1      GLN   7  67.656  10.807   3.438
   47   1HE2  GLN   7          HE22      GLN   7  68.673   8.506   6.041
   48   2HE2  GLN   7          HE21      GLN   7  69.302   9.395   4.737
   49    H    ALA   8           HN       ALA   8  65.192  12.814   1.238
   50    HA   ALA   8           HA       ALA   8  62.385  13.122   1.860
   51   1HB   ALA   8           HB3      ALA   8  64.457  14.894   0.567
   52   2HB   ALA   8           HB2      ALA   8  62.768  15.392   0.674
   53   3HB   ALA   8           HB1      ALA   8  63.689  15.073   2.145
   54    H    GLU   9           HN       GLU   9  64.212  12.542  -1.091
   55    HA   GLU   9           HA       GLU   9  61.850  12.974  -2.792
   56   1HB   GLU   9           HB2      GLU   9  64.248  13.480  -3.496
   57   2HB   GLU   9           HB1      GLU   9  64.493  11.737  -3.593
   58   1HG   GLU   9           HG2      GLU   9  63.730  11.925  -5.718
   59   2HG   GLU   9           HG1      GLU   9  62.135  12.075  -4.982
   60    H    ALA  10           HN       ALA  10  63.840  10.233  -1.683
   61    HA   ALA  10           HA       ALA  10  62.480   8.189  -3.112
   62   1HB   ALA  10           HB3      ALA  10  63.895   8.156  -0.434
   63   2HB   ALA  10           HB2      ALA  10  63.277   6.699  -1.213
   64   3HB   ALA  10           HB1      ALA  10  64.539   7.651  -1.995
   65    H    ARG  11           HN       ARG  11  61.897   9.406   0.206
   66    HA   ARG  11           HA       ARG  11  59.574   7.764   0.639
   67   1HB   ARG  11           HB2      ARG  11  60.644  10.269   1.937
   68   2HB   ARG  11           HB1      ARG  11  59.090   9.588   2.419
   69   1HG   ARG  11           HG2      ARG  11  60.555   7.339   2.489
   70   2HG   ARG  11           HG1      ARG  11  61.837   8.505   2.816
   71   1HD   ARG  11           HD2      ARG  11  61.030   8.031   4.965
   72   2HD   ARG  11           HD1      ARG  11  60.152   9.502   4.545
   73    HE   ARG  11           HE       ARG  11  58.517   7.416   3.670
   74   1HH1  ARG  11          HH21      ARG  11  60.132   6.543   6.309
   75   2HH1  ARG  11          HH22      ARG  11  58.844   6.715   7.454
   76   1HH2  ARG  11          HH11      ARG  11  56.781   8.451   5.275
   77   2HH2  ARG  11          HH12      ARG  11  56.946   7.793   6.869
   78    H    ALA  12           HN       ALA  12  60.098  10.687  -1.129
   79    HA   ALA  12           HA       ALA  12  57.332  11.603  -1.035
   80   1HB   ALA  12           HB3      ALA  12  59.433  13.015  -1.536
   81   2HB   ALA  12           HB2      ALA  12  59.356  12.326  -3.156
   82   3HB   ALA  12           HB1      ALA  12  58.016  13.298  -2.547
   83    H    PHE  13           HN       PHE  13  59.262   9.533  -3.133
   84    HA   PHE  13           HA       PHE  13  57.088   9.343  -5.117
   85   1HB   PHE  13           HB2      PHE  13  59.336   9.304  -6.000
   86   2HB   PHE  13           HB1      PHE  13  59.800   8.008  -4.897
   87    HD1  PHE  13           HD1      PHE  13  57.064   8.698  -7.384
   88    HD2  PHE  13           HD2      PHE  13  59.895   5.875  -5.813
   89    HE1  PHE  13           HE1      PHE  13  56.305   7.014  -9.038
   90    HE2  PHE  13           HE2      PHE  13  59.135   4.192  -7.467
   91    HZ   PHE  13           HZ       PHE  13  57.340   4.762  -9.081
   92    H    LEU  14           HN       LEU  14  58.231   7.652  -2.309
   93    HA   LEU  14           HA       LEU  14  56.742   5.196  -2.995
   94   1HB   LEU  14           HB2      LEU  14  58.189   5.917  -0.429
   95   2HB   LEU  14           HB1      LEU  14  57.631   4.313  -0.905
   96    HG   LEU  14           HG       LEU  14  59.594   5.914  -2.558
   97   1HD1  LEU  14          HD12      LEU  14  60.323   5.298  -0.134
   98   2HD1  LEU  14          HD11      LEU  14  60.356   3.640  -0.734
   99   3HD1  LEU  14          HD13      LEU  14  61.394   4.864  -1.467
  100   1HD2  LEU  14          HD22      LEU  14  58.228   3.337  -2.770
  101   2HD2  LEU  14          HD21      LEU  14  59.110   4.239  -4.003
  102   3HD2  LEU  14          HD23      LEU  14  59.980   3.176  -2.896
  103    H    SER  15           HN       SER  15  54.595   5.097  -2.578
  104    HA   SER  15           HA       SER  15  53.242   7.087  -0.977
  105   1HB   SER  15           HB2      SER  15  52.486   4.690  -2.541
  106   2HB   SER  15           HB1      SER  15  51.415   5.079  -1.198
  107    HG   SER  15           HG       SER  15  52.301   6.983  -3.102
  108    H    GLU  16           HN       GLU  16  51.870   6.478   0.951
  109    HA   GLU  16           HA       GLU  16  53.452   5.346   3.022
  110   1HB   GLU  16           HB2      GLU  16  50.465   5.804   2.813
  111   2HB   GLU  16           HB1      GLU  16  51.257   5.260   4.293
  112   1HG   GLU  16           HG2      GLU  16  52.411   7.648   2.930
  113   2HG   GLU  16           HG1      GLU  16  50.876   7.861   3.770
  114    H    GLU  17           HN       GLU  17  51.009   3.901   0.906
  115    HA   GLU  17           HA       GLU  17  50.870   1.386   2.312
  116   1HB   GLU  17           HB2      GLU  17  50.277   2.055  -0.588
  117   2HB   GLU  17           HB1      GLU  17  49.835   0.546   0.213
  118   1HG   GLU  17           HG2      GLU  17  48.124   1.508   1.376
  119   2HG   GLU  17           HG1      GLU  17  49.005   3.017   1.619
  120    H    MET  18           HN       MET  18  52.981   2.673  -0.199
  121    HA   MET  18           HA       MET  18  54.185   0.144  -0.905
  122   1HB   MET  18           HB2      MET  18  54.507   2.934  -1.614
  123   2HB   MET  18           HB1      MET  18  56.080   2.183  -1.346
  124   1HG   MET  18           HG2      MET  18  55.791   0.638  -3.058
  125   2HG   MET  18           HG1      MET  18  54.030   0.706  -2.960
  126   1HE   MET  18           HE1      MET  18  54.261   0.570  -5.475
  127   2HE   MET  18           HE3      MET  18  54.729   1.891  -6.555
  128   3HE   MET  18           HE2      MET  18  55.963   0.951  -5.722
  129    H    ILE  19           HN       ILE  19  55.325   2.835   1.170
  130    HA   ILE  19           HA       ILE  19  57.691   1.579   2.085
  131    HB   ILE  19           HB       ILE  19  55.850   3.583   3.408
  132   1HG1  ILE  19          HG12      ILE  19  58.525   4.462   2.770
  133   2HG1  ILE  19          HG11      ILE  19  57.783   3.736   1.344
  134   1HG2  ILE  19          HG22      ILE  19  58.486   2.427   4.334
  135   2HG2  ILE  19          HG21      ILE  19  57.897   3.993   4.889
  136   3HG2  ILE  19          HG23      ILE  19  56.973   2.531   5.232
  137   1HD1  ILE  19          HD13      ILE  19  56.053   5.552   2.932
  138   2HD1  ILE  19          HD12      ILE  19  57.380   6.316   2.057
  139   3HD1  ILE  19          HD11      ILE  19  56.179   5.362   1.184
  140    H    ALA  20           HN       ALA  20  54.347   1.132   3.058
  141    HA   ALA  20           HA       ALA  20  54.905  -0.285   5.510
  142   1HB   ALA  20           HB2      ALA  20  52.583   0.460   3.973
  143   2HB   ALA  20           HB1      ALA  20  52.472  -1.245   4.410
  144   3HB   ALA  20           HB3      ALA  20  52.673  -0.023   5.667
  145    H    GLU  21           HN       GLU  21  54.514  -1.231   2.137
  146    HA   GLU  21           HA       GLU  21  54.572  -4.078   2.638
  147   1HB   GLU  21           HB2      GLU  21  53.661  -3.640   0.557
  148   2HB   GLU  21           HB1      GLU  21  54.736  -2.277   0.256
  149   1HG   GLU  21           HG2      GLU  21  56.493  -3.653  -0.449
  150   2HG   GLU  21           HG1      GLU  21  55.845  -5.071   0.375
  151    H    PHE  22           HN       PHE  22  57.023  -1.618   1.943
  152    HA   PHE  22           HA       PHE  22  59.202  -3.445   1.533
  153   1HB   PHE  22           HB2      PHE  22  59.233  -0.583   2.538
  154   2HB   PHE  22           HB1      PHE  22  60.640  -1.478   1.963
  155    HD1  PHE  22           HD1      PHE  22  59.318  -3.000  -0.289
  156    HD2  PHE  22           HD2      PHE  22  59.082   1.126   0.877
  157    HE1  PHE  22           HE1      PHE  22  58.765  -2.372  -2.624
  158    HE2  PHE  22           HE2      PHE  22  58.528   1.755  -1.457
  159    HZ   PHE  22           HZ       PHE  22  58.369   0.005  -3.208
  160    H    LYS  23           HN       LYS  23  57.851  -1.912   4.431
  161    HA   LYS  23           HA       LYS  23  59.918  -2.634   6.248
  162   1HB   LYS  23           HB2      LYS  23  57.645  -1.218   6.504
  163   2HB   LYS  23           HB1      LYS  23  57.101  -2.741   7.208
  164   1HG   LYS  23           HG2      LYS  23  59.751  -1.621   8.054
  165   2HG   LYS  23           HG1      LYS  23  58.276  -0.924   8.726
  166   1HD   LYS  23           HD2      LYS  23  57.604  -3.413   9.170
  167   2HD   LYS  23           HD1      LYS  23  59.331  -3.728   8.999
  168   1HE   LYS  23           HE2      LYS  23  59.887  -2.434  10.869
  169   2HE   LYS  23           HE1      LYS  23  58.386  -1.509  10.796
  170   1HZ   LYS  23           HZ1      LYS  23  58.610  -4.381  11.518
  171   2HZ   LYS  23           HZ3      LYS  23  58.360  -3.106  12.609
  172   3HZ   LYS  23           HZ2      LYS  23  57.169  -3.481  11.457
  173    H    ALA  24           HN       ALA  24  57.341  -4.511   4.805
  174    HA   ALA  24           HA       ALA  24  57.288  -6.687   6.650
  175   1HB   ALA  24           HB1      ALA  24  56.011  -6.068   4.268
  176   2HB   ALA  24           HB3      ALA  24  56.983  -7.477   3.845
  177   3HB   ALA  24           HB2      ALA  24  55.822  -7.572   5.171
  178    H    ALA  25           HN       ALA  25  59.157  -6.305   3.615
  179    HA   ALA  25           HA       ALA  25  60.676  -8.735   4.073
  180   1HB   ALA  25           HB3      ALA  25  60.251  -7.099   1.902
  181   2HB   ALA  25           HB2      ALA  25  61.908  -6.691   2.346
  182   3HB   ALA  25           HB1      ALA  25  61.479  -8.363   1.980
  183    H    PHE  26           HN       PHE  26  61.018  -5.395   5.023
  184    HA   PHE  26           HA       PHE  26  63.806  -5.308   5.533
  185   1HB   PHE  26           HB2      PHE  26  62.582  -3.266   5.649
  186   2HB   PHE  26           HB1      PHE  26  61.447  -3.927   6.823
  187    HD1  PHE  26           HD1      PHE  26  65.031  -3.024   6.337
  188    HD2  PHE  26           HD2      PHE  26  61.864  -3.775   9.131
  189    HE1  PHE  26           HE1      PHE  26  66.483  -2.234   8.189
  190    HE2  PHE  26           HE2      PHE  26  63.311  -2.986  10.989
  191    HZ   PHE  26           HZ       PHE  26  65.622  -2.214  10.516
  192    H    ASP  27           HN       ASP  27  61.153  -6.045   7.834
  193    HA   ASP  27           HA       ASP  27  62.773  -6.765  10.027
  194   1HB   ASP  27           HB2      ASP  27  60.028  -7.635   9.135
  195   2HB   ASP  27           HB1      ASP  27  60.766  -8.327  10.580
  196    H    MET  28           HN       MET  28  62.018  -8.555   7.109
  197    HA   MET  28           HA       MET  28  62.667 -11.177   7.970
  198   1HB   MET  28           HB2      MET  28  62.324  -9.794   5.445
  199   2HB   MET  28           HB1      MET  28  63.663 -10.938   5.352
  200   1HG   MET  28           HG2      MET  28  62.236 -12.742   6.154
  201   2HG   MET  28           HG1      MET  28  60.901 -11.616   6.402
  202   1HE   MET  28           HE2      MET  28  63.601 -12.560   4.084
  203   2HE   MET  28           HE1      MET  28  62.894 -12.797   2.488
  204   3HE   MET  28           HE3      MET  28  63.239 -11.164   3.072
  205    H    PHE  29           HN       PHE  29  64.828  -8.814   6.352
  206    HA   PHE  29           HA       PHE  29  67.175 -10.417   7.055
  207   1HB   PHE  29           HB2      PHE  29  67.201  -7.583   6.005
  208   2HB   PHE  29           HB1      PHE  29  68.430  -8.834   5.805
  209    HD1  PHE  29           HD1      PHE  29  68.080 -10.715   4.253
  210    HD2  PHE  29           HD2      PHE  29  65.191  -7.562   4.645
  211    HE1  PHE  29           HE1      PHE  29  66.991 -11.453   2.151
  212    HE2  PHE  29           HE2      PHE  29  64.100  -8.301   2.545
  213    HZ   PHE  29           HZ       PHE  29  65.000 -10.246   1.298
  214    H    ASP  30           HN       ASP  30  65.252  -8.616   8.938
  215    HA   ASP  30           HA       ASP  30  67.528  -7.434  10.479
  216   1HB   ASP  30           HB2      ASP  30  65.733  -5.850   9.685
  217   2HB   ASP  30           HB1      ASP  30  64.589  -6.729  10.699
  218    H    ALA  31           HN       ALA  31  67.556  -9.950  11.036
  219    HA   ALA  31           HA       ALA  31  65.556 -10.879  12.915
  220   1HB   ALA  31           HB2      ALA  31  68.380 -11.845  12.364
  221   2HB   ALA  31           HB1      ALA  31  67.209 -12.694  13.373
  222   3HB   ALA  31           HB3      ALA  31  66.898 -12.482  11.650
  223    H    ASP  32           HN       ASP  32  68.329  -8.841  13.163
  224    HA   ASP  32           HA       ASP  32  68.780  -9.316  16.010
  225   1HB   ASP  32           HB2      ASP  32  69.687  -6.918  14.407
  226   2HB   ASP  32           HB1      ASP  32  70.423  -7.585  15.864
  227    H    GLY  33           HN       GLY  33  66.492  -7.582  14.195
  228   1HA   GLY  33           HA2      GLY  33  64.859  -6.011  14.805
  229   2HA   GLY  33           HA1      GLY  33  65.060  -6.637  16.443
  230    H    GLY  34           HN       GLY  34  67.806  -5.276  14.789
  231   1HA   GLY  34           HA2      GLY  34  68.006  -3.200  16.859
  232   2HA   GLY  34           HA1      GLY  34  69.207  -3.540  15.615
  233    H    GLY  35           HN       GLY  35  66.237  -3.377  14.119
  234   1HA   GLY  35           HA2      GLY  35  65.073  -1.647  13.002
  235   2HA   GLY  35           HA1      GLY  35  66.022  -0.471  13.912
  236    H    ASP  36           HN       ASP  36  68.013  -2.804  12.490
  237    HA   ASP  36           HA       ASP  36  68.264  -1.447   9.894
  238   1HB   ASP  36           HB2      ASP  36  70.643  -0.849  10.256
  239   2HB   ASP  36           HB1      ASP  36  69.582   0.025  11.362
  240    H    ILE  37           HN       ILE  37  69.272  -2.787   8.380
  241    HA   ILE  37           HA       ILE  37  70.210  -5.418   9.440
  242    HB   ILE  37           HB       ILE  37  68.488  -6.213   8.209
  243   1HG1  ILE  37          HG12      ILE  37  70.649  -6.608   6.784
  244   2HG1  ILE  37          HG11      ILE  37  69.079  -6.951   6.073
  245   1HG2  ILE  37          HG22      ILE  37  68.561  -3.603   6.680
  246   2HG2  ILE  37          HG21      ILE  37  67.408  -4.893   6.346
  247   3HG2  ILE  37          HG23      ILE  37  67.401  -4.091   7.915
  248   1HD1  ILE  37          HD13      ILE  37  70.634  -4.371   5.701
  249   2HD1  ILE  37          HD12      ILE  37  70.509  -5.668   4.514
  250   3HD1  ILE  37          HD11      ILE  37  69.073  -4.752   4.973
  251    H    SER  38           HN       SER  38  71.963  -6.424   8.250
  252    HA   SER  38           HA       SER  38  74.087  -4.605   7.631
  253   1HB   SER  38           HB2      SER  38  73.840  -7.533   6.882
  254   2HB   SER  38           HB1      SER  38  75.331  -6.597   6.923
  255    HG   SER  38           HG       SER  38  73.625  -7.316   9.069
  256    H    THR  39           HN       THR  39  74.772  -3.760   5.685
  257    HA   THR  39           HA       THR  39  72.975  -3.586   3.487
  258    HB   THR  39           HB       THR  39  74.908  -2.642   2.247
  259    HG1  THR  39           HG1      THR  39  76.242  -3.858   4.380
  260   1HG2  THR  39          HG22      THR  39  74.150  -1.813   4.996
  261   2HG2  THR  39          HG21      THR  39  75.586  -1.046   4.315
  262   3HG2  THR  39          HG23      THR  39  74.037  -0.920   3.480
  263    H    LYS  40           HN       LYS  40  75.336  -6.001   4.332
  264    HA   LYS  40           HA       LYS  40  75.794  -7.127   1.749
  265   1HB   LYS  40           HB2      LYS  40  76.607  -9.057   2.897
  266   2HB   LYS  40           HB1      LYS  40  76.993  -7.690   3.942
  267   1HG   LYS  40           HG2      LYS  40  75.010  -8.130   5.308
  268   2HG   LYS  40           HG1      LYS  40  74.539  -9.448   4.234
  269   1HD   LYS  40           HD2      LYS  40  75.986 -10.891   5.200
  270   2HD   LYS  40           HD1      LYS  40  77.293  -9.707   5.194
  271   1HE   LYS  40           HE2      LYS  40  76.815  -8.962   7.306
  272   2HE   LYS  40           HE1      LYS  40  75.080  -9.202   7.108
  273   1HZ   LYS  40           HZ3      LYS  40  76.001 -11.718   7.001
  274   2HZ   LYS  40           HZ2      LYS  40  77.092 -11.020   8.102
  275   3HZ   LYS  40           HZ1      LYS  40  75.422 -10.971   8.410
  276    H    ALA  41           HN       ALA  41  73.231  -7.673   4.145
  277    HA   ALA  41           HA       ALA  41  71.946  -9.736   2.526
  278   1HB   ALA  41           HB3      ALA  41  71.729  -9.696   4.997
  279   2HB   ALA  41           HB2      ALA  41  70.874  -8.157   4.886
  280   3HB   ALA  41           HB1      ALA  41  70.155  -9.617   4.206
  281    H    LEU  42           HN       LEU  42  72.105  -6.365   2.388
  282    HA   LEU  42           HA       LEU  42  69.447  -5.694   1.580
  283   1HB   LEU  42           HB2      LEU  42  71.865  -4.331   1.924
  284   2HB   LEU  42           HB1      LEU  42  71.509  -4.155   0.207
  285    HG   LEU  42           HG       LEU  42  69.384  -3.155   0.651
  286   1HD1  LEU  42          HD13      LEU  42  69.588  -4.655   3.100
  287   2HD1  LEU  42          HD12      LEU  42  69.271  -2.964   3.484
  288   3HD1  LEU  42          HD11      LEU  42  68.174  -3.848   2.422
  289   1HD2  LEU  42          HD21      LEU  42  71.726  -1.984   1.390
  290   2HD2  LEU  42          HD23      LEU  42  70.169  -1.154   1.415
  291   3HD2  LEU  42          HD22      LEU  42  70.815  -1.862   2.895
  292    H    GLY  43           HN       GLY  43  72.320  -6.596  -0.351
  293   1HA   GLY  43           HA2      GLY  43  71.288  -6.356  -2.923
  294   2HA   GLY  43           HA1      GLY  43  72.368  -7.674  -2.453
  295    H    THR  44           HN       THR  44  70.682  -8.930  -0.560
  296    HA   THR  44           HA       THR  44  68.963 -10.459  -2.342
  297    HB   THR  44           HB       THR  44  69.151 -10.534   0.682
  298    HG1  THR  44           HG1      THR  44  70.737 -12.016   0.389
  299   1HG2  THR  44          HG21      THR  44  67.257 -11.691  -0.851
  300   2HG2  THR  44          HG23      THR  44  68.511 -12.927  -0.958
  301   3HG2  THR  44          HG22      THR  44  67.883 -12.439   0.619
  302    H    VAL  45           HN       VAL  45  68.501  -7.992   0.158
  303    HA   VAL  45           HA       VAL  45  65.718  -8.172   0.521
  304    HB   VAL  45           HB       VAL  45  67.587  -5.792   0.487
  305   1HG1  VAL  45          HG12      VAL  45  65.308  -5.038  -0.125
  306   2HG1  VAL  45          HG11      VAL  45  64.664  -5.853   1.300
  307   3HG1  VAL  45          HG13      VAL  45  65.758  -4.484   1.488
  308   1HG2  VAL  45          HG21      VAL  45  67.061  -7.847   2.330
  309   2HG2  VAL  45          HG23      VAL  45  67.940  -6.351   2.643
  310   3HG2  VAL  45          HG22      VAL  45  66.207  -6.438   2.957
  311    H    MET  46           HN       MET  46  67.451  -6.121  -1.840
  312    HA   MET  46           HA       MET  46  65.049  -5.364  -3.245
  313   1HB   MET  46           HB2      MET  46  66.651  -4.632  -5.037
  314   2HB   MET  46           HB1      MET  46  67.052  -3.998  -3.441
  315   1HG   MET  46           HG2      MET  46  68.390  -6.415  -3.482
  316   2HG   MET  46           HG1      MET  46  68.558  -5.853  -5.144
  317   1HE   MET  46           HE2      MET  46  68.498  -2.928  -5.143
  318   2HE   MET  46           HE1      MET  46  70.157  -2.405  -4.867
  319   3HE   MET  46           HE3      MET  46  69.825  -3.791  -5.915
  320    H    ARG  47           HN       ARG  47  66.954  -8.220  -3.234
  321    HA   ARG  47           HA       ARG  47  66.688  -9.186  -5.864
  322   1HB   ARG  47           HB2      ARG  47  67.894 -10.265  -3.867
  323   2HB   ARG  47           HB1      ARG  47  66.324 -10.940  -3.433
  324   1HG   ARG  47           HG2      ARG  47  66.432 -12.493  -5.069
  325   2HG   ARG  47           HG1      ARG  47  66.924 -11.297  -6.267
  326   1HD   ARG  47           HD2      ARG  47  68.974 -12.240  -6.211
  327   2HD   ARG  47           HD1      ARG  47  69.150 -11.550  -4.598
  328    HE   ARG  47           HE       ARG  47  68.029 -13.770  -3.831
  329   1HH1  ARG  47          HH21      ARG  47  70.614 -13.260  -5.971
  330   2HH1  ARG  47          HH22      ARG  47  70.887 -14.940  -6.290
  331   1HH2  ARG  47          HH11      ARG  47  68.102 -16.003  -4.522
  332   2HH2  ARG  47          HH12      ARG  47  69.466 -16.492  -5.469
  333    H    MET  48           HN       MET  48  64.466  -9.951  -3.145
  334    HA   MET  48           HA       MET  48  62.461 -11.052  -4.905
  335   1HB   MET  48           HB2      MET  48  61.060 -11.166  -2.945
  336   2HB   MET  48           HB1      MET  48  62.704 -11.554  -2.433
  337   1HG   MET  48           HG2      MET  48  63.036  -9.288  -1.614
  338   2HG   MET  48           HG1      MET  48  61.462  -8.794  -2.243
  339   1HE   MET  48           HE2      MET  48  63.390 -11.210  -0.419
  340   2HE   MET  48           HE1      MET  48  63.019 -10.709   1.228
  341   3HE   MET  48           HE3      MET  48  62.264 -12.159   0.549
  342    H    LEU  49           HN       LEU  49  63.343  -7.853  -4.051
  343    HA   LEU  49           HA       LEU  49  60.790  -6.563  -4.338
  344   1HB   LEU  49           HB2      LEU  49  63.658  -5.699  -4.432
  345   2HB   LEU  49           HB1      LEU  49  62.419  -4.584  -5.006
  346    HG   LEU  49           HG       LEU  49  63.073  -4.447  -2.511
  347   1HD1  LEU  49          HD12      LEU  49  60.351  -4.564  -3.718
  348   2HD1  LEU  49          HD11      LEU  49  60.454  -4.460  -1.960
  349   3HD1  LEU  49          HD13      LEU  49  61.190  -3.210  -2.962
  350   1HD2  LEU  49          HD22      LEU  49  62.773  -7.090  -2.437
  351   2HD2  LEU  49          HD21      LEU  49  62.371  -6.099  -1.038
  352   3HD2  LEU  49          HD23      LEU  49  61.095  -6.663  -2.116
  353    H    GLY  50           HN       GLY  50  63.238  -7.643  -6.621
  354   1HA   GLY  50           HA2      GLY  50  62.222  -8.191  -8.893
  355   2HA   GLY  50           HA1      GLY  50  61.551  -6.560  -8.842
  356    H    GLN  51           HN       GLN  51  64.784  -7.445  -7.722
  357    HA   GLN  51           HA       GLN  51  65.992  -6.245 -10.147
  358   1HB   GLN  51           HB2      GLN  51  66.577  -5.210  -7.356
  359   2HB   GLN  51           HB1      GLN  51  67.315  -4.646  -8.856
  360   1HG   GLN  51           HG2      GLN  51  65.188  -3.817  -9.664
  361   2HG   GLN  51           HG1      GLN  51  64.341  -4.532  -8.294
  362   1HE2  GLN  51          HE22      GLN  51  65.004  -1.813  -6.156
  363   2HE2  GLN  51          HE21      GLN  51  64.196  -3.287  -6.391
  364    H    ASN  52           HN       ASN  52  68.204  -6.862 -10.419
  365    HA   ASN  52           HA       ASN  52  69.416  -8.596  -8.352
  366   1HB   ASN  52           HB2      ASN  52  68.098 -10.165  -9.705
  367   2HB   ASN  52           HB1      ASN  52  68.847  -9.547 -11.177
  368   1HD2  ASN  52          HD22      ASN  52  70.961 -12.414 -10.553
  369   2HD2  ASN  52          HD21      ASN  52  69.511 -11.974 -11.316
  370    HA   PRO  53           HA       PRO  53  72.375  -5.947 -10.721
  371   1HB   PRO  53           HB2      PRO  53  73.350  -4.634  -8.512
  372   2HB   PRO  53           HB1      PRO  53  71.959  -4.068  -9.454
  373   1HG   PRO  53           HG2      PRO  53  72.002  -5.373  -6.773
  374   2HG   PRO  53           HG1      PRO  53  70.806  -4.263  -7.461
  375   1HD   PRO  53           HD2      PRO  53  70.532  -7.073  -7.256
  376   2HD   PRO  53           HD1      PRO  53  69.511  -5.991  -8.227
  377    H    THR  54           HN       THR  54  74.811  -5.924 -10.408
  378    HA   THR  54           HA       THR  54  75.676  -8.505  -9.239
  379    HB   THR  54           HB       THR  54  76.378  -7.888 -11.551
  380    HG1  THR  54           HG1      THR  54  77.920  -9.149 -10.898
  381   1HG2  THR  54          HG23      THR  54  77.662  -5.598 -10.060
  382   2HG2  THR  54          HG22      THR  54  78.228  -6.113 -11.649
  383   3HG2  THR  54          HG21      THR  54  76.578  -5.522 -11.450
  384    H    LYS  55           HN       LYS  55  77.711  -8.526  -7.938
  385    HA   LYS  55           HA       LYS  55  77.580  -6.860  -5.669
  386   1HB   LYS  55           HB2      LYS  55  79.674  -8.639  -6.849
  387   2HB   LYS  55           HB1      LYS  55  80.155  -7.543  -5.553
  388   1HG   LYS  55           HG2      LYS  55  79.476  -9.412  -4.337
  389   2HG   LYS  55           HG1      LYS  55  77.992  -8.460  -4.367
  390   1HD   LYS  55           HD2      LYS  55  77.075  -9.771  -6.148
  391   2HD   LYS  55           HD1      LYS  55  78.625 -10.557  -6.453
  392   1HE   LYS  55           HE2      LYS  55  78.506 -11.824  -4.458
  393   2HE   LYS  55           HE1      LYS  55  77.246 -10.793  -3.780
  394   1HZ   LYS  55           HZ3      LYS  55  75.916 -11.566  -5.833
  395   2HZ   LYS  55           HZ2      LYS  55  77.032 -12.845  -5.878
  396   3HZ   LYS  55           HZ1      LYS  55  76.061 -12.610  -4.505
  397    H    GLU  56           HN       GLU  56  78.914  -6.209  -8.795
  398    HA   GLU  56           HA       GLU  56  80.843  -4.226  -8.120
  399   1HB   GLU  56           HB2      GLU  56  79.737  -5.279 -10.481
  400   2HB   GLU  56           HB1      GLU  56  79.395  -3.549 -10.539
  401   1HG   GLU  56           HG2      GLU  56  81.779  -3.071 -10.071
  402   2HG   GLU  56           HG1      GLU  56  82.114  -4.802 -10.050
  403    H    GLU  57           HN       GLU  57  77.741  -3.371  -9.653
  404    HA   GLU  57           HA       GLU  57  77.708  -0.731  -8.600
  405   1HB   GLU  57           HB2      GLU  57  75.203  -0.869  -9.138
  406   2HB   GLU  57           HB1      GLU  57  76.311  -1.173 -10.477
  407   1HG   GLU  57           HG2      GLU  57  75.921  -3.663  -9.182
  408   2HG   GLU  57           HG1      GLU  57  74.324  -2.933  -9.356
  409    H    LEU  58           HN       LEU  58  77.024  -3.728  -7.078
  410    HA   LEU  58           HA       LEU  58  75.104  -2.829  -5.132
  411   1HB   LEU  58           HB2      LEU  58  75.618  -5.234  -5.640
  412   2HB   LEU  58           HB1      LEU  58  77.165  -5.032  -4.819
  413    HG   LEU  58           HG       LEU  58  75.595  -4.061  -2.892
  414   1HD1  LEU  58          HD12      LEU  58  73.725  -5.021  -4.780
  415   2HD1  LEU  58          HD11      LEU  58  73.720  -6.183  -3.453
  416   3HD1  LEU  58          HD13      LEU  58  73.397  -4.478  -3.135
  417   1HD2  LEU  58          HD21      LEU  58  76.032  -6.998  -3.518
  418   2HD2  LEU  58          HD23      LEU  58  77.113  -5.946  -2.604
  419   3HD2  LEU  58          HD22      LEU  58  75.537  -6.380  -1.941
  420    H    ASP  59           HN       ASP  59  78.650  -3.300  -4.876
  421    HA   ASP  59           HA       ASP  59  78.966  -2.285  -2.265
  422   1HB   ASP  59           HB2      ASP  59  80.670  -3.200  -4.212
  423   2HB   ASP  59           HB1      ASP  59  81.084  -1.485  -4.157
  424    H    ALA  60           HN       ALA  60  79.139  -0.495  -5.360
  425    HA   ALA  60           HA       ALA  60  79.587   2.071  -4.218
  426   1HB   ALA  60           HB1      ALA  60  78.432   1.093  -6.811
  427   2HB   ALA  60           HB3      ALA  60  78.322   2.808  -6.411
  428   3HB   ALA  60           HB2      ALA  60  79.901   2.028  -6.527
  429    H    ILE  61           HN       ILE  61  76.591   0.283  -4.825
  430    HA   ILE  61           HA       ILE  61  74.772   2.405  -4.264
  431    HB   ILE  61           HB       ILE  61  74.605  -0.599  -4.163
  432   1HG1  ILE  61          HG12      ILE  61  73.285   1.614  -5.757
  433   2HG1  ILE  61          HG11      ILE  61  74.449   0.427  -6.343
  434   1HG2  ILE  61          HG22      ILE  61  72.489   1.361  -3.237
  435   2HG2  ILE  61          HG21      ILE  61  72.149  -0.316  -3.660
  436   3HG2  ILE  61          HG23      ILE  61  73.207   0.053  -2.298
  437   1HD1  ILE  61          HD13      ILE  61  72.670  -1.318  -5.507
  438   2HD1  ILE  61          HD12      ILE  61  71.558   0.044  -5.624
  439   3HD1  ILE  61          HD11      ILE  61  72.430  -0.507  -7.054
  440    H    ILE  62           HN       ILE  62  76.292  -0.003  -2.117
  441    HA   ILE  62           HA       ILE  62  74.939   0.753   0.269
  442    HB   ILE  62           HB       ILE  62  77.738  -0.349  -0.122
  443   1HG1  ILE  62          HG12      ILE  62  75.083  -1.662   0.554
  444   2HG1  ILE  62          HG11      ILE  62  75.941  -1.797  -0.981
  445   1HG2  ILE  62          HG22      ILE  62  77.441   0.754   2.084
  446   2HG2  ILE  62          HG21      ILE  62  76.017  -0.245   2.375
  447   3HG2  ILE  62          HG23      ILE  62  77.607  -0.995   2.242
  448   1HD1  ILE  62          HD12      ILE  62  77.318  -2.543   1.589
  449   2HD1  ILE  62          HD11      ILE  62  76.241  -3.691   0.794
  450   3HD1  ILE  62          HD13      ILE  62  77.665  -3.087  -0.052
  451    H    GLU  63           HN       GLU  63  78.066   1.896  -1.046
  452    HA   GLU  63           HA       GLU  63  78.530   3.786   1.069
  453   1HB   GLU  63           HB2      GLU  63  80.075   2.835  -0.916
  454   2HB   GLU  63           HB1      GLU  63  79.589   4.363  -1.654
  455   1HG   GLU  63           HG2      GLU  63  81.444   5.080  -0.473
  456   2HG   GLU  63           HG1      GLU  63  80.201   5.312   0.757
  457    H    GLU  64           HN       GLU  64  76.248   3.780  -1.431
  458    HA   GLU  64           HA       GLU  64  76.119   6.746  -1.547
  459   1HB   GLU  64           HB2      GLU  64  75.166   4.518  -3.248
  460   2HB   GLU  64           HB1      GLU  64  74.073   5.896  -3.127
  461   1HG   GLU  64           HG2      GLU  64  75.627   7.380  -4.054
  462   2HG   GLU  64           HG1      GLU  64  76.999   6.351  -3.646
  463    H    VAL  65           HN       VAL  65  74.614   4.035  -0.030
  464    HA   VAL  65           HA       VAL  65  72.162   5.573   0.607
  465    HB   VAL  65           HB       VAL  65  72.987   2.766   1.415
  466   1HG1  VAL  65          HG12      VAL  65  70.961   4.463   2.410
  467   2HG1  VAL  65          HG11      VAL  65  70.149   3.315   1.343
  468   3HG1  VAL  65          HG13      VAL  65  71.129   2.728   2.688
  469   1HG2  VAL  65          HG23      VAL  65  71.547   3.914  -0.947
  470   2HG2  VAL  65          HG22      VAL  65  72.670   2.556  -0.873
  471   3HG2  VAL  65          HG21      VAL  65  71.011   2.359  -0.313
  472    H    ASP  66           HN       ASP  66  75.160   4.500   2.082
  473    HA   ASP  66           HA       ASP  66  74.290   5.236   4.786
  474   1HB   ASP  66           HB2      ASP  66  76.508   3.809   3.594
  475   2HB   ASP  66           HB1      ASP  66  77.101   5.027   4.724
  476    H    GLU  67           HN       GLU  67  73.707   7.495   3.921
  477    HA   GLU  67           HA       GLU  67  75.791   9.326   3.166
  478   1HB   GLU  67           HB2      GLU  67  74.146  11.085   3.660
  479   2HB   GLU  67           HB1      GLU  67  73.384   9.771   2.763
  480   1HG   GLU  67           HG2      GLU  67  71.865   9.612   4.416
  481   2HG   GLU  67           HG1      GLU  67  73.161   9.053   5.476
  482    H    ASP  68           HN       ASP  68  75.001   7.876   6.149
  483    HA   ASP  68           HA       ASP  68  76.363  10.045   7.676
  484   1HB   ASP  68           HB2      ASP  68  75.581   8.494   9.649
  485   2HB   ASP  68           HB1      ASP  68  74.400   9.522   8.836
  486    H    GLY  69           HN       GLY  69  76.717   6.766   6.560
  487   1HA   GLY  69           HA2      GLY  69  78.707   5.486   6.487
  488   2HA   GLY  69           HA1      GLY  69  79.519   6.763   7.394
  489    H    SER  70           HN       SER  70  76.514   5.490   8.592
  490    HA   SER  70           HA       SER  70  77.681   4.760  11.115
  491   1HB   SER  70           HB2      SER  70  75.345   3.471  11.228
  492   2HB   SER  70           HB1      SER  70  75.435   5.224  11.367
  493    HG   SER  70           HG       SER  70  73.947   4.819   9.801
  494    H    GLY  71           HN       GLY  71  77.315   3.079   8.112
  495   1HA   GLY  71           HA2      GLY  71  78.435   1.030   7.577
  496   2HA   GLY  71           HA1      GLY  71  78.640   0.721   9.302
  497    H    THR  72           HN       THR  72  75.496   1.697   8.861
  498    HA   THR  72           HA       THR  72  74.505  -1.028   8.200
  499    HB   THR  72           HB       THR  72  72.877  -0.729  10.185
  500    HG1  THR  72           HG1      THR  72  73.765   1.523  10.413
  501   1HG2  THR  72          HG23      THR  72  75.772  -1.455  10.267
  502   2HG2  THR  72          HG22      THR  72  74.900  -1.371  11.798
  503   3HG2  THR  72          HG21      THR  72  74.352  -2.468  10.531
  504    H    ILE  73           HN       ILE  73  72.214  -1.015   7.596
  505    HA   ILE  73           HA       ILE  73  71.308   1.701   6.726
  506    HB   ILE  73           HB       ILE  73  70.475  -0.948   5.529
  507   1HG1  ILE  73          HG12      ILE  73  72.995  -0.410   5.413
  508   2HG1  ILE  73          HG11      ILE  73  72.175  -0.727   3.884
  509   1HG2  ILE  73          HG23      ILE  73  70.306   1.931   4.596
  510   2HG2  ILE  73          HG22      ILE  73  69.877   0.538   3.604
  511   3HG2  ILE  73          HG21      ILE  73  68.958   0.896   5.066
  512   1HD1  ILE  73          HD13      ILE  73  72.084   2.094   4.715
  513   2HD1  ILE  73          HD12      ILE  73  73.713   1.494   4.406
  514   3HD1  ILE  73          HD11      ILE  73  72.484   1.396   3.144
  515    H    ASP  74           HN       ASP  74  69.383   2.404   7.522
  516    HA   ASP  74           HA       ASP  74  67.804   0.502   9.184
  517   1HB   ASP  74           HB2      ASP  74  67.290   3.460   9.086
  518   2HB   ASP  74           HB1      ASP  74  67.062   2.335  10.426
  519    H    PHE  75           HN       PHE  75  65.330   0.976   9.067
  520    HA   PHE  75           HA       PHE  75  64.367   0.384   6.499
  521   1HB   PHE  75           HB2      PHE  75  63.138   0.260   8.762
  522   2HB   PHE  75           HB1      PHE  75  62.747   1.961   8.501
  523    HD1  PHE  75           HD2      PHE  75  63.005  -0.952   6.168
  524    HD2  PHE  75           HD1      PHE  75  60.518   2.135   7.814
  525    HE1  PHE  75           HE2      PHE  75  61.172  -1.609   4.629
  526    HE2  PHE  75           HE1      PHE  75  58.685   1.484   6.274
  527    HZ   PHE  75           HZ       PHE  75  59.012  -0.389   4.682
  528    H    GLU  76           HN       GLU  76  64.986   3.535   7.967
  529    HA   GLU  76           HA       GLU  76  63.630   5.042   5.893
  530   1HB   GLU  76           HB2      GLU  76  64.995   6.965   6.852
  531   2HB   GLU  76           HB1      GLU  76  63.950   6.130   8.001
  532   1HG   GLU  76           HG2      GLU  76  66.442   4.743   7.939
  533   2HG   GLU  76           HG1      GLU  76  66.794   6.463   8.106
  534    H    GLU  77           HN       GLU  77  66.905   3.811   6.326
  535    HA   GLU  77           HA       GLU  77  67.940   5.346   4.051
  536   1HB   GLU  77           HB2      GLU  77  69.108   3.137   5.763
  537   2HB   GLU  77           HB1      GLU  77  69.978   3.876   4.419
  538   1HG   GLU  77           HG2      GLU  77  69.632   6.114   5.497
  539   2HG   GLU  77           HG1      GLU  77  68.926   5.287   6.886
  540    H    PHE  78           HN       PHE  78  66.394   2.285   4.552
  541    HA   PHE  78           HA       PHE  78  67.417   0.941   2.222
  542   1HB   PHE  78           HB2      PHE  78  66.423  -0.606   3.597
  543   2HB   PHE  78           HB1      PHE  78  65.221   0.537   4.188
  544    HD1  PHE  78           HD2      PHE  78  63.288   1.166   2.674
  545    HD2  PHE  78           HD1      PHE  78  65.908  -2.133   1.853
  546    HE1  PHE  78           HE2      PHE  78  61.601   0.213   1.122
  547    HE2  PHE  78           HE1      PHE  78  64.224  -3.088   0.301
  548    HZ   PHE  78           HZ       PHE  78  62.070  -1.914  -0.064
  549    H    LEU  79           HN       LEU  79  64.436   2.816   2.833
  550    HA   LEU  79           HA       LEU  79  63.214   2.614   0.332
  551   1HB   LEU  79           HB2      LEU  79  63.447   5.128   2.016
  552   2HB   LEU  79           HB1      LEU  79  62.228   4.823   0.778
  553    HG   LEU  79           HG       LEU  79  62.620   3.051   3.203
  554   1HD1  LEU  79          HD11      LEU  79  60.972   5.520   2.768
  555   2HD1  LEU  79          HD13      LEU  79  60.317   4.222   3.765
  556   3HD1  LEU  79          HD12      LEU  79  61.837   4.995   4.214
  557   1HD2  LEU  79          HD22      LEU  79  61.463   2.323   0.945
  558   2HD2  LEU  79          HD21      LEU  79  60.706   1.924   2.487
  559   3HD2  LEU  79          HD23      LEU  79  60.125   3.299   1.550
  560    H    VAL  80           HN       VAL  80  66.078   4.439   1.232
  561    HA   VAL  80           HA       VAL  80  66.205   6.039  -1.169
  562    HB   VAL  80           HB       VAL  80  68.275   5.225   0.882
  563   1HG1  VAL  80          HG13      VAL  80  68.607   6.447  -1.776
  564   2HG1  VAL  80          HG12      VAL  80  69.332   7.378  -0.465
  565   3HG1  VAL  80          HG11      VAL  80  69.809   5.699  -0.725
  566   1HG2  VAL  80          HG21      VAL  80  66.300   7.329   0.617
  567   2HG2  VAL  80          HG23      VAL  80  67.335   6.946   1.992
  568   3HG2  VAL  80          HG22      VAL  80  67.922   8.015   0.718
  569    H    MET  81           HN       MET  81  67.983   3.092  -0.170
  570    HA   MET  81           HA       MET  81  69.403   2.682  -2.562
  571   1HB   MET  81           HB2      MET  81  69.383   1.349  -0.280
  572   2HB   MET  81           HB1      MET  81  68.235   0.318  -1.137
  573   1HG   MET  81           HG2      MET  81  69.830  -0.081  -2.917
  574   2HG   MET  81           HG1      MET  81  70.953   1.090  -2.226
  575   1HE   MET  81           HE2      MET  81  72.601   0.718  -0.587
  576   2HE   MET  81           HE1      MET  81  71.339   0.782   0.641
  577   3HE   MET  81           HE3      MET  81  72.574  -0.481   0.703
  578    H    MET  82           HN       MET  82  66.081   1.724  -1.742
  579    HA   MET  82           HA       MET  82  65.551   0.167  -4.057
  580   1HB   MET  82           HB2      MET  82  63.564   1.965  -2.644
  581   2HB   MET  82           HB1      MET  82  63.214   0.500  -3.561
  582   1HG   MET  82           HG2      MET  82  64.704   0.700  -0.932
  583   2HG   MET  82           HG1      MET  82  63.155  -0.092  -1.225
  584   1HE   MET  82           HE1      MET  82  63.119  -1.444  -3.571
  585   2HE   MET  82           HE3      MET  82  64.017  -2.969  -3.590
  586   3HE   MET  82           HE2      MET  82  62.926  -2.600  -2.256
  587    H    VAL  83           HN       VAL  83  64.668   3.603  -3.505
  588    HA   VAL  83           HA       VAL  83  63.989   4.045  -6.269
  589    HB   VAL  83           HB       VAL  83  64.770   6.067  -4.146
  590   1HG1  VAL  83          HG12      VAL  83  64.070   6.289  -6.943
  591   2HG1  VAL  83          HG11      VAL  83  62.853   7.086  -5.947
  592   3HG1  VAL  83          HG13      VAL  83  64.545   7.560  -5.816
  593   1HG2  VAL  83          HG22      VAL  83  62.592   4.295  -4.203
  594   2HG2  VAL  83          HG21      VAL  83  62.738   5.746  -3.211
  595   3HG2  VAL  83          HG23      VAL  83  61.941   5.828  -4.782
  596    H    ARG  84           HN       ARG  84  66.972   3.601  -4.782
  597    HA   ARG  84           HA       ARG  84  68.642   5.492  -6.074
  598   1HB   ARG  84           HB2      ARG  84  69.007   3.333  -4.376
  599   2HB   ARG  84           HB1      ARG  84  69.815   2.818  -5.858
  600   1HG   ARG  84           HG2      ARG  84  71.400   4.025  -4.455
  601   2HG   ARG  84           HG1      ARG  84  71.046   4.982  -5.893
  602   1HD   ARG  84           HD2      ARG  84  69.085   5.722  -4.026
  603   2HD   ARG  84           HD1      ARG  84  70.588   5.642  -3.107
  604    HE   ARG  84           HE       ARG  84  71.551   7.257  -4.741
  605   1HH1  ARG  84          HH21      ARG  84  69.686   7.069  -6.990
  606   2HH1  ARG  84          HH22      ARG  84  68.629   8.420  -6.751
  607   1HH2  ARG  84          HH11      ARG  84  69.523   8.869  -3.432
  608   2HH2  ARG  84          HH12      ARG  84  68.536   9.439  -4.736
  609    H    GLN  85           HN       GLN  85  66.800   2.940  -7.426
  610    HA   GLN  85           HA       GLN  85  68.184   3.376 -10.020
  611   1HB   GLN  85           HB2      GLN  85  67.626   0.677  -8.762
  612   2HB   GLN  85           HB1      GLN  85  68.037   0.895 -10.463
  613   1HG   GLN  85           HG2      GLN  85  69.958   2.385  -9.064
  614   2HG   GLN  85           HG1      GLN  85  69.787   0.889  -8.147
  615   1HE2  GLN  85          HE22      GLN  85  70.685  -1.124 -11.106
  616   2HE2  GLN  85          HE21      GLN  85  69.446  -1.090  -9.945
  617    H    MET  86           HN       MET  86  65.339   2.161  -8.279
  618    HA   MET  86           HA       MET  86  63.752   1.786 -10.668
  619   1HB   MET  86           HB2      MET  86  61.879   1.500  -9.166
  620   2HB   MET  86           HB1      MET  86  63.277   0.706  -8.444
  621   1HG   MET  86           HG2      MET  86  63.392   2.189  -6.716
  622   2HG   MET  86           HG1      MET  86  62.931   3.558  -7.725
  623   1HE   MET  86           HE1      MET  86  62.497   2.101  -5.002
  624   2HE   MET  86           HE3      MET  86  60.979   2.856  -4.500
  625   3HE   MET  86           HE2      MET  86  61.038   1.129  -4.837
  626    H    LYS  87           HN       LYS  87  64.944   4.569  -9.285
  627    HA   LYS  87           HA       LYS  87  62.752   6.372  -9.337
  628   1HB   LYS  87           HB2      LYS  87  64.484   8.131  -9.749
  629   2HB   LYS  87           HB1      LYS  87  64.919   7.039  -8.433
  630   1HG   LYS  87           HG2      LYS  87  66.792   6.423  -9.515
  631   2HG   LYS  87           HG1      LYS  87  65.849   5.940 -10.925
  632   1HD   LYS  87           HD2      LYS  87  67.314   7.638 -11.719
  633   2HD   LYS  87           HD1      LYS  87  65.754   8.435 -11.520
  634   1HE   LYS  87           HE2      LYS  87  66.424   9.514  -9.531
  635   2HE   LYS  87           HE1      LYS  87  67.778   8.411  -9.285
  636   1HZ   LYS  87           HZ3      LYS  87  67.895   9.819 -11.784
  637   2HZ   LYS  87           HZ2      LYS  87  67.931  10.855 -10.438
  638   3HZ   LYS  87           HZ1      LYS  87  69.089   9.620 -10.596
  639    H    GLU  88           HN       GLU  88  64.455   4.808 -11.922
  640    HA   GLU  88           HA       GLU  88  62.554   5.612 -13.892
  641   1HB   GLU  88           HB2      GLU  88  64.465   7.609 -13.338
  642   2HB   GLU  88           HB1      GLU  88  64.972   6.872 -14.860
  643   1HG   GLU  88           HG2      GLU  88  62.782   7.248 -15.835
  644   2HG   GLU  88           HG1      GLU  88  62.154   7.832 -14.293
  645    H    ASP  89           HN       ASP  89  62.805   3.304 -14.217
  646    HA   ASP  89           HA       ASP  89  65.419   2.388 -15.271
  647   1HB   ASP  89           HB2      ASP  89  63.928   1.053 -13.628
  648   2HB   ASP  89           HB1      ASP  89  62.921   0.710 -15.036
  649    H    ALA  90           HN       ALA  90  63.912   4.309 -16.830
  650    HA   ALA  90           HA       ALA  90  62.370   3.122 -18.902
  651   1HB   ALA  90           HB1      ALA  90  63.521   5.689 -18.343
  652   2HB   ALA  90           HB3      ALA  90  63.895   5.259 -20.012
  653   3HB   ALA  90           HB2      ALA  90  62.219   5.295 -19.464
   
  No H/Q in entry =         653
  Start of MODEL   25
    1   1H    ALA   1           HT3      ALA   1  65.010  12.881  14.100
    2   2H    ALA   1           HT2      ALA   1  63.703  12.049  13.403
    3   3H    ALA   1           HT1      ALA   1  64.625  11.316  14.629
    4    HA   ALA   1           HA       ALA   1  66.470  11.016  13.249
    5   1HB   ALA   1           HB2      ALA   1  64.165   9.752  12.739
    6   2HB   ALA   1           HB1      ALA   1  64.347  10.585  11.195
    7   3HB   ALA   1           HB3      ALA   1  65.606   9.485  11.757
    8    H    SER   2           HN       SER   2  67.873  12.235  12.087
    9    HA   SER   2           HA       SER   2  67.317  14.737  10.960
   10   1HB   SER   2           HB2      SER   2  69.591  14.414  11.083
   11   2HB   SER   2           HB1      SER   2  69.481  12.718  10.620
   12    HG   SER   2           HG       SER   2  70.337  14.427   9.062
   13    H    MET   3           HN       MET   3  66.132  15.321   9.210
   14    HA   MET   3           HA       MET   3  65.347  13.215   7.273
   15   1HB   MET   3           HB2      MET   3  63.663  14.796   8.375
   16   2HB   MET   3           HB1      MET   3  64.354  16.070   7.369
   17   1HG   MET   3           HG2      MET   3  63.078  15.390   5.647
   18   2HG   MET   3           HG1      MET   3  63.874  13.818   5.690
   19   1HE   MET   3           HE3      MET   3  63.635  12.409   7.573
   20   2HE   MET   3           HE2      MET   3  62.403  12.517   8.829
   21   3HE   MET   3           HE1      MET   3  62.136  11.480   7.429
   22    H    THR   4           HN       THR   4  67.327  13.083   6.076
   23    HA   THR   4           HA       THR   4  68.499  15.475   4.886
   24    HB   THR   4           HB       THR   4  69.920  13.843   3.652
   25    HG1  THR   4           HG1      THR   4  68.461  11.881   5.076
   26   1HG2  THR   4          HG23      THR   4  70.095  14.510   6.230
   27   2HG2  THR   4          HG22      THR   4  69.807  12.782   6.439
   28   3HG2  THR   4          HG21      THR   4  71.196  13.338   5.504
   29    H    ASP   5           HN       ASP   5  68.590  15.829   2.531
   30    HA   ASP   5           HA       ASP   5  66.041  15.781   1.283
   31   1HB   ASP   5           HB2      ASP   5  68.744  15.901  -0.086
   32   2HB   ASP   5           HB1      ASP   5  67.208  16.453  -0.753
   33    H    GLN   6           HN       GLN   6  68.391  13.297   1.630
   34    HA   GLN   6           HA       GLN   6  67.870  11.752  -0.711
   35   1HB   GLN   6           HB2      GLN   6  68.551  10.721   2.059
   36   2HB   GLN   6           HB1      GLN   6  68.806   9.877   0.531
   37   1HG   GLN   6           HG2      GLN   6  70.524  11.343  -0.136
   38   2HG   GLN   6           HG1      GLN   6  70.027  12.590   1.009
   39   1HE2  GLN   6          HE22      GLN   6  71.727   9.317   2.814
   40   2HE2  GLN   6          HE21      GLN   6  70.485   9.094   1.678
   41    H    GLN   7           HN       GLN   7  66.279  11.802   2.475
   42    HA   GLN   7           HA       GLN   7  64.391   9.708   1.724
   43   1HB   GLN   7           HB2      GLN   7  64.012  11.662   3.992
   44   2HB   GLN   7           HB1      GLN   7  63.466   9.989   3.882
   45   1HG   GLN   7           HG2      GLN   7  66.343  10.921   4.119
   46   2HG   GLN   7           HG1      GLN   7  65.399  10.118   5.375
   47   1HE2  GLN   7          HE22      GLN   7  67.479   7.588   3.468
   48   2HE2  GLN   7          HE21      GLN   7  67.875   9.045   4.244
   49    H    ALA   8           HN       ALA   8  64.579  13.147   1.369
   50    HA   ALA   8           HA       ALA   8  61.756  13.692   1.173
   51   1HB   ALA   8           HB3      ALA   8  64.179  15.134   0.061
   52   2HB   ALA   8           HB2      ALA   8  62.534  15.758  -0.053
   53   3HB   ALA   8           HB1      ALA   8  63.282  15.530   1.527
   54    H    GLU   9           HN       GLU   9  64.192  12.592  -1.133
   55    HA   GLU   9           HA       GLU   9  62.327  12.853  -3.397
   56   1HB   GLU   9           HB2      GLU   9  65.026  11.476  -3.325
   57   2HB   GLU   9           HB1      GLU   9  64.149  12.026  -4.753
   58   1HG   GLU   9           HG2      GLU   9  64.685  14.234  -4.407
   59   2HG   GLU   9           HG1      GLU   9  64.720  14.061  -2.652
   60    H    ALA  10           HN       ALA  10  63.956  10.178  -1.665
   61    HA   ALA  10           HA       ALA  10  62.635   8.077  -3.074
   62   1HB   ALA  10           HB2      ALA  10  64.125   8.324  -0.507
   63   2HB   ALA  10           HB1      ALA  10  63.093   6.907  -0.697
   64   3HB   ALA  10           HB3      ALA  10  64.386   7.220  -1.856
   65    H    ARG  11           HN       ARG  11  61.928   9.277   0.233
   66    HA   ARG  11           HA       ARG  11  59.464   7.889   0.504
   67   1HB   ARG  11           HB2      ARG  11  60.926   9.349   2.201
   68   2HB   ARG  11           HB1      ARG  11  59.744  10.583   1.757
   69   1HG   ARG  11           HG2      ARG  11  57.937   8.856   2.258
   70   2HG   ARG  11           HG1      ARG  11  59.208   7.866   2.976
   71   1HD   ARG  11           HD2      ARG  11  58.165   9.169   4.738
   72   2HD   ARG  11           HD1      ARG  11  59.789   9.798   4.467
   73    HE   ARG  11           HE       ARG  11  57.434  11.109   3.182
   74   1HH1  ARG  11          HH21      ARG  11  60.663  11.472   3.848
   75   2HH1  ARG  11          HH22      ARG  11  60.534  13.027   4.599
   76   1HH2  ARG  11          HH11      ARG  11  57.069  12.975   4.722
   77   2HH2  ARG  11          HH12      ARG  11  58.499  13.879   5.093
   78    H    ALA  12           HN       ALA  12  60.277  10.731  -1.306
   79    HA   ALA  12           HA       ALA  12  57.575  11.793  -1.462
   80   1HB   ALA  12           HB2      ALA  12  60.170  12.317  -2.880
   81   2HB   ALA  12           HB1      ALA  12  58.672  12.953  -3.559
   82   3HB   ALA  12           HB3      ALA  12  59.173  13.424  -1.935
   83    H    PHE  13           HN       PHE  13  59.505   9.517  -3.342
   84    HA   PHE  13           HA       PHE  13  57.437   9.345  -5.437
   85   1HB   PHE  13           HB2      PHE  13  59.719   9.150  -6.195
   86   2HB   PHE  13           HB1      PHE  13  60.059   7.891  -5.007
   87    HD1  PHE  13           HD1      PHE  13  57.259   8.477  -7.440
   88    HD2  PHE  13           HD2      PHE  13  60.328   5.819  -6.040
   89    HE1  PHE  13           HE1      PHE  13  56.499   6.750  -9.052
   90    HE2  PHE  13           HE2      PHE  13  59.569   4.093  -7.650
   91    HZ   PHE  13           HZ       PHE  13  57.655   4.558  -9.157
   92    H    LEU  14           HN       LEU  14  58.280   7.766  -2.477
   93    HA   LEU  14           HA       LEU  14  56.700   5.357  -3.160
   94   1HB   LEU  14           HB2      LEU  14  58.040   6.037  -0.530
   95   2HB   LEU  14           HB1      LEU  14  57.491   4.450  -1.072
   96    HG   LEU  14           HG       LEU  14  59.555   6.024  -2.615
   97   1HD1  LEU  14          HD12      LEU  14  59.855   4.895  -0.004
   98   2HD1  LEU  14          HD11      LEU  14  60.744   3.884  -1.143
   99   3HD1  LEU  14          HD13      LEU  14  61.098   5.609  -1.032
  100   1HD2  LEU  14          HD21      LEU  14  58.176   3.920  -3.436
  101   2HD2  LEU  14          HD23      LEU  14  59.905   4.032  -3.771
  102   3HD2  LEU  14          HD22      LEU  14  59.328   3.037  -2.434
  103    H    SER  15           HN       SER  15  54.699   4.900  -2.224
  104    HA   SER  15           HA       SER  15  53.389   7.198  -0.861
  105   1HB   SER  15           HB2      SER  15  51.347   6.372  -1.651
  106   2HB   SER  15           HB1      SER  15  52.446   5.921  -2.952
  107    HG   SER  15           HG       SER  15  50.988   4.238  -2.063
  108    H    GLU  16           HN       GLU  16  51.632   6.360   0.802
  109    HA   GLU  16           HA       GLU  16  53.008   5.200   3.000
  110   1HB   GLU  16           HB2      GLU  16  51.111   6.532   3.507
  111   2HB   GLU  16           HB1      GLU  16  50.084   5.639   2.386
  112   1HG   GLU  16           HG2      GLU  16  49.816   3.856   3.830
  113   2HG   GLU  16           HG1      GLU  16  51.358   4.140   4.636
  114    H    GLU  17           HN       GLU  17  50.772   3.773   0.625
  115    HA   GLU  17           HA       GLU  17  50.747   1.157   1.835
  116   1HB   GLU  17           HB2      GLU  17  49.248   2.302  -0.078
  117   2HB   GLU  17           HB1      GLU  17  50.376   1.423  -1.110
  118   1HG   GLU  17           HG2      GLU  17  49.270  -0.087   1.198
  119   2HG   GLU  17           HG1      GLU  17  48.135   0.297  -0.097
  120    H    MET  18           HN       MET  18  52.909   2.771  -0.408
  121    HA   MET  18           HA       MET  18  54.248   0.381  -1.330
  122   1HB   MET  18           HB2      MET  18  55.183   3.266  -1.217
  123   2HB   MET  18           HB1      MET  18  56.025   1.969  -2.067
  124   1HG   MET  18           HG2      MET  18  53.121   2.563  -2.625
  125   2HG   MET  18           HG1      MET  18  54.407   3.450  -3.444
  126   1HE   MET  18           HE1      MET  18  56.671   1.788  -3.936
  127   2HE   MET  18           HE3      MET  18  56.350   0.884  -5.423
  128   3HE   MET  18           HE2      MET  18  55.873   2.575  -5.295
  129    H    ILE  19           HN       ILE  19  55.414   2.938   0.894
  130    HA   ILE  19           HA       ILE  19  57.657   1.561   1.875
  131    HB   ILE  19           HB       ILE  19  55.815   3.557   3.208
  132   1HG1  ILE  19          HG12      ILE  19  58.577   4.316   2.720
  133   2HG1  ILE  19          HG11      ILE  19  57.801   3.765   1.235
  134   1HG2  ILE  19          HG22      ILE  19  58.423   2.376   4.203
  135   2HG2  ILE  19          HG21      ILE  19  57.675   3.825   4.874
  136   3HG2  ILE  19          HG23      ILE  19  56.848   2.272   4.989
  137   1HD1  ILE  19          HD12      ILE  19  55.820   5.287   2.002
  138   2HD1  ILE  19          HD11      ILE  19  57.033   6.056   3.026
  139   3HD1  ILE  19          HD13      ILE  19  57.240   6.039   1.274
  140    H    ALA  20           HN       ALA  20  54.289   0.998   2.501
  141    HA   ALA  20           HA       ALA  20  54.583  -0.411   4.999
  142   1HB   ALA  20           HB3      ALA  20  52.425   0.495   3.875
  143   2HB   ALA  20           HB2      ALA  20  52.441  -1.014   2.963
  144   3HB   ALA  20           HB1      ALA  20  52.327  -1.048   4.722
  145    H    GLU  21           HN       GLU  21  54.537  -1.468   1.598
  146    HA   GLU  21           HA       GLU  21  54.806  -4.277   2.241
  147   1HB   GLU  21           HB2      GLU  21  55.565  -2.862  -0.332
  148   2HB   GLU  21           HB1      GLU  21  55.219  -4.581  -0.132
  149   1HG   GLU  21           HG2      GLU  21  52.907  -4.001   0.591
  150   2HG   GLU  21           HG1      GLU  21  53.262  -2.301   0.279
  151    H    PHE  22           HN       PHE  22  57.127  -1.779   1.161
  152    HA   PHE  22           HA       PHE  22  59.430  -3.438   1.131
  153   1HB   PHE  22           HB2      PHE  22  59.130  -0.482   1.730
  154   2HB   PHE  22           HB1      PHE  22  60.689  -1.281   1.527
  155    HD1  PHE  22           HD1      PHE  22  60.668  -2.957  -0.647
  156    HD2  PHE  22           HD2      PHE  22  58.327   0.610  -0.156
  157    HE1  PHE  22           HE1      PHE  22  60.451  -2.761  -3.109
  158    HE2  PHE  22           HE2      PHE  22  58.110   0.807  -2.619
  159    HZ   PHE  22           HZ       PHE  22  59.172  -0.878  -4.095
  160    H    LYS  23           HN       LYS  23  57.713  -1.923   3.793
  161    HA   LYS  23           HA       LYS  23  59.750  -2.145   5.781
  162   1HB   LYS  23           HB2      LYS  23  57.777  -0.825   6.235
  163   2HB   LYS  23           HB1      LYS  23  56.729  -2.225   6.003
  164   1HG   LYS  23           HG2      LYS  23  57.063  -1.800   8.401
  165   2HG   LYS  23           HG1      LYS  23  57.802  -3.334   7.942
  166   1HD   LYS  23           HD2      LYS  23  59.924  -2.574   8.313
  167   2HD   LYS  23           HD1      LYS  23  59.556  -0.959   7.707
  168   1HE   LYS  23           HE2      LYS  23  59.535  -0.289   9.863
  169   2HE   LYS  23           HE1      LYS  23  58.013  -1.168  10.017
  170   1HZ   LYS  23           HZ2      LYS  23  59.456  -3.189  10.440
  171   2HZ   LYS  23           HZ1      LYS  23  60.743  -2.103  10.662
  172   3HZ   LYS  23           HZ3      LYS  23  59.387  -2.028  11.678
  173    H    ALA  24           HN       ALA  24  57.450  -4.482   4.485
  174    HA   ALA  24           HA       ALA  24  57.715  -6.490   6.482
  175   1HB   ALA  24           HB3      ALA  24  57.129  -6.615   3.521
  176   2HB   ALA  24           HB2      ALA  24  57.184  -8.068   4.520
  177   3HB   ALA  24           HB1      ALA  24  56.003  -6.804   4.865
  178    H    ALA  25           HN       ALA  25  59.689  -5.783   3.608
  179    HA   ALA  25           HA       ALA  25  61.403  -8.074   3.861
  180   1HB   ALA  25           HB2      ALA  25  61.105  -6.121   1.984
  181   2HB   ALA  25           HB1      ALA  25  62.591  -5.590   2.771
  182   3HB   ALA  25           HB3      ALA  25  62.498  -7.200   2.058
  183    H    PHE  26           HN       PHE  26  61.695  -4.721   5.047
  184    HA   PHE  26           HA       PHE  26  64.261  -4.859   6.172
  185   1HB   PHE  26           HB2      PHE  26  62.440  -2.927   6.122
  186   2HB   PHE  26           HB1      PHE  26  62.086  -3.528   7.743
  187    HD1  PHE  26           HD1      PHE  26  65.129  -2.840   5.646
  188    HD2  PHE  26           HD2      PHE  26  63.221  -2.479   9.479
  189    HE1  PHE  26           HE1      PHE  26  67.119  -1.647   6.524
  190    HE2  PHE  26           HE2      PHE  26  65.211  -1.284  10.356
  191    HZ   PHE  26           HZ       PHE  26  67.159  -0.868   8.879
  192    H    ASP  27           HN       ASP  27  61.231  -5.388   8.018
  193    HA   ASP  27           HA       ASP  27  62.374  -6.409  10.353
  194   1HB   ASP  27           HB2      ASP  27  59.756  -6.621   9.022
  195   2HB   ASP  27           HB1      ASP  27  60.124  -7.972  10.096
  196    H    MET  28           HN       MET  28  61.888  -8.033   7.263
  197    HA   MET  28           HA       MET  28  62.340 -10.708   8.141
  198   1HB   MET  28           HB2      MET  28  62.289  -9.266   5.588
  199   2HB   MET  28           HB1      MET  28  63.435 -10.607   5.599
  200   1HG   MET  28           HG2      MET  28  61.762 -12.192   6.092
  201   2HG   MET  28           HG1      MET  28  60.634 -10.958   6.652
  202   1HE   MET  28           HE3      MET  28  62.767 -12.239   3.932
  203   2HE   MET  28           HE2      MET  28  61.934 -11.958   2.406
  204   3HE   MET  28           HE1      MET  28  62.800 -10.636   3.184
  205    H    PHE  29           HN       PHE  29  64.667  -8.394   6.681
  206    HA   PHE  29           HA       PHE  29  66.911 -10.106   7.498
  207   1HB   PHE  29           HB2      PHE  29  67.279  -7.295   6.520
  208   2HB   PHE  29           HB1      PHE  29  68.249  -8.728   6.188
  209    HD1  PHE  29           HD1      PHE  29  67.362 -10.503   4.641
  210    HD2  PHE  29           HD2      PHE  29  65.421  -6.705   5.143
  211    HE1  PHE  29           HE1      PHE  29  66.094 -10.873   2.543
  212    HE2  PHE  29           HE2      PHE  29  64.154  -7.074   3.042
  213    HZ   PHE  29           HZ       PHE  29  64.489  -9.159   1.743
  214    H    ASP  30           HN       ASP  30  64.967  -8.293   9.293
  215    HA   ASP  30           HA       ASP  30  67.197  -7.176  10.949
  216   1HB   ASP  30           HB2      ASP  30  65.231  -5.692   9.897
  217   2HB   ASP  30           HB1      ASP  30  64.386  -6.248  11.342
  218    H    ALA  31           HN       ALA  31  66.656  -9.851  11.252
  219    HA   ALA  31           HA       ALA  31  64.655 -10.293  13.331
  220   1HB   ALA  31           HB2      ALA  31  66.344 -11.910  11.639
  221   2HB   ALA  31           HB1      ALA  31  66.506 -12.433  13.315
  222   3HB   ALA  31           HB3      ALA  31  64.915 -12.390  12.554
  223    H    ASP  32           HN       ASP  32  67.737  -8.946  13.324
  224    HA   ASP  32           HA       ASP  32  68.721 -10.021  15.832
  225   1HB   ASP  32           HB2      ASP  32  70.422  -8.316  15.683
  226   2HB   ASP  32           HB1      ASP  32  70.148  -8.930  14.053
  227    H    GLY  33           HN       GLY  33  66.656  -7.332  14.908
  228   1HA   GLY  33           HA2      GLY  33  65.118  -6.218  16.349
  229   2HA   GLY  33           HA1      GLY  33  65.901  -6.982  17.733
  230    H    GLY  34           HN       GLY  34  67.752  -5.314  15.270
  231   1HA   GLY  34           HA2      GLY  34  68.546  -3.328  17.342
  232   2HA   GLY  34           HA1      GLY  34  69.497  -3.737  15.914
  233    H    GLY  35           HN       GLY  35  67.001  -3.638  14.223
  234   1HA   GLY  35           HA2      GLY  35  65.467  -1.907  13.447
  235   2HA   GLY  35           HA1      GLY  35  66.447  -0.711  14.296
  236    H    ASP  36           HN       ASP  36  68.339  -3.013  12.665
  237    HA   ASP  36           HA       ASP  36  68.386  -1.593  10.094
  238   1HB   ASP  36           HB2      ASP  36  70.720  -0.893  10.266
  239   2HB   ASP  36           HB1      ASP  36  69.800  -0.174  11.589
  240    H    ILE  37           HN       ILE  37  69.226  -2.929   8.480
  241    HA   ILE  37           HA       ILE  37  70.153  -5.601   9.420
  242    HB   ILE  37           HB       ILE  37  68.428  -6.186   8.073
  243   1HG1  ILE  37          HG12      ILE  37  70.687  -6.743   6.847
  244   2HG1  ILE  37          HG11      ILE  37  69.155  -7.010   6.028
  245   1HG2  ILE  37          HG22      ILE  37  68.873  -3.633   6.506
  246   2HG2  ILE  37          HG21      ILE  37  67.580  -4.791   6.186
  247   3HG2  ILE  37          HG23      ILE  37  67.625  -3.921   7.720
  248   1HD1  ILE  37          HD11      ILE  37  69.362  -4.818   4.911
  249   2HD1  ILE  37          HD13      ILE  37  70.907  -4.553   5.720
  250   3HD1  ILE  37          HD12      ILE  37  70.741  -5.854   4.544
  251    H    SER  38           HN       SER  38  71.927  -6.595   8.298
  252    HA   SER  38           HA       SER  38  74.156  -4.840   7.918
  253   1HB   SER  38           HB2      SER  38  73.655  -7.719   7.812
  254   2HB   SER  38           HB1      SER  38  74.858  -7.200   6.634
  255    HG   SER  38           HG       SER  38  75.552  -7.703   8.898
  256    H    THR  39           HN       THR  39  75.050  -3.965   6.074
  257    HA   THR  39           HA       THR  39  73.409  -3.642   3.749
  258    HB   THR  39           HB       THR  39  75.707  -2.845   2.759
  259    HG1  THR  39           HG1      THR  39  77.088  -3.743   4.201
  260   1HG2  THR  39          HG21      THR  39  73.887  -1.360   3.537
  261   2HG2  THR  39          HG23      THR  39  74.483  -1.510   5.189
  262   3HG2  THR  39          HG22      THR  39  75.473  -0.716   3.963
  263    H    LYS  40           HN       LYS  40  75.659  -6.099   4.692
  264    HA   LYS  40           HA       LYS  40  76.281  -7.048   2.024
  265   1HB   LYS  40           HB2      LYS  40  77.067  -9.096   3.224
  266   2HB   LYS  40           HB1      LYS  40  77.746  -7.611   3.891
  267   1HG   LYS  40           HG2      LYS  40  76.752  -7.950   5.889
  268   2HG   LYS  40           HG1      LYS  40  75.196  -8.291   5.131
  269   1HD   LYS  40           HD2      LYS  40  77.270 -10.391   4.825
  270   2HD   LYS  40           HD1      LYS  40  76.637 -10.166   6.455
  271   1HE   LYS  40           HE2      LYS  40  74.304 -10.259   5.418
  272   2HE   LYS  40           HE1      LYS  40  75.088 -10.823   3.942
  273   1HZ   LYS  40           HZ1      LYS  40  76.211 -12.429   5.730
  274   2HZ   LYS  40           HZ3      LYS  40  74.710 -12.186   6.481
  275   3HZ   LYS  40           HZ2      LYS  40  74.777 -12.818   4.905
  276    H    ALA  41           HN       ALA  41  73.602  -7.440   4.194
  277    HA   ALA  41           HA       ALA  41  72.605  -9.869   2.884
  278   1HB   ALA  41           HB1      ALA  41  71.430  -7.994   4.949
  279   2HB   ALA  41           HB3      ALA  41  70.552  -9.381   4.304
  280   3HB   ALA  41           HB2      ALA  41  72.047  -9.625   5.205
  281    H    LEU  42           HN       LEU  42  72.535  -6.526   2.237
  282    HA   LEU  42           HA       LEU  42  69.971  -6.135   1.115
  283   1HB   LEU  42           HB2      LEU  42  72.671  -4.946   0.709
  284   2HB   LEU  42           HB1      LEU  42  71.493  -4.663  -0.564
  285    HG   LEU  42           HG       LEU  42  70.376  -3.143   0.687
  286   1HD1  LEU  42          HD11      LEU  42  70.498  -5.268   2.803
  287   2HD1  LEU  42          HD13      LEU  42  70.080  -3.623   3.279
  288   3HD1  LEU  42          HD12      LEU  42  69.090  -4.477   2.096
  289   1HD2  LEU  42          HD21      LEU  42  73.011  -3.500   1.925
  290   2HD2  LEU  42          HD23      LEU  42  72.210  -2.024   1.385
  291   3HD2  LEU  42          HD22      LEU  42  71.836  -2.703   2.971
  292    H    GLY  43           HN       GLY  43  72.939  -7.299  -0.542
  293   1HA   GLY  43           HA2      GLY  43  71.995  -7.681  -3.109
  294   2HA   GLY  43           HA1      GLY  43  73.059  -8.856  -2.330
  295    H    THR  44           HN       THR  44  71.216  -9.580  -0.248
  296    HA   THR  44           HA       THR  44  69.624 -11.551  -1.685
  297    HB   THR  44           HB       THR  44  69.611 -10.817   1.256
  298    HG1  THR  44           HG1      THR  44  70.986 -12.940  -0.005
  299   1HG2  THR  44          HG22      THR  44  68.661 -13.259  -0.265
  300   2HG2  THR  44          HG21      THR  44  68.786 -13.173   1.492
  301   3HG2  THR  44          HG23      THR  44  67.661 -12.119   0.634
  302    H    VAL  45           HN       VAL  45  68.921  -8.662   0.297
  303    HA   VAL  45           HA       VAL  45  66.090  -8.839   0.211
  304    HB   VAL  45           HB       VAL  45  67.623  -6.235   0.120
  305   1HG1  VAL  45          HG12      VAL  45  64.937  -7.177   0.993
  306   2HG1  VAL  45          HG11      VAL  45  65.713  -5.951   1.996
  307   3HG1  VAL  45          HG13      VAL  45  65.412  -5.633   0.287
  308   1HG2  VAL  45          HG22      VAL  45  67.367  -8.265   2.344
  309   2HG2  VAL  45          HG21      VAL  45  68.828  -7.479   1.745
  310   3HG2  VAL  45          HG23      VAL  45  67.650  -6.557   2.680
  311    H    MET  46           HN       MET  46  68.102  -6.663  -1.793
  312    HA   MET  46           HA       MET  46  66.168  -5.832  -3.603
  313   1HB   MET  46           HB2      MET  46  69.113  -6.291  -3.805
  314   2HB   MET  46           HB1      MET  46  68.225  -5.994  -5.300
  315   1HG   MET  46           HG2      MET  46  67.293  -4.134  -3.341
  316   2HG   MET  46           HG1      MET  46  69.056  -4.089  -3.341
  317   1HE   MET  46           HE3      MET  46  69.861  -2.443  -4.081
  318   2HE   MET  46           HE2      MET  46  70.462  -2.802  -5.699
  319   3HE   MET  46           HE1      MET  46  69.439  -1.392  -5.440
  320    H    ARG  47           HN       ARG  47  67.557  -9.012  -3.322
  321    HA   ARG  47           HA       ARG  47  66.809  -9.882  -5.995
  322   1HB   ARG  47           HB2      ARG  47  68.590 -11.059  -4.860
  323   2HB   ARG  47           HB1      ARG  47  67.542 -11.416  -3.487
  324   1HG   ARG  47           HG2      ARG  47  66.520 -13.144  -4.557
  325   2HG   ARG  47           HG1      ARG  47  66.484 -12.292  -6.100
  326   1HD   ARG  47           HD2      ARG  47  68.155 -13.663  -6.752
  327   2HD   ARG  47           HD1      ARG  47  69.195 -12.749  -5.661
  328    HE   ARG  47           HE       ARG  47  68.734 -14.468  -3.931
  329   1HH1  ARG  47          HH11      ARG  47  69.023 -15.312  -7.157
  330   2HH1  ARG  47          HH12      ARG  47  68.427 -16.927  -6.974
  331   1HH2  ARG  47          HH21      ARG  47  67.421 -16.470  -3.688
  332   2HH2  ARG  47          HH22      ARG  47  67.520 -17.583  -5.011
  333    H    MET  48           HN       MET  48  65.386 -10.301  -2.742
  334    HA   MET  48           HA       MET  48  63.118 -11.804  -3.733
  335   1HB   MET  48           HB2      MET  48  63.993 -10.658  -1.148
  336   2HB   MET  48           HB1      MET  48  62.246 -10.794  -1.358
  337   1HG   MET  48           HG2      MET  48  62.633 -13.193  -2.099
  338   2HG   MET  48           HG1      MET  48  64.304 -13.007  -1.568
  339   1HE   MET  48           HE3      MET  48  64.823 -11.765   0.466
  340   2HE   MET  48           HE2      MET  48  63.484 -10.931   1.252
  341   3HE   MET  48           HE1      MET  48  64.245 -12.304   2.049
  342    H    LEU  49           HN       LEU  49  63.438  -8.424  -2.572
  343    HA   LEU  49           HA       LEU  49  60.871  -7.492  -2.976
  344   1HB   LEU  49           HB2      LEU  49  63.259  -5.941  -3.995
  345   2HB   LEU  49           HB1      LEU  49  61.773  -5.308  -3.288
  346    HG   LEU  49           HG       LEU  49  64.011  -6.780  -1.892
  347   1HD1  LEU  49          HD11      LEU  49  63.010  -4.024  -2.056
  348   2HD1  LEU  49          HD13      LEU  49  63.244  -4.590  -0.402
  349   3HD1  LEU  49          HD12      LEU  49  64.589  -4.618  -1.542
  350   1HD2  LEU  49          HD23      LEU  49  61.165  -6.268  -1.003
  351   2HD2  LEU  49          HD22      LEU  49  62.042  -7.799  -1.004
  352   3HD2  LEU  49          HD21      LEU  49  62.475  -6.536   0.148
  353    H    GLY  50           HN       GLY  50  63.383  -7.603  -5.532
  354   1HA   GLY  50           HA2      GLY  50  62.278  -8.714  -7.656
  355   2HA   GLY  50           HA1      GLY  50  61.223  -7.303  -7.554
  356    H    GLN  51           HN       GLN  51  64.720  -8.076  -7.574
  357    HA   GLN  51           HA       GLN  51  65.221  -6.277  -9.779
  358   1HB   GLN  51           HB2      GLN  51  65.005  -4.998  -7.319
  359   2HB   GLN  51           HB1      GLN  51  66.743  -5.223  -7.513
  360   1HG   GLN  51           HG2      GLN  51  65.947  -3.083  -8.513
  361   2HG   GLN  51           HG1      GLN  51  66.672  -4.156  -9.710
  362   1HE2  GLN  51          HE22      GLN  51  62.649  -3.387  -9.863
  363   2HE2  GLN  51          HE21      GLN  51  63.535  -2.969  -8.477
  364    H    ASN  52           HN       ASN  52  67.019  -7.073 -10.771
  365    HA   ASN  52           HA       ASN  52  69.021  -8.504  -9.071
  366   1HB   ASN  52           HB2      ASN  52  67.860  -9.322 -11.744
  367   2HB   ASN  52           HB1      ASN  52  69.339 -10.026 -11.088
  368   1HD2  ASN  52          HD22      ASN  52  67.557 -11.594  -8.316
  369   2HD2  ASN  52          HD21      ASN  52  68.995 -10.740  -8.614
  370    HA   PRO  53           HA       PRO  53  71.024  -5.269 -11.717
  371   1HB   PRO  53           HB2      PRO  53  72.159  -3.889  -9.625
  372   2HB   PRO  53           HB1      PRO  53  70.551  -3.529 -10.275
  373   1HG   PRO  53           HG2      PRO  53  71.279  -4.905  -7.733
  374   2HG   PRO  53           HG1      PRO  53  69.819  -3.985  -8.133
  375   1HD   PRO  53           HD2      PRO  53  70.032  -6.807  -8.067
  376   2HD   PRO  53           HD1      PRO  53  68.697  -5.877  -8.777
  377    H    THR  54           HN       THR  54  73.515  -4.671 -11.516
  378    HA   THR  54           HA       THR  54  74.957  -7.189 -11.266
  379    HB   THR  54           HB       THR  54  76.945  -5.779 -11.878
  380    HG1  THR  54           HG1      THR  54  76.771  -3.674 -11.896
  381   1HG2  THR  54          HG22      THR  54  75.284  -6.780 -13.543
  382   2HG2  THR  54          HG21      THR  54  74.573  -5.170 -13.649
  383   3HG2  THR  54          HG23      THR  54  76.251  -5.429 -14.131
  384    H    LYS  55           HN       LYS  55  76.071  -7.896  -9.498
  385    HA   LYS  55           HA       LYS  55  75.804  -6.858  -6.935
  386   1HB   LYS  55           HB2      LYS  55  77.590  -8.763  -8.243
  387   2HB   LYS  55           HB1      LYS  55  78.380  -7.926  -6.908
  388   1HG   LYS  55           HG2      LYS  55  76.974  -8.826  -5.327
  389   2HG   LYS  55           HG1      LYS  55  75.602  -8.896  -6.436
  390   1HD   LYS  55           HD2      LYS  55  76.131 -10.988  -7.152
  391   2HD   LYS  55           HD1      LYS  55  77.860 -10.635  -7.193
  392   1HE   LYS  55           HE2      LYS  55  77.341 -12.336  -5.477
  393   2HE   LYS  55           HE1      LYS  55  77.975 -10.863  -4.743
  394   1HZ   LYS  55           HZ3      LYS  55  75.334 -10.370  -4.815
  395   2HZ   LYS  55           HZ2      LYS  55  75.351 -12.047  -4.533
  396   3HZ   LYS  55           HZ1      LYS  55  76.158 -10.996  -3.470
  397    H    GLU  56           HN       GLU  56  78.247  -6.003  -9.364
  398    HA   GLU  56           HA       GLU  56  79.909  -4.383  -7.743
  399   1HB   GLU  56           HB2      GLU  56  79.370  -4.689 -10.618
  400   2HB   GLU  56           HB1      GLU  56  79.895  -3.067 -10.166
  401   1HG   GLU  56           HG2      GLU  56  81.783  -4.651 -10.725
  402   2HG   GLU  56           HG1      GLU  56  81.893  -3.927  -9.119
  403    H    GLU  57           HN       GLU  57  77.333  -3.191  -9.938
  404    HA   GLU  57           HA       GLU  57  77.251  -0.553  -8.974
  405   1HB   GLU  57           HB2      GLU  57  75.893  -1.849 -10.891
  406   2HB   GLU  57           HB1      GLU  57  74.648  -1.848  -9.641
  407   1HG   GLU  57           HG2      GLU  57  74.556   0.498  -9.552
  408   2HG   GLU  57           HG1      GLU  57  76.143   0.680 -10.301
  409    H    LEU  58           HN       LEU  58  76.057  -3.484  -7.505
  410    HA   LEU  58           HA       LEU  58  74.211  -2.264  -5.665
  411   1HB   LEU  58           HB2      LEU  58  74.685  -4.813  -6.299
  412   2HB   LEU  58           HB1      LEU  58  75.730  -4.718  -4.881
  413    HG   LEU  58           HG       LEU  58  73.245  -3.421  -4.275
  414   1HD1  LEU  58          HD12      LEU  58  72.764  -5.286  -6.210
  415   2HD1  LEU  58          HD11      LEU  58  72.640  -6.277  -4.756
  416   3HD1  LEU  58          HD13      LEU  58  71.608  -4.859  -4.947
  417   1HD2  LEU  58          HD21      LEU  58  75.046  -5.485  -3.243
  418   2HD2  LEU  58          HD23      LEU  58  74.076  -4.305  -2.362
  419   3HD2  LEU  58          HD22      LEU  58  73.354  -5.828  -2.883
  420    H    ASP  59           HN       ASP  59  77.638  -3.236  -5.329
  421    HA   ASP  59           HA       ASP  59  77.976  -2.390  -2.644
  422   1HB   ASP  59           HB2      ASP  59  79.608  -3.548  -4.480
  423   2HB   ASP  59           HB1      ASP  59  80.248  -1.905  -4.490
  424    H    ALA  60           HN       ALA  60  78.509  -0.573  -5.679
  425    HA   ALA  60           HA       ALA  60  79.305   1.872  -4.466
  426   1HB   ALA  60           HB3      ALA  60  79.101   1.063  -7.022
  427   2HB   ALA  60           HB2      ALA  60  77.608   1.995  -6.915
  428   3HB   ALA  60           HB1      ALA  60  79.156   2.769  -6.582
  429    H    ILE  61           HN       ILE  61  76.091   0.556  -5.179
  430    HA   ILE  61           HA       ILE  61  74.576   2.883  -4.547
  431    HB   ILE  61           HB       ILE  61  74.000  -0.074  -4.517
  432   1HG1  ILE  61          HG12      ILE  61  72.622   2.156  -6.019
  433   2HG1  ILE  61          HG11      ILE  61  74.115   1.426  -6.610
  434   1HG2  ILE  61          HG21      ILE  61  72.541   2.000  -3.058
  435   2HG2  ILE  61          HG23      ILE  61  71.532   1.179  -4.251
  436   3HG2  ILE  61          HG22      ILE  61  72.355   0.247  -3.000
  437   1HD1  ILE  61          HD12      ILE  61  71.648  -0.180  -5.899
  438   2HD1  ILE  61          HD11      ILE  61  72.002   0.385  -7.533
  439   3HD1  ILE  61          HD13      ILE  61  73.093  -0.750  -6.737
  440    H    ILE  62           HN       ILE  62  75.674   0.189  -2.476
  441    HA   ILE  62           HA       ILE  62  74.469   1.147  -0.068
  442    HB   ILE  62           HB       ILE  62  76.973  -0.523  -0.452
  443   1HG1  ILE  62          HG12      ILE  62  74.459  -1.749   0.490
  444   2HG1  ILE  62          HG11      ILE  62  74.389  -1.136  -1.163
  445   1HG2  ILE  62          HG21      ILE  62  76.224   0.730   1.851
  446   2HG2  ILE  62          HG23      ILE  62  75.320  -0.779   1.991
  447   3HG2  ILE  62          HG22      ILE  62  77.074  -0.816   1.809
  448   1HD1  ILE  62          HD11      ILE  62  76.896  -2.515  -0.686
  449   2HD1  ILE  62          HD13      ILE  62  75.525  -3.563  -0.321
  450   3HD1  ILE  62          HD12      ILE  62  75.672  -2.827  -1.917
  451    H    GLU  63           HN       GLU  63  77.622   1.790  -1.566
  452    HA   GLU  63           HA       GLU  63  78.704   3.293   0.628
  453   1HB   GLU  63           HB2      GLU  63  79.309   3.119  -2.316
  454   2HB   GLU  63           HB1      GLU  63  80.105   4.339  -1.320
  455   1HG   GLU  63           HG2      GLU  63  80.928   2.592   0.199
  456   2HG   GLU  63           HG1      GLU  63  80.104   1.359  -0.757
  457    H    GLU  64           HN       GLU  64  76.215   4.007  -1.600
  458    HA   GLU  64           HA       GLU  64  76.527   6.937  -1.123
  459   1HB   GLU  64           HB2      GLU  64  74.781   5.461  -3.118
  460   2HB   GLU  64           HB1      GLU  64  74.929   7.213  -2.982
  461   1HG   GLU  64           HG2      GLU  64  77.188   5.296  -3.632
  462   2HG   GLU  64           HG1      GLU  64  76.377   6.361  -4.782
  463    H    VAL  65           HN       VAL  65  74.704   4.190  -0.196
  464    HA   VAL  65           HA       VAL  65  72.324   5.747   0.572
  465    HB   VAL  65           HB       VAL  65  73.096   2.840   0.903
  466   1HG1  VAL  65          HG13      VAL  65  70.666   4.357   1.878
  467   2HG1  VAL  65          HG12      VAL  65  70.678   2.606   1.669
  468   3HG1  VAL  65          HG11      VAL  65  71.770   3.363   2.829
  469   1HG2  VAL  65          HG21      VAL  65  72.379   3.803  -1.359
  470   2HG2  VAL  65          HG23      VAL  65  71.428   2.442  -0.765
  471   3HG2  VAL  65          HG22      VAL  65  70.799   4.084  -0.627
  472    H    ASP  66           HN       ASP  66  75.233   4.448   2.043
  473    HA   ASP  66           HA       ASP  66  74.265   4.963   4.771
  474   1HB   ASP  66           HB2      ASP  66  76.651   3.728   3.525
  475   2HB   ASP  66           HB1      ASP  66  76.948   4.572   5.045
  476    H    GLU  67           HN       GLU  67  73.821   7.306   4.196
  477    HA   GLU  67           HA       GLU  67  75.978   9.113   3.617
  478   1HB   GLU  67           HB2      GLU  67  74.398  10.873   4.415
  479   2HB   GLU  67           HB1      GLU  67  73.653   9.772   3.253
  480   1HG   GLU  67           HG2      GLU  67  72.330   8.752   4.855
  481   2HG   GLU  67           HG1      GLU  67  73.463   9.099   6.161
  482    H    ASP  68           HN       ASP  68  74.902   7.574   6.542
  483    HA   ASP  68           HA       ASP  68  76.454   9.452   8.230
  484   1HB   ASP  68           HB2      ASP  68  75.497   8.274  10.113
  485   2HB   ASP  68           HB1      ASP  68  74.202   8.576   8.956
  486    H    GLY  69           HN       GLY  69  76.535   6.108   7.074
  487   1HA   GLY  69           HA2      GLY  69  78.541   4.838   6.763
  488   2HA   GLY  69           HA1      GLY  69  79.404   5.998   7.773
  489    H    SER  70           HN       SER  70  76.356   4.441   8.647
  490    HA   SER  70           HA       SER  70  77.534   3.533  11.164
  491   1HB   SER  70           HB2      SER  70  75.137   2.430  11.295
  492   2HB   SER  70           HB1      SER  70  75.319   4.173  11.476
  493    HG   SER  70           HG       SER  70  74.652   2.737   9.115
  494    H    GLY  71           HN       GLY  71  77.830   2.331   8.152
  495   1HA   GLY  71           HA2      GLY  71  78.484   0.222   7.356
  496   2HA   GLY  71           HA1      GLY  71  78.660  -0.270   9.041
  497    H    THR  72           HN       THR  72  75.581   0.990   8.461
  498    HA   THR  72           HA       THR  72  74.428  -1.617   7.653
  499    HB   THR  72           HB       THR  72  72.746  -1.154   9.667
  500    HG1  THR  72           HG1      THR  72  73.486   0.309  10.948
  501   1HG2  THR  72          HG23      THR  72  75.120  -2.768   9.287
  502   2HG2  THR  72          HG22      THR  72  74.903  -2.374  10.992
  503   3HG2  THR  72          HG21      THR  72  73.612  -3.183  10.102
  504    H    ILE  73           HN       ILE  73  71.967  -1.347   7.391
  505    HA   ILE  73           HA       ILE  73  71.423   1.413   6.375
  506    HB   ILE  73           HB       ILE  73  70.300  -1.249   5.453
  507   1HG1  ILE  73          HG12      ILE  73  72.699  -0.645   4.829
  508   2HG1  ILE  73          HG11      ILE  73  71.611  -0.923   3.471
  509   1HG2  ILE  73          HG23      ILE  73  69.825   1.567   4.430
  510   2HG2  ILE  73          HG22      ILE  73  69.209   0.091   3.687
  511   3HG2  ILE  73          HG21      ILE  73  68.648   0.573   5.287
  512   1HD1  ILE  73          HD11      ILE  73  71.531   1.851   4.347
  513   2HD1  ILE  73          HD13      ILE  73  73.165   1.359   3.899
  514   3HD1  ILE  73          HD12      ILE  73  71.846   1.197   2.739
  515    H    ASP  74           HN       ASP  74  69.501   2.399   6.998
  516    HA   ASP  74           HA       ASP  74  67.903   0.924   9.053
  517   1HB   ASP  74           HB2      ASP  74  68.861   3.719   8.828
  518   2HB   ASP  74           HB1      ASP  74  67.200   3.535   9.391
  519    H    PHE  75           HN       PHE  75  65.554   1.302   8.994
  520    HA   PHE  75           HA       PHE  75  64.330   0.922   6.537
  521   1HB   PHE  75           HB2      PHE  75  63.288   0.872   8.901
  522   2HB   PHE  75           HB1      PHE  75  62.998   2.597   8.664
  523    HD1  PHE  75           HD2      PHE  75  62.840  -0.347   6.351
  524    HD2  PHE  75           HD1      PHE  75  60.747   2.950   8.139
  525    HE1  PHE  75           HE2      PHE  75  60.843  -0.869   4.974
  526    HE2  PHE  75           HE1      PHE  75  58.750   2.430   6.762
  527    HZ   PHE  75           HZ       PHE  75  58.798   0.520   5.181
  528    H    GLU  76           HN       GLU  76  64.920   4.064   8.128
  529    HA   GLU  76           HA       GLU  76  63.692   5.692   6.150
  530   1HB   GLU  76           HB2      GLU  76  65.862   6.127   8.180
  531   2HB   GLU  76           HB1      GLU  76  65.544   7.378   6.978
  532   1HG   GLU  76           HG2      GLU  76  63.110   7.284   7.640
  533   2HG   GLU  76           HG1      GLU  76  63.574   6.212   8.961
  534    H    GLU  77           HN       GLU  77  67.014   4.425   6.367
  535    HA   GLU  77           HA       GLU  77  67.868   5.759   3.928
  536   1HB   GLU  77           HB2      GLU  77  69.094   3.403   5.396
  537   2HB   GLU  77           HB1      GLU  77  69.885   4.360   4.142
  538   1HG   GLU  77           HG2      GLU  77  69.826   6.343   5.516
  539   2HG   GLU  77           HG1      GLU  77  68.821   5.537   6.722
  540    H    PHE  78           HN       PHE  78  66.023   2.964   4.607
  541    HA   PHE  78           HA       PHE  78  66.754   1.346   2.343
  542   1HB   PHE  78           HB2      PHE  78  65.093   1.030   4.525
  543   2HB   PHE  78           HB1      PHE  78  63.945   1.177   3.194
  544    HD1  PHE  78           HD1      PHE  78  67.113  -0.578   4.147
  545    HD2  PHE  78           HD2      PHE  78  63.496  -0.677   1.835
  546    HE1  PHE  78           HE1      PHE  78  67.623  -2.904   3.451
  547    HE2  PHE  78           HE2      PHE  78  64.005  -3.002   1.137
  548    HZ   PHE  78           HZ       PHE  78  66.069  -4.116   1.945
  549    H    LEU  79           HN       LEU  79  63.842   3.361   2.860
  550    HA   LEU  79           HA       LEU  79  62.748   3.309   0.320
  551   1HB   LEU  79           HB2      LEU  79  63.063   5.841   1.960
  552   2HB   LEU  79           HB1      LEU  79  61.805   5.499   0.772
  553    HG   LEU  79           HG       LEU  79  62.239   4.075   3.414
  554   1HD1  LEU  79          HD12      LEU  79  59.979   5.788   2.340
  555   2HD1  LEU  79          HD11      LEU  79  59.963   4.942   3.888
  556   3HD1  LEU  79          HD13      LEU  79  61.119   6.245   3.607
  557   1HD2  LEU  79          HD22      LEU  79  60.475   3.469   1.039
  558   2HD2  LEU  79          HD21      LEU  79  61.528   2.371   1.931
  559   3HD2  LEU  79          HD23      LEU  79  60.030   2.945   2.663
  560    H    VAL  80           HN       VAL  80  65.659   4.970   1.362
  561    HA   VAL  80           HA       VAL  80  65.987   6.577  -1.015
  562    HB   VAL  80           HB       VAL  80  67.782   5.709   1.242
  563   1HG1  VAL  80          HG13      VAL  80  68.593   6.877  -1.405
  564   2HG1  VAL  80          HG12      VAL  80  69.452   7.363   0.057
  565   3HG1  VAL  80          HG11      VAL  80  69.418   5.666  -0.422
  566   1HG2  VAL  80          HG23      VAL  80  66.152   7.610   1.457
  567   2HG2  VAL  80          HG22      VAL  80  67.832   8.089   1.698
  568   3HG2  VAL  80          HG21      VAL  80  67.025   8.441   0.170
  569    H    MET  81           HN       MET  81  67.889   3.735   0.049
  570    HA   MET  81           HA       MET  81  69.256   3.189  -2.283
  571   1HB   MET  81           HB2      MET  81  69.525   1.916  -0.192
  572   2HB   MET  81           HB1      MET  81  67.952   1.159  -0.450
  573   1HG   MET  81           HG2      MET  81  68.760  -0.268  -2.014
  574   2HG   MET  81           HG1      MET  81  69.772   0.971  -2.753
  575   1HE   MET  81           HE1      MET  81  69.191  -0.177   0.679
  576   2HE   MET  81           HE3      MET  81  70.668  -0.953   1.270
  577   3HE   MET  81           HE2      MET  81  70.564   0.803   1.184
  578    H    MET  82           HN       MET  82  65.855   2.465  -1.609
  579    HA   MET  82           HA       MET  82  65.441   0.843  -3.959
  580   1HB   MET  82           HB2      MET  82  63.433   2.472  -2.372
  581   2HB   MET  82           HB1      MET  82  63.051   1.174  -3.505
  582   1HG   MET  82           HG2      MET  82  64.674   0.884  -0.960
  583   2HG   MET  82           HG1      MET  82  63.017   0.328  -1.197
  584   1HE   MET  82           HE2      MET  82  62.225  -1.176  -2.782
  585   2HE   MET  82           HE1      MET  82  63.117  -0.944  -4.283
  586   3HE   MET  82           HE3      MET  82  63.082  -2.534  -3.506
  587    H    VAL  83           HN       VAL  83  64.367   4.198  -3.277
  588    HA   VAL  83           HA       VAL  83  63.794   4.693  -6.081
  589    HB   VAL  83           HB       VAL  83  64.138   6.729  -3.864
  590   1HG1  VAL  83          HG12      VAL  83  63.336   6.811  -6.671
  591   2HG1  VAL  83          HG11      VAL  83  62.095   7.475  -5.609
  592   3HG1  VAL  83          HG13      VAL  83  63.728   8.141  -5.581
  593   1HG2  VAL  83          HG22      VAL  83  62.044   4.708  -4.395
  594   2HG2  VAL  83          HG21      VAL  83  62.430   5.560  -2.900
  595   3HG2  VAL  83          HG23      VAL  83  61.446   6.347  -4.134
  596    H    ARG  84           HN       ARG  84  66.703   4.309  -4.619
  597    HA   ARG  84           HA       ARG  84  68.188   6.594  -5.516
  598   1HB   ARG  84           HB2      ARG  84  69.102   5.105  -3.820
  599   2HB   ARG  84           HB1      ARG  84  69.056   3.746  -4.943
  600   1HG   ARG  84           HG2      ARG  84  70.954   4.395  -5.997
  601   2HG   ARG  84           HG1      ARG  84  70.492   6.098  -5.969
  602   1HD   ARG  84           HD2      ARG  84  71.280   6.382  -3.738
  603   2HD   ARG  84           HD1      ARG  84  71.400   4.641  -3.480
  604    HE   ARG  84           HE       ARG  84  73.542   4.742  -4.443
  605   1HH1  ARG  84          HH11      ARG  84  72.759   7.873  -4.181
  606   2HH1  ARG  84          HH12      ARG  84  73.500   8.423  -5.646
  607   1HH2  ARG  84          HH21      ARG  84  74.006   5.232  -6.904
  608   2HH2  ARG  84          HH22      ARG  84  74.206   6.929  -7.188
  609    H    GLN  85           HN       GLN  85  67.832   3.314  -6.914
  610    HA   GLN  85           HA       GLN  85  68.942   4.352  -9.466
  611   1HB   GLN  85           HB2      GLN  85  69.051   1.992 -10.138
  612   2HB   GLN  85           HB1      GLN  85  69.832   2.212  -8.573
  613   1HG   GLN  85           HG2      GLN  85  68.501   0.474  -7.940
  614   2HG   GLN  85           HG1      GLN  85  67.266   1.723  -7.792
  615   1HE2  GLN  85          HE22      GLN  85  67.211  -0.352 -11.346
  616   2HE2  GLN  85          HE21      GLN  85  68.699   0.164 -10.714
  617    H    MET  86           HN       MET  86  65.980   3.080  -8.048
  618    HA   MET  86           HA       MET  86  64.464   2.532 -10.341
  619   1HB   MET  86           HB2      MET  86  63.847   3.459  -7.585
  620   2HB   MET  86           HB1      MET  86  62.579   3.695  -8.787
  621   1HG   MET  86           HG2      MET  86  62.324   1.419  -9.170
  622   2HG   MET  86           HG1      MET  86  63.973   1.045  -8.672
  623   1HE   MET  86           HE3      MET  86  60.491   1.720  -7.988
  624   2HE   MET  86           HE2      MET  86  60.174   1.428  -6.279
  625   3HE   MET  86           HE1      MET  86  60.842   2.976  -6.792
  626    H    LYS  87           HN       LYS  87  65.536   5.616  -9.091
  627    HA   LYS  87           HA       LYS  87  63.711   7.339 -10.422
  628   1HB   LYS  87           HB2      LYS  87  65.931   7.694  -8.830
  629   2HB   LYS  87           HB1      LYS  87  66.503   8.274 -10.395
  630   1HG   LYS  87           HG2      LYS  87  64.799   9.911 -10.543
  631   2HG   LYS  87           HG1      LYS  87  63.839   9.146  -9.275
  632   1HD   LYS  87           HD2      LYS  87  64.873  11.046  -8.254
  633   2HD   LYS  87           HD1      LYS  87  65.776   9.641  -7.690
  634   1HE   LYS  87           HE2      LYS  87  67.473  11.136  -8.333
  635   2HE   LYS  87           HE1      LYS  87  67.312  10.087  -9.742
  636   1HZ   LYS  87           HZ2      LYS  87  65.800  12.616  -9.477
  637   2HZ   LYS  87           HZ1      LYS  87  67.350  12.560 -10.171
  638   3HZ   LYS  87           HZ3      LYS  87  66.073  11.696 -10.878
  639    H    GLU  88           HN       GLU  88  67.040   6.589 -11.519
  640    HA   GLU  88           HA       GLU  88  67.832   6.178 -13.699
  641   1HB   GLU  88           HB2      GLU  88  65.146   5.304 -13.769
  642   2HB   GLU  88           HB1      GLU  88  65.360   6.330 -15.188
  643   1HG   GLU  88           HG2      GLU  88  67.005   3.911 -14.405
  644   2HG   GLU  88           HG1      GLU  88  65.992   4.100 -15.836
  645    H    ASP  89           HN       ASP  89  68.579   8.462 -13.360
  646    HA   ASP  89           HA       ASP  89  66.982  10.508 -14.792
  647   1HB   ASP  89           HB2      ASP  89  68.892  12.019 -14.011
  648   2HB   ASP  89           HB1      ASP  89  67.896  11.311 -12.739
  649    H    ALA  90           HN       ALA  90  67.430   9.156 -16.825
  650    HA   ALA  90           HA       ALA  90  70.148   9.278 -17.897
  651   1HB   ALA  90           HB2      ALA  90  67.509   8.553 -19.206
  652   2HB   ALA  90           HB1      ALA  90  69.092   8.362 -19.958
  653   3HB   ALA  90           HB3      ALA  90  68.677   7.420 -18.526
   
  No H/Q in entry =         653
  Start of MODEL   26
    1   1H    ALA   1           HT1      ALA   1  66.094  12.548  12.796
    2   2H    ALA   1           HT3      ALA   1  64.735  11.536  12.855
    3   3H    ALA   1           HT2      ALA   1  65.990  11.335  13.983
    4    HA   ALA   1           HA       ALA   1  67.227  10.113  12.606
    5   1HB   ALA   1           HB1      ALA   1  64.949   9.115  12.411
    6   2HB   ALA   1           HB3      ALA   1  64.666  10.106  10.981
    7   3HB   ALA   1           HB2      ALA   1  65.920   8.865  10.961
    8    H    SER   2           HN       SER   2  68.715  10.341  10.960
    9    HA   SER   2           HA       SER   2  69.072  12.781   9.624
   10   1HB   SER   2           HB2      SER   2  70.255  10.145   9.532
   11   2HB   SER   2           HB1      SER   2  70.125  10.804   7.904
   12    HG   SER   2           HG       SER   2  71.724  12.056   8.403
   13    H    MET   3           HN       MET   3  67.897  13.733   8.039
   14    HA   MET   3           HA       MET   3  66.425  11.958   6.132
   15   1HB   MET   3           HB2      MET   3  64.594  13.597   6.109
   16   2HB   MET   3           HB1      MET   3  64.868  13.017   7.753
   17   1HG   MET   3           HG2      MET   3  66.597  15.169   7.566
   18   2HG   MET   3           HG1      MET   3  65.188  15.715   6.655
   19   1HE   MET   3           HE1      MET   3  66.962  15.048   9.531
   20   2HE   MET   3           HE3      MET   3  66.287  16.535  10.215
   21   3HE   MET   3           HE2      MET   3  65.928  14.976  10.956
   22    H    THR   4           HN       THR   4  68.699  12.500   5.110
   23    HA   THR   4           HA       THR   4  69.336  15.060   4.115
   24    HB   THR   4           HB       THR   4  70.611  13.875   2.370
   25    HG1  THR   4           HG1      THR   4  70.364  11.610   2.239
   26   1HG2  THR   4          HG23      THR   4  71.017  13.721   5.058
   27   2HG2  THR   4          HG22      THR   4  70.962  12.009   4.635
   28   3HG2  THR   4          HG21      THR   4  72.135  13.072   3.859
   29    H    ASP   5           HN       ASP   5  69.243  15.484   1.578
   30    HA   ASP   5           HA       ASP   5  66.456  15.831   0.920
   31   1HB   ASP   5           HB2      ASP   5  69.025  16.226  -0.618
   32   2HB   ASP   5           HB1      ASP   5  67.448  16.481  -1.368
   33    H    GLN   6           HN       GLN   6  68.998  13.661  -0.342
   34    HA   GLN   6           HA       GLN   6  67.458  12.378  -2.336
   35   1HB   GLN   6           HB2      GLN   6  69.051  10.577  -2.219
   36   2HB   GLN   6           HB1      GLN   6  69.939  12.063  -1.875
   37   1HG   GLN   6           HG2      GLN   6  69.336  11.518   0.620
   38   2HG   GLN   6           HG1      GLN   6  69.101   9.881   0.012
   39   1HE2  GLN   6          HE22      GLN   6  72.555   9.244  -0.346
   40   2HE2  GLN   6          HE21      GLN   6  70.973   8.650  -0.507
   41    H    GLN   7           HN       GLN   7  67.514  11.947   1.157
   42    HA   GLN   7           HA       GLN   7  65.841   9.554   1.097
   43   1HB   GLN   7           HB2      GLN   7  66.630  11.443   3.335
   44   2HB   GLN   7           HB1      GLN   7  65.665   9.985   3.574
   45   1HG   GLN   7           HG2      GLN   7  67.629   8.811   2.278
   46   2HG   GLN   7           HG1      GLN   7  68.549  10.233   2.772
   47   1HE2  GLN   7          HE22      GLN   7  67.338   7.532   5.612
   48   2HE2  GLN   7          HE21      GLN   7  66.647   7.489   4.061
   49    H    ALA   8           HN       ALA   8  65.356  13.021   1.254
   50    HA   ALA   8           HA       ALA   8  62.604  12.914   2.147
   51   1HB   ALA   8           HB1      ALA   8  64.210  14.938   2.163
   52   2HB   ALA   8           HB3      ALA   8  63.795  15.115   0.458
   53   3HB   ALA   8           HB2      ALA   8  62.537  15.239   1.689
   54    H    GLU   9           HN       GLU   9  64.208  12.676  -0.964
   55    HA   GLU   9           HA       GLU   9  61.704  12.954  -2.468
   56   1HB   GLU   9           HB2      GLU   9  64.477  12.085  -3.338
   57   2HB   GLU   9           HB1      GLU   9  63.123  12.389  -4.427
   58   1HG   GLU   9           HG2      GLU   9  63.038  14.709  -3.153
   59   2HG   GLU   9           HG1      GLU   9  64.728  14.335  -2.811
   60    H    ALA  10           HN       ALA  10  63.718  10.361  -1.205
   61    HA   ALA  10           HA       ALA  10  62.654   8.209  -2.734
   62   1HB   ALA  10           HB1      ALA  10  64.269   8.525  -0.346
   63   2HB   ALA  10           HB3      ALA  10  63.110   7.211  -0.142
   64   3HB   ALA  10           HB2      ALA  10  64.239   7.188  -1.497
   65    H    ARG  11           HN       ARG  11  61.687   9.299   0.544
   66    HA   ARG  11           HA       ARG  11  59.327   7.642   0.588
   67   1HB   ARG  11           HB2      ARG  11  60.530   9.742   2.284
   68   2HB   ARG  11           HB1      ARG  11  58.770   9.645   2.367
   69   1HG   ARG  11           HG2      ARG  11  58.909   7.804   3.647
   70   2HG   ARG  11           HG1      ARG  11  59.840   6.982   2.394
   71   1HD   ARG  11           HD2      ARG  11  61.340   6.977   4.189
   72   2HD   ARG  11           HD1      ARG  11  61.833   8.420   3.302
   73    HE   ARG  11           HE       ARG  11  61.242   9.637   5.219
   74   1HH1  ARG  11          HH11      ARG  11  60.267   6.473   5.746
   75   2HH1  ARG  11          HH12      ARG  11  58.998   6.860   6.859
   76   1HH2  ARG  11          HH21      ARG  11  59.212  10.278   6.322
   77   2HH2  ARG  11          HH22      ARG  11  58.399   9.015   7.184
   78    H    ALA  12           HN       ALA  12  60.024  10.846  -0.631
   79    HA   ALA  12           HA       ALA  12  57.333  11.816  -0.784
   80   1HB   ALA  12           HB1      ALA  12  59.710  12.448  -2.560
   81   2HB   ALA  12           HB3      ALA  12  58.224  13.392  -2.470
   82   3HB   ALA  12           HB2      ALA  12  59.288  13.290  -1.069
   83    H    PHE  13           HN       PHE  13  59.276   9.788  -2.935
   84    HA   PHE  13           HA       PHE  13  57.137   9.750  -4.966
   85   1HB   PHE  13           HB2      PHE  13  59.374   9.725  -5.841
   86   2HB   PHE  13           HB1      PHE  13  59.842   8.403  -4.772
   87    HD1  PHE  13           HD1      PHE  13  57.735   9.311  -7.694
   88    HD2  PHE  13           HD2      PHE  13  59.356   6.122  -5.315
   89    HE1  PHE  13           HE1      PHE  13  57.009   7.668  -9.403
   90    HE2  PHE  13           HE2      PHE  13  58.629   4.478  -7.025
   91    HZ   PHE  13           HZ       PHE  13  57.456   5.252  -9.068
   92    H    LEU  14           HN       LEU  14  58.202   7.890  -2.240
   93    HA   LEU  14           HA       LEU  14  56.660   5.511  -3.089
   94   1HB   LEU  14           HB2      LEU  14  58.093   5.973  -0.458
   95   2HB   LEU  14           HB1      LEU  14  57.583   4.428  -1.145
   96    HG   LEU  14           HG       LEU  14  59.430   6.181  -2.729
   97   1HD1  LEU  14          HD12      LEU  14  60.261   5.902  -0.299
   98   2HD1  LEU  14          HD11      LEU  14  60.457   4.196  -0.698
   99   3HD1  LEU  14          HD13      LEU  14  61.362   5.419  -1.589
  100   1HD2  LEU  14          HD21      LEU  14  58.340   3.525  -2.860
  101   2HD2  LEU  14          HD23      LEU  14  59.369   4.346  -4.033
  102   3HD2  LEU  14          HD22      LEU  14  60.095   3.412  -2.726
  103    H    SER  15           HN       SER  15  54.511   5.478  -2.678
  104    HA   SER  15           HA       SER  15  53.215   7.381  -0.952
  105   1HB   SER  15           HB2      SER  15  52.429   5.290  -2.778
  106   2HB   SER  15           HB1      SER  15  51.507   5.149  -1.285
  107    HG   SER  15           HG       SER  15  51.623   7.232  -3.153
  108    H    GLU  16           HN       GLU  16  52.231   7.009   1.106
  109    HA   GLU  16           HA       GLU  16  53.708   5.590   3.014
  110   1HB   GLU  16           HB2      GLU  16  51.349   7.125   3.003
  111   2HB   GLU  16           HB1      GLU  16  50.898   5.580   3.724
  112   1HG   GLU  16           HG2      GLU  16  53.293   6.027   4.947
  113   2HG   GLU  16           HG1      GLU  16  52.710   7.679   4.750
  114    H    GLU  17           HN       GLU  17  51.030   4.459   0.996
  115    HA   GLU  17           HA       GLU  17  50.713   1.922   2.332
  116   1HB   GLU  17           HB2      GLU  17  49.948   2.958  -0.399
  117   2HB   GLU  17           HB1      GLU  17  49.654   1.283   0.065
  118   1HG   GLU  17           HG2      GLU  17  47.721   2.025   0.973
  119   2HG   GLU  17           HG1      GLU  17  48.724   2.715   2.251
  120    H    MET  18           HN       MET  18  52.708   3.036  -0.379
  121    HA   MET  18           HA       MET  18  53.669   0.411  -1.101
  122   1HB   MET  18           HB2      MET  18  54.236   3.198  -1.837
  123   2HB   MET  18           HB1      MET  18  55.662   2.160  -1.872
  124   1HG   MET  18           HG2      MET  18  53.707   0.581  -3.046
  125   2HG   MET  18           HG1      MET  18  53.344   2.193  -3.661
  126   1HE   MET  18           HE3      MET  18  54.650  -0.789  -4.223
  127   2HE   MET  18           HE2      MET  18  56.005  -0.688  -5.346
  128   3HE   MET  18           HE1      MET  18  56.306  -0.682  -3.609
  129    H    ILE  19           HN       ILE  19  54.600   2.768   1.315
  130    HA   ILE  19           HA       ILE  19  57.186   1.504   1.850
  131    HB   ILE  19           HB       ILE  19  55.571   3.632   3.276
  132   1HG1  ILE  19          HG12      ILE  19  58.277   4.266   2.413
  133   2HG1  ILE  19          HG11      ILE  19  57.300   3.679   1.067
  134   1HG2  ILE  19          HG22      ILE  19  58.057   2.164   4.099
  135   2HG2  ILE  19          HG21      ILE  19  57.897   3.874   4.501
  136   3HG2  ILE  19          HG23      ILE  19  56.706   2.714   5.091
  137   1HD1  ILE  19          HD12      ILE  19  55.718   5.466   2.673
  138   2HD1  ILE  19          HD11      ILE  19  57.237   6.256   2.249
  139   3HD1  ILE  19          HD13      ILE  19  56.184   5.629   0.979
  140    H    ALA  20           HN       ALA  20  53.896   1.233   3.027
  141    HA   ALA  20           HA       ALA  20  54.512  -0.147   5.478
  142   1HB   ALA  20           HB3      ALA  20  52.088   0.293   3.803
  143   2HB   ALA  20           HB2      ALA  20  52.051  -1.078   4.911
  144   3HB   ALA  20           HB1      ALA  20  52.322   0.551   5.532
  145    H    GLU  21           HN       GLU  21  54.268  -1.145   2.135
  146    HA   GLU  21           HA       GLU  21  54.086  -3.993   2.742
  147   1HB   GLU  21           HB2      GLU  21  54.308  -2.303   0.311
  148   2HB   GLU  21           HB1      GLU  21  54.974  -3.932   0.182
  149   1HG   GLU  21           HG2      GLU  21  52.596  -3.912  -0.470
  150   2HG   GLU  21           HG1      GLU  21  52.834  -4.867   0.994
  151    H    PHE  22           HN       PHE  22  56.683  -1.822   1.586
  152    HA   PHE  22           HA       PHE  22  58.726  -3.817   1.525
  153   1HB   PHE  22           HB2      PHE  22  58.934  -0.826   1.994
  154   2HB   PHE  22           HB1      PHE  22  60.298  -1.885   1.632
  155    HD1  PHE  22           HD1      PHE  22  59.065  -3.735  -0.342
  156    HD2  PHE  22           HD2      PHE  22  58.752   0.530   0.061
  157    HE1  PHE  22           HE1      PHE  22  58.574  -3.543  -2.765
  158    HE2  PHE  22           HE2      PHE  22  58.261   0.723  -2.363
  159    HZ   PHE  22           HZ       PHE  22  58.172  -1.314  -3.776
  160    H    LYS  23           HN       LYS  23  57.412  -1.860   4.139
  161    HA   LYS  23           HA       LYS  23  59.442  -2.170   6.072
  162   1HB   LYS  23           HB2      LYS  23  57.525  -0.753   6.516
  163   2HB   LYS  23           HB1      LYS  23  56.430  -2.132   6.415
  164   1HG   LYS  23           HG2      LYS  23  56.795  -1.718   8.752
  165   2HG   LYS  23           HG1      LYS  23  57.722  -3.160   8.343
  166   1HD   LYS  23           HD2      LYS  23  59.770  -1.860   8.171
  167   2HD   LYS  23           HD1      LYS  23  58.876  -0.358   8.411
  168   1HE   LYS  23           HE2      LYS  23  60.098  -1.500  10.452
  169   2HE   LYS  23           HE1      LYS  23  58.502  -0.784  10.671
  170   1HZ   LYS  23           HZ1      LYS  23  58.863  -3.626   9.936
  171   2HZ   LYS  23           HZ3      LYS  23  58.834  -3.112  11.553
  172   3HZ   LYS  23           HZ2      LYS  23  57.477  -2.868  10.560
  173    H    ALA  24           HN       ALA  24  57.185  -4.506   4.798
  174    HA   ALA  24           HA       ALA  24  57.529  -6.428   6.958
  175   1HB   ALA  24           HB1      ALA  24  56.106  -6.301   4.380
  176   2HB   ALA  24           HB3      ALA  24  56.712  -7.905   4.791
  177   3HB   ALA  24           HB2      ALA  24  55.624  -7.064   5.895
  178    H    ALA  25           HN       ALA  25  59.056  -5.812   3.834
  179    HA   ALA  25           HA       ALA  25  60.618  -8.257   3.836
  180   1HB   ALA  25           HB2      ALA  25  60.023  -6.511   1.896
  181   2HB   ALA  25           HB1      ALA  25  61.578  -5.835   2.381
  182   3HB   ALA  25           HB3      ALA  25  61.478  -7.506   1.832
  183    H    PHE  26           HN       PHE  26  61.044  -5.022   5.134
  184    HA   PHE  26           HA       PHE  26  63.852  -5.068   5.566
  185   1HB   PHE  26           HB2      PHE  26  62.178  -3.133   5.931
  186   2HB   PHE  26           HB1      PHE  26  61.896  -3.851   7.518
  187    HD1  PHE  26           HD1      PHE  26  64.834  -3.058   5.309
  188    HD2  PHE  26           HD2      PHE  26  63.163  -2.991   9.265
  189    HE1  PHE  26           HE1      PHE  26  66.900  -1.986   6.163
  190    HE2  PHE  26           HE2      PHE  26  65.229  -1.919  10.119
  191    HZ   PHE  26           HZ       PHE  26  67.098  -1.417   8.568
  192    H    ASP  27           HN       ASP  27  61.263  -5.883   7.907
  193    HA   ASP  27           HA       ASP  27  62.955  -6.906   9.927
  194   1HB   ASP  27           HB2      ASP  27  60.944  -8.196  10.673
  195   2HB   ASP  27           HB1      ASP  27  60.594  -6.497  10.351
  196    H    MET  28           HN       MET  28  62.242  -8.225   6.828
  197    HA   MET  28           HA       MET  28  62.724 -11.002   7.565
  198   1HB   MET  28           HB2      MET  28  61.444 -10.947   5.648
  199   2HB   MET  28           HB1      MET  28  62.196  -9.466   5.062
  200   1HG   MET  28           HG2      MET  28  62.800 -11.408   3.657
  201   2HG   MET  28           HG1      MET  28  64.213 -10.712   4.447
  202   1HE   MET  28           HE1      MET  28  65.785 -11.861   4.932
  203   2HE   MET  28           HE3      MET  28  65.940 -13.372   5.839
  204   3HE   MET  28           HE2      MET  28  65.601 -13.407   4.109
  205    H    PHE  29           HN       PHE  29  64.636  -8.322   6.234
  206    HA   PHE  29           HA       PHE  29  67.001 -10.004   5.856
  207   1HB   PHE  29           HB2      PHE  29  67.226  -7.031   6.045
  208   2HB   PHE  29           HB1      PHE  29  67.994  -8.143   4.914
  209    HD1  PHE  29           HD1      PHE  29  65.667  -9.682   3.928
  210    HD2  PHE  29           HD2      PHE  29  66.108  -5.476   4.671
  211    HE1  PHE  29           HE1      PHE  29  63.895  -9.204   2.260
  212    HE2  PHE  29           HE2      PHE  29  64.336  -4.995   3.002
  213    HZ   PHE  29           HZ       PHE  29  63.231  -6.858   1.796
  214    H    ASP  30           HN       ASP  30  65.502  -8.548   8.515
  215    HA   ASP  30           HA       ASP  30  68.001  -8.066  10.004
  216   1HB   ASP  30           HB2      ASP  30  65.067  -7.724  10.590
  217   2HB   ASP  30           HB1      ASP  30  66.243  -7.699  11.906
  218    H    ALA  31           HN       ALA  31  69.021  -9.973  10.517
  219    HA   ALA  31           HA       ALA  31  67.527 -12.382  11.200
  220   1HB   ALA  31           HB2      ALA  31  69.755 -12.454  10.087
  221   2HB   ALA  31           HB1      ALA  31  70.480 -11.776  11.543
  222   3HB   ALA  31           HB3      ALA  31  69.731 -13.372  11.591
  223    H    ASP  32           HN       ASP  32  69.044  -9.747  12.954
  224    HA   ASP  32           HA       ASP  32  68.744 -11.153  15.535
  225   1HB   ASP  32           HB2      ASP  32  69.643  -8.316  14.936
  226   2HB   ASP  32           HB1      ASP  32  69.757  -9.130  16.497
  227    H    GLY  33           HN       GLY  33  67.236  -8.526  13.707
  228   1HA   GLY  33           HA2      GLY  33  64.920  -7.920  13.931
  229   2HA   GLY  33           HA1      GLY  33  64.889  -8.720  15.505
  230    H    GLY  34           HN       GLY  34  67.534  -6.592  14.762
  231   1HA   GLY  34           HA2      GLY  34  66.780  -4.853  16.993
  232   2HA   GLY  34           HA1      GLY  34  68.239  -4.707  16.013
  233    H    GLY  35           HN       GLY  35  66.557  -4.794  13.509
  234   1HA   GLY  35           HA2      GLY  35  64.854  -3.294  12.522
  235   2HA   GLY  35           HA1      GLY  35  65.317  -2.081  13.716
  236    H    ASP  36           HN       ASP  36  67.712  -4.019  12.045
  237    HA   ASP  36           HA       ASP  36  68.265  -1.898  10.079
  238   1HB   ASP  36           HB2      ASP  36  70.733  -1.905  10.967
  239   2HB   ASP  36           HB1      ASP  36  69.535  -0.887  11.767
  240    H    ILE  37           HN       ILE  37  69.015  -2.870   8.245
  241    HA   ILE  37           HA       ILE  37  69.959  -5.687   8.491
  242    HB   ILE  37           HB       ILE  37  69.182  -6.068   6.299
  243   1HG1  ILE  37          HG12      ILE  37  69.038  -3.059   5.914
  244   2HG1  ILE  37          HG11      ILE  37  70.316  -4.098   5.281
  245   1HG2  ILE  37          HG23      ILE  37  67.410  -4.129   7.770
  246   2HG2  ILE  37          HG22      ILE  37  66.921  -4.783   6.207
  247   3HG2  ILE  37          HG21      ILE  37  67.216  -5.870   7.566
  248   1HD1  ILE  37          HD11      ILE  37  68.320  -5.450   4.241
  249   2HD1  ILE  37          HD13      ILE  37  67.428  -3.946   4.469
  250   3HD1  ILE  37          HD12      ILE  37  68.870  -3.971   3.453
  251    H    SER  38           HN       SER  38  72.079  -6.139   8.049
  252    HA   SER  38           HA       SER  38  74.035  -4.138   7.695
  253   1HB   SER  38           HB2      SER  38  74.849  -6.258   8.362
  254   2HB   SER  38           HB1      SER  38  74.001  -7.090   7.061
  255    HG   SER  38           HG       SER  38  76.115  -6.924   6.441
  256    H    THR  39           HN       THR  39  75.001  -3.234   5.823
  257    HA   THR  39           HA       THR  39  73.350  -2.954   3.529
  258    HB   THR  39           HB       THR  39  75.156  -1.787   2.511
  259    HG1  THR  39           HG1      THR  39  76.750  -3.186   4.390
  260   1HG2  THR  39          HG23      THR  39  74.629  -1.451   5.381
  261   2HG2  THR  39          HG22      THR  39  76.141  -0.719   4.841
  262   3HG2  THR  39          HG21      THR  39  74.617  -0.253   4.085
  263    H    LYS  40           HN       LYS  40  75.387  -5.531   4.453
  264    HA   LYS  40           HA       LYS  40  76.038  -6.452   1.768
  265   1HB   LYS  40           HB2      LYS  40  76.182  -7.718   4.508
  266   2HB   LYS  40           HB1      LYS  40  76.587  -8.612   3.042
  267   1HG   LYS  40           HG2      LYS  40  77.893  -6.070   2.922
  268   2HG   LYS  40           HG1      LYS  40  78.232  -6.790   4.497
  269   1HD   LYS  40           HD2      LYS  40  78.398  -8.828   2.475
  270   2HD   LYS  40           HD1      LYS  40  79.409  -7.461   2.006
  271   1HE   LYS  40           HE2      LYS  40  79.609  -8.154   4.857
  272   2HE   LYS  40           HE1      LYS  40  80.158  -9.435   3.777
  273   1HZ   LYS  40           HZ3      LYS  40  81.014  -6.645   3.355
  274   2HZ   LYS  40           HZ2      LYS  40  81.813  -7.629   4.486
  275   3HZ   LYS  40           HZ1      LYS  40  81.764  -8.079   2.848
  276    H    ALA  41           HN       ALA  41  73.421  -6.995   4.061
  277    HA   ALA  41           HA       ALA  41  72.320  -9.248   2.555
  278   1HB   ALA  41           HB1      ALA  41  71.511  -7.667   4.963
  279   2HB   ALA  41           HB3      ALA  41  70.276  -8.603   4.122
  280   3HB   ALA  41           HB2      ALA  41  71.699  -9.410   4.780
  281    H    LEU  42           HN       LEU  42  72.437  -5.991   1.925
  282    HA   LEU  42           HA       LEU  42  69.758  -5.404   1.108
  283   1HB   LEU  42           HB2      LEU  42  72.462  -4.324   0.336
  284   2HB   LEU  42           HB1      LEU  42  71.010  -3.783  -0.507
  285    HG   LEU  42           HG       LEU  42  71.683  -2.348   1.468
  286   1HD1  LEU  42          HD13      LEU  42  68.993  -3.741   1.598
  287   2HD1  LEU  42          HD12      LEU  42  69.382  -2.205   2.375
  288   3HD1  LEU  42          HD11      LEU  42  69.384  -2.329   0.615
  289   1HD2  LEU  42          HD21      LEU  42  72.354  -4.385   2.842
  290   2HD2  LEU  42          HD23      LEU  42  71.389  -3.176   3.683
  291   3HD2  LEU  42          HD22      LEU  42  70.632  -4.662   3.104
  292    H    GLY  43           HN       GLY  43  72.496  -6.907  -0.583
  293   1HA   GLY  43           HA2      GLY  43  71.348  -7.018  -3.178
  294   2HA   GLY  43           HA1      GLY  43  72.551  -8.155  -2.568
  295    H    THR  44           HN       THR  44  70.837  -9.021  -0.326
  296    HA   THR  44           HA       THR  44  69.421 -11.134  -1.702
  297    HB   THR  44           HB       THR  44  69.387 -10.250   1.199
  298    HG1  THR  44           HG1      THR  44  71.231 -11.226   1.102
  299   1HG2  THR  44          HG22      THR  44  68.147 -12.631  -0.191
  300   2HG2  THR  44          HG21      THR  44  68.455 -12.592   1.544
  301   3HG2  THR  44          HG23      THR  44  67.342 -11.431   0.820
  302    H    VAL  45           HN       VAL  45  68.428  -8.154  -0.042
  303    HA   VAL  45           HA       VAL  45  65.616  -8.549  -0.191
  304    HB   VAL  45           HB       VAL  45  67.078  -5.908  -0.460
  305   1HG1  VAL  45          HG11      VAL  45  64.290  -6.775   0.217
  306   2HG1  VAL  45          HG13      VAL  45  64.937  -5.326   0.987
  307   3HG1  VAL  45          HG12      VAL  45  64.829  -5.417  -0.771
  308   1HG2  VAL  45          HG23      VAL  45  66.488  -7.657   1.931
  309   2HG2  VAL  45          HG22      VAL  45  68.019  -6.913   1.472
  310   3HG2  VAL  45          HG21      VAL  45  66.705  -5.915   2.099
  311    H    MET  46           HN       MET  46  67.791  -6.828  -2.454
  312    HA   MET  46           HA       MET  46  65.885  -6.141  -4.400
  313   1HB   MET  46           HB2      MET  46  68.773  -6.996  -4.747
  314   2HB   MET  46           HB1      MET  46  67.799  -6.275  -6.029
  315   1HG   MET  46           HG2      MET  46  67.863  -4.841  -3.419
  316   2HG   MET  46           HG1      MET  46  69.330  -4.790  -4.395
  317   1HE   MET  46           HE1      MET  46  69.514  -2.734  -4.597
  318   2HE   MET  46           HE3      MET  46  69.376  -2.452  -6.337
  319   3HE   MET  46           HE2      MET  46  68.424  -1.493  -5.208
  320    H    ARG  47           HN       ARG  47  67.082  -9.264  -3.521
  321    HA   ARG  47           HA       ARG  47  66.352 -10.564  -6.036
  322   1HB   ARG  47           HB2      ARG  47  67.739 -11.286  -3.622
  323   2HB   ARG  47           HB1      ARG  47  66.461 -12.464  -3.924
  324   1HG   ARG  47           HG2      ARG  47  68.352 -11.563  -6.104
  325   2HG   ARG  47           HG1      ARG  47  68.727 -12.923  -5.044
  326   1HD   ARG  47           HD2      ARG  47  66.095 -13.393  -5.849
  327   2HD   ARG  47           HD1      ARG  47  66.896 -12.804  -7.306
  328    HE   ARG  47           HE       ARG  47  67.532 -15.303  -5.869
  329   1HH1  ARG  47          HH11      ARG  47  70.074 -13.839  -6.586
  330   2HH1  ARG  47          HH12      ARG  47  70.411 -14.471  -8.161
  331   1HH2  ARG  47          HH21      ARG  47  67.218 -15.743  -8.624
  332   2HH2  ARG  47          HH22      ARG  47  68.793 -15.548  -9.316
  333    H    MET  48           HN       MET  48  65.109 -11.069  -2.712
  334    HA   MET  48           HA       MET  48  62.735 -12.378  -3.435
  335   1HB   MET  48           HB2      MET  48  61.818 -11.260  -1.260
  336   2HB   MET  48           HB1      MET  48  63.178 -12.375  -1.132
  337   1HG   MET  48           HG2      MET  48  64.254  -9.795  -1.671
  338   2HG   MET  48           HG1      MET  48  63.067  -9.608  -0.382
  339   1HE   MET  48           HE1      MET  48  62.830 -11.023   1.535
  340   2HE   MET  48           HE3      MET  48  63.271 -12.656   1.020
  341   3HE   MET  48           HE2      MET  48  64.101 -11.903   2.379
  342    H    LEU  49           HN       LEU  49  62.921  -8.890  -2.586
  343    HA   LEU  49           HA       LEU  49  60.379  -8.109  -3.353
  344   1HB   LEU  49           HB2      LEU  49  62.851  -6.523  -4.092
  345   2HB   LEU  49           HB1      LEU  49  61.246  -5.898  -3.714
  346    HG   LEU  49           HG       LEU  49  63.216  -7.202  -1.826
  347   1HD1  LEU  49          HD12      LEU  49  61.859  -4.503  -2.009
  348   2HD1  LEU  49          HD11      LEU  49  62.689  -5.054  -0.554
  349   3HD1  LEU  49          HD13      LEU  49  63.588  -4.848  -2.057
  350   1HD2  LEU  49          HD23      LEU  49  60.882  -8.089  -1.506
  351   2HD2  LEU  49          HD22      LEU  49  61.484  -7.172  -0.124
  352   3HD2  LEU  49          HD21      LEU  49  60.341  -6.430  -1.244
  353    H    GLY  50           HN       GLY  50  63.048  -9.024  -5.442
  354   1HA   GLY  50           HA2      GLY  50  62.397  -9.979  -7.653
  355   2HA   GLY  50           HA1      GLY  50  61.217  -8.673  -7.782
  356    H    GLN  51           HN       GLN  51  64.696  -9.358  -7.715
  357    HA   GLN  51           HA       GLN  51  65.301  -7.497  -9.787
  358   1HB   GLN  51           HB2      GLN  51  64.818  -6.217  -7.346
  359   2HB   GLN  51           HB1      GLN  51  66.576  -6.302  -7.456
  360   1HG   GLN  51           HG2      GLN  51  65.712  -4.244  -8.519
  361   2HG   GLN  51           HG1      GLN  51  66.496  -5.293  -9.701
  362   1HE2  GLN  51          HE22      GLN  51  62.508  -4.532 -10.007
  363   2HE2  GLN  51          HE21      GLN  51  63.409  -3.932  -8.700
  364    H    ASN  52           HN       ASN  52  67.341  -7.980 -10.538
  365    HA   ASN  52           HA       ASN  52  69.121  -9.530  -8.696
  366   1HB   ASN  52           HB2      ASN  52  69.177  -9.901 -11.681
  367   2HB   ASN  52           HB1      ASN  52  69.667 -11.025 -10.413
  368   1HD2  ASN  52          HD22      ASN  52  65.711 -10.784 -11.466
  369   2HD2  ASN  52          HD21      ASN  52  66.787  -9.567 -11.957
  370    HA   PRO  53           HA       PRO  53  71.346  -5.794 -10.237
  371   1HB   PRO  53           HB2      PRO  53  72.115  -4.934  -7.741
  372   2HB   PRO  53           HB1      PRO  53  70.591  -4.461  -8.515
  373   1HG   PRO  53           HG2      PRO  53  71.044  -6.389  -6.284
  374   2HG   PRO  53           HG1      PRO  53  69.603  -5.431  -6.665
  375   1HD   PRO  53           HD2      PRO  53  69.965  -8.184  -7.229
  376   2HD   PRO  53           HD1      PRO  53  68.683  -7.141  -7.883
  377    H    THR  54           HN       THR  54  73.629  -5.653 -10.448
  378    HA   THR  54           HA       THR  54  75.117  -8.047  -9.627
  379    HB   THR  54           HB       THR  54  75.498  -7.143 -11.866
  380    HG1  THR  54           HG1      THR  54  77.279  -7.963 -10.461
  381   1HG2  THR  54          HG23      THR  54  75.940  -4.628 -10.307
  382   2HG2  THR  54          HG22      THR  54  76.835  -4.856 -11.810
  383   3HG2  THR  54          HG21      THR  54  75.070  -4.868 -11.821
  384    H    LYS  55           HN       LYS  55  76.710  -8.104  -8.043
  385    HA   LYS  55           HA       LYS  55  76.624  -6.297  -5.883
  386   1HB   LYS  55           HB2      LYS  55  79.031  -7.256  -5.449
  387   2HB   LYS  55           HB1      LYS  55  77.636  -8.331  -5.355
  388   1HG   LYS  55           HG2      LYS  55  78.212  -9.463  -7.255
  389   2HG   LYS  55           HG1      LYS  55  78.839  -8.017  -8.048
  390   1HD   LYS  55           HD2      LYS  55  80.772  -8.133  -6.351
  391   2HD   LYS  55           HD1      LYS  55  80.212  -9.771  -6.009
  392   1HE   LYS  55           HE2      LYS  55  80.799  -8.825  -8.819
  393   2HE   LYS  55           HE1      LYS  55  82.035  -9.555  -7.794
  394   1HZ   LYS  55           HZ3      LYS  55  79.428 -10.859  -8.301
  395   2HZ   LYS  55           HZ2      LYS  55  80.771 -11.100  -9.312
  396   3HZ   LYS  55           HZ1      LYS  55  80.844 -11.554  -7.676
  397    H    GLU  56           HN       GLU  56  78.750  -6.287  -8.734
  398    HA   GLU  56           HA       GLU  56  80.602  -4.336  -7.994
  399   1HB   GLU  56           HB2      GLU  56  79.229  -4.796 -10.652
  400   2HB   GLU  56           HB1      GLU  56  80.561  -3.655 -10.445
  401   1HG   GLU  56           HG2      GLU  56  80.716  -6.583  -9.678
  402   2HG   GLU  56           HG1      GLU  56  81.295  -5.937 -11.215
  403    H    GLU  57           HN       GLU  57  77.234  -3.871  -8.992
  404    HA   GLU  57           HA       GLU  57  77.531  -0.936  -8.781
  405   1HB   GLU  57           HB2      GLU  57  75.190  -2.716  -9.517
  406   2HB   GLU  57           HB1      GLU  57  75.093  -0.957  -9.430
  407   1HG   GLU  57           HG2      GLU  57  77.124  -2.411 -11.139
  408   2HG   GLU  57           HG1      GLU  57  75.552  -1.890 -11.746
  409    H    LEU  58           HN       LEU  58  76.348  -3.638  -6.916
  410    HA   LEU  58           HA       LEU  58  74.635  -2.141  -5.142
  411   1HB   LEU  58           HB2      LEU  58  75.200  -4.811  -5.517
  412   2HB   LEU  58           HB1      LEU  58  75.995  -4.478  -3.978
  413    HG   LEU  58           HG       LEU  58  73.304  -3.293  -4.252
  414   1HD1  LEU  58          HD13      LEU  58  73.681  -6.299  -4.072
  415   2HD1  LEU  58          HD12      LEU  58  72.155  -5.445  -3.848
  416   3HD1  LEU  58          HD11      LEU  58  72.949  -5.434  -5.423
  417   1HD2  LEU  58          HD23      LEU  58  74.756  -3.346  -2.182
  418   2HD2  LEU  58          HD22      LEU  58  73.137  -4.005  -1.947
  419   3HD2  LEU  58          HD21      LEU  58  74.514  -5.093  -2.133
  420    H    ASP  59           HN       ASP  59  77.896  -3.507  -4.511
  421    HA   ASP  59           HA       ASP  59  78.471  -2.348  -2.087
  422   1HB   ASP  59           HB2      ASP  59  80.824  -2.358  -2.709
  423   2HB   ASP  59           HB1      ASP  59  80.043  -3.774  -3.412
  424    H    ALA  60           HN       ALA  60  78.731  -0.704  -5.248
  425    HA   ALA  60           HA       ALA  60  79.670   1.789  -4.176
  426   1HB   ALA  60           HB3      ALA  60  79.807   1.202  -6.584
  427   2HB   ALA  60           HB2      ALA  60  78.050   1.292  -6.694
  428   3HB   ALA  60           HB1      ALA  60  78.985   2.743  -6.337
  429    H    ILE  61           HN       ILE  61  76.411   0.561  -4.896
  430    HA   ILE  61           HA       ILE  61  74.945   2.911  -4.310
  431    HB   ILE  61           HB       ILE  61  74.287  -0.026  -4.040
  432   1HG1  ILE  61          HG12      ILE  61  72.953   1.911  -5.893
  433   2HG1  ILE  61          HG11      ILE  61  74.595   1.390  -6.272
  434   1HG2  ILE  61          HG21      ILE  61  72.970   1.349  -2.397
  435   2HG2  ILE  61          HG23      ILE  61  72.353   2.288  -3.756
  436   3HG2  ILE  61          HG22      ILE  61  71.979   0.569  -3.631
  437   1HD1  ILE  61          HD13      ILE  61  73.234  -0.954  -5.528
  438   2HD1  ILE  61          HD12      ILE  61  72.107  -0.072  -6.558
  439   3HD1  ILE  61          HD11      ILE  61  73.714  -0.485  -7.158
  440    H    ILE  62           HN       ILE  62  75.515   0.142  -2.104
  441    HA   ILE  62           HA       ILE  62  74.478   1.096   0.259
  442    HB   ILE  62           HB       ILE  62  77.101  -0.346  -0.203
  443   1HG1  ILE  62          HG12      ILE  62  74.446  -1.357   0.855
  444   2HG1  ILE  62          HG11      ILE  62  74.886  -1.413  -0.852
  445   1HG2  ILE  62          HG21      ILE  62  75.608   0.183   2.385
  446   2HG2  ILE  62          HG23      ILE  62  76.950  -0.949   2.214
  447   3HG2  ILE  62          HG22      ILE  62  77.215   0.776   1.963
  448   1HD1  ILE  62          HD11      ILE  62  76.956  -2.688  -0.209
  449   2HD1  ILE  62          HD13      ILE  62  76.338  -2.762   1.440
  450   3HD1  ILE  62          HD12      ILE  62  75.456  -3.550   0.133
  451    H    GLU  63           HN       GLU  63  77.385   2.239  -1.367
  452    HA   GLU  63           HA       GLU  63  78.462   3.756   0.821
  453   1HB   GLU  63           HB2      GLU  63  79.228   3.195  -1.795
  454   2HB   GLU  63           HB1      GLU  63  78.930   4.933  -1.813
  455   1HG   GLU  63           HG2      GLU  63  80.395   5.204   0.158
  456   2HG   GLU  63           HG1      GLU  63  80.708   3.468   0.160
  457    H    GLU  64           HN       GLU  64  76.561   4.851  -2.015
  458    HA   GLU  64           HA       GLU  64  76.191   7.511  -0.996
  459   1HB   GLU  64           HB2      GLU  64  75.462   6.031  -3.336
  460   2HB   GLU  64           HB1      GLU  64  74.016   6.820  -2.706
  461   1HG   GLU  64           HG2      GLU  64  75.100   8.979  -2.726
  462   2HG   GLU  64           HG1      GLU  64  76.654   8.247  -3.130
  463    H    VAL  65           HN       VAL  65  74.897   4.589   0.066
  464    HA   VAL  65           HA       VAL  65  72.307   5.742   0.899
  465    HB   VAL  65           HB       VAL  65  73.421   3.034   1.656
  466   1HG1  VAL  65          HG11      VAL  65  71.220   4.255   2.574
  467   2HG1  VAL  65          HG13      VAL  65  70.550   3.610   1.074
  468   3HG1  VAL  65          HG12      VAL  65  71.259   2.519   2.269
  469   1HG2  VAL  65          HG23      VAL  65  73.249   3.790  -0.929
  470   2HG2  VAL  65          HG22      VAL  65  72.865   2.154  -0.393
  471   3HG2  VAL  65          HG21      VAL  65  71.571   3.322  -0.659
  472    H    ASP  66           HN       ASP  66  75.333   4.578   2.376
  473    HA   ASP  66           HA       ASP  66  74.408   5.338   5.059
  474   1HB   ASP  66           HB2      ASP  66  76.550   3.750   3.940
  475   2HB   ASP  66           HB1      ASP  66  77.200   4.916   5.093
  476    H    GLU  67           HN       GLU  67  74.039   7.631   4.110
  477    HA   GLU  67           HA       GLU  67  76.295   9.304   3.518
  478   1HB   GLU  67           HB2      GLU  67  73.446   9.802   4.336
  479   2HB   GLU  67           HB1      GLU  67  74.588  11.146   4.294
  480   1HG   GLU  67           HG2      GLU  67  74.697   9.399   1.922
  481   2HG   GLU  67           HG1      GLU  67  73.164  10.249   2.124
  482    H    ASP  68           HN       ASP  68  75.125   7.981   6.455
  483    HA   ASP  68           HA       ASP  68  76.501  10.059   8.076
  484   1HB   ASP  68           HB2      ASP  68  75.539   8.591   9.992
  485   2HB   ASP  68           HB1      ASP  68  74.409   9.557   9.042
  486    H    GLY  69           HN       GLY  69  76.867   6.812   6.904
  487   1HA   GLY  69           HA2      GLY  69  78.805   5.462   6.970
  488   2HA   GLY  69           HA1      GLY  69  79.591   6.706   7.944
  489    H    SER  70           HN       SER  70  76.480   5.311   8.798
  490    HA   SER  70           HA       SER  70  77.445   4.606  11.438
  491   1HB   SER  70           HB2      SER  70  75.076   3.304  11.272
  492   2HB   SER  70           HB1      SER  70  75.202   5.029  11.605
  493    HG   SER  70           HG       SER  70  74.211   5.337   9.788
  494    H    GLY  71           HN       GLY  71  77.687   3.072   8.442
  495   1HA   GLY  71           HA2      GLY  71  78.613   0.967   7.920
  496   2HA   GLY  71           HA1      GLY  71  78.787   0.669   9.652
  497    H    THR  72           HN       THR  72  75.643   1.644   9.022
  498    HA   THR  72           HA       THR  72  74.680  -1.101   8.429
  499    HB   THR  72           HB       THR  72  73.044  -0.886  10.352
  500    HG1  THR  72           HG1      THR  72  74.858   0.997  11.382
  501   1HG2  THR  72          HG22      THR  72  76.021  -1.075  10.801
  502   2HG2  THR  72          HG21      THR  72  74.870  -1.344  12.109
  503   3HG2  THR  72          HG23      THR  72  74.847  -2.386  10.686
  504    H    ILE  73           HN       ILE  73  72.324  -1.090   7.907
  505    HA   ILE  73           HA       ILE  73  71.497   1.578   6.836
  506    HB   ILE  73           HB       ILE  73  70.913  -1.212   5.812
  507   1HG1  ILE  73          HG12      ILE  73  73.167  -0.197   5.326
  508   2HG1  ILE  73          HG11      ILE  73  72.208  -0.524   3.883
  509   1HG2  ILE  73          HG22      ILE  73  69.009   0.521   5.675
  510   2HG2  ILE  73          HG21      ILE  73  70.043   1.383   4.537
  511   3HG2  ILE  73          HG23      ILE  73  69.498  -0.255   4.169
  512   1HD1  ILE  73          HD12      ILE  73  71.441   2.052   4.637
  513   2HD1  ILE  73          HD11      ILE  73  73.182   2.024   4.911
  514   3HD1  ILE  73          HD13      ILE  73  72.535   1.637   3.317
  515    H    ASP  74           HN       ASP  74  69.358   2.238   7.196
  516    HA   ASP  74           HA       ASP  74  67.804   0.532   9.100
  517   1HB   ASP  74           HB2      ASP  74  66.760   2.895   9.651
  518   2HB   ASP  74           HB1      ASP  74  68.298   2.422  10.373
  519    H    PHE  75           HN       PHE  75  65.382   0.932   8.929
  520    HA   PHE  75           HA       PHE  75  64.383   0.371   6.393
  521   1HB   PHE  75           HB2      PHE  75  63.152   0.324   8.643
  522   2HB   PHE  75           HB1      PHE  75  62.842   2.041   8.383
  523    HD1  PHE  75           HD2      PHE  75  62.961  -0.838   6.005
  524    HD2  PHE  75           HD1      PHE  75  60.591   2.276   7.767
  525    HE1  PHE  75           HE2      PHE  75  61.083  -1.409   4.484
  526    HE2  PHE  75           HE1      PHE  75  58.712   1.709   6.251
  527    HZ   PHE  75           HZ       PHE  75  58.958  -0.135   4.609
  528    H    GLU  76           HN       GLU  76  65.274   3.490   7.716
  529    HA   GLU  76           HA       GLU  76  63.896   5.035   5.672
  530   1HB   GLU  76           HB2      GLU  76  65.988   5.671   7.749
  531   2HB   GLU  76           HB1      GLU  76  65.511   6.864   6.541
  532   1HG   GLU  76           HG2      GLU  76  63.390   5.420   8.098
  533   2HG   GLU  76           HG1      GLU  76  64.245   6.769   8.846
  534    H    GLU  77           HN       GLU  77  67.217   3.844   6.123
  535    HA   GLU  77           HA       GLU  77  68.192   5.157   3.713
  536   1HB   GLU  77           HB2      GLU  77  69.343   2.975   5.470
  537   2HB   GLU  77           HB1      GLU  77  70.191   3.647   4.077
  538   1HG   GLU  77           HG2      GLU  77  69.956   5.922   5.091
  539   2HG   GLU  77           HG1      GLU  77  69.250   5.171   6.521
  540    H    PHE  78           HN       PHE  78  66.483   2.232   4.378
  541    HA   PHE  78           HA       PHE  78  67.402   0.690   2.128
  542   1HB   PHE  78           HB2      PHE  78  66.264  -0.749   3.481
  543   2HB   PHE  78           HB1      PHE  78  65.257   0.531   4.150
  544    HD1  PHE  78           HD2      PHE  78  65.671  -1.772   1.253
  545    HD2  PHE  78           HD1      PHE  78  63.080   0.977   3.294
  546    HE1  PHE  78           HE2      PHE  78  63.775  -2.509  -0.165
  547    HE2  PHE  78           HE1      PHE  78  61.181   0.241   1.876
  548    HZ   PHE  78           HZ       PHE  78  61.530  -1.502   0.146
  549    H    LEU  79           HN       LEU  79  64.521   2.756   2.604
  550    HA   LEU  79           HA       LEU  79  63.409   2.511   0.036
  551   1HB   LEU  79           HB2      LEU  79  63.549   5.053   1.688
  552   2HB   LEU  79           HB1      LEU  79  62.372   4.691   0.424
  553    HG   LEU  79           HG       LEU  79  62.716   2.989   2.906
  554   1HD1  LEU  79          HD11      LEU  79  60.972   5.383   2.353
  555   2HD1  LEU  79          HD13      LEU  79  60.451   4.128   3.479
  556   3HD1  LEU  79          HD12      LEU  79  61.937   5.028   3.786
  557   1HD2  LEU  79          HD21      LEU  79  61.683   1.990   0.826
  558   2HD2  LEU  79          HD23      LEU  79  60.613   2.012   2.228
  559   3HD2  LEU  79          HD22      LEU  79  60.413   3.208   0.948
  560    H    VAL  80           HN       VAL  80  66.272   4.209   1.079
  561    HA   VAL  80           HA       VAL  80  66.558   5.885  -1.258
  562    HB   VAL  80           HB       VAL  80  68.667   4.857   0.667
  563   1HG1  VAL  80          HG12      VAL  80  68.662   7.139  -1.332
  564   2HG1  VAL  80          HG11      VAL  80  69.913   6.882  -0.115
  565   3HG1  VAL  80          HG13      VAL  80  69.666   5.691  -1.391
  566   1HG2  VAL  80          HG22      VAL  80  66.539   6.374   1.349
  567   2HG2  VAL  80          HG21      VAL  80  68.129   6.587   2.082
  568   3HG2  VAL  80          HG23      VAL  80  67.616   7.642   0.764
  569    H    MET  81           HN       MET  81  68.216   2.861  -0.285
  570    HA   MET  81           HA       MET  81  69.626   2.457  -2.708
  571   1HB   MET  81           HB2      MET  81  68.526   0.477  -0.696
  572   2HB   MET  81           HB1      MET  81  69.576   0.013  -2.035
  573   1HG   MET  81           HG2      MET  81  71.344   1.449  -1.227
  574   2HG   MET  81           HG1      MET  81  70.289   2.113   0.019
  575   1HE   MET  81           HE2      MET  81  69.621   1.414   1.794
  576   2HE   MET  81           HE1      MET  81  69.350  -0.254   2.291
  577   3HE   MET  81           HE3      MET  81  70.791   0.612   2.838
  578    H    MET  82           HN       MET  82  66.286   1.851  -1.863
  579    HA   MET  82           HA       MET  82  65.688   0.126  -4.090
  580   1HB   MET  82           HB2      MET  82  64.164  -0.069  -2.337
  581   2HB   MET  82           HB1      MET  82  64.139   1.665  -2.033
  582   1HG   MET  82           HG2      MET  82  62.513   2.036  -3.550
  583   2HG   MET  82           HG1      MET  82  63.188   0.886  -4.701
  584   1HE   MET  82           HE1      MET  82  63.610  -1.607  -3.202
  585   2HE   MET  82           HE3      MET  82  62.109  -2.540  -3.260
  586   3HE   MET  82           HE2      MET  82  62.696  -1.721  -4.704
  587    H    VAL  83           HN       VAL  83  64.449   3.433  -3.482
  588    HA   VAL  83           HA       VAL  83  63.658   3.960  -6.131
  589    HB   VAL  83           HB       VAL  83  64.794   6.022  -4.225
  590   1HG1  VAL  83          HG13      VAL  83  63.345   6.072  -6.772
  591   2HG1  VAL  83          HG12      VAL  83  62.561   7.033  -5.517
  592   3HG1  VAL  83          HG11      VAL  83  64.236   7.361  -5.962
  593   1HG2  VAL  83          HG22      VAL  83  62.105   4.636  -4.303
  594   2HG2  VAL  83          HG21      VAL  83  63.207   4.793  -2.934
  595   3HG2  VAL  83          HG23      VAL  83  62.330   6.203  -3.528
  596    H    ARG  84           HN       ARG  84  66.841   3.775  -4.806
  597    HA   ARG  84           HA       ARG  84  68.245   5.497  -6.590
  598   1HB   ARG  84           HB2      ARG  84  68.966   3.852  -4.517
  599   2HB   ARG  84           HB1      ARG  84  69.614   2.973  -5.903
  600   1HG   ARG  84           HG2      ARG  84  71.332   4.421  -5.998
  601   2HG   ARG  84           HG1      ARG  84  70.191   5.732  -6.306
  602   1HD   ARG  84           HD2      ARG  84  70.327   4.851  -3.489
  603   2HD   ARG  84           HD1      ARG  84  71.803   5.597  -4.102
  604    HE   ARG  84           HE       ARG  84  69.141   6.930  -3.970
  605   1HH1  ARG  84          HH21      ARG  84  72.315   7.011  -5.223
  606   2HH1  ARG  84          HH22      ARG  84  72.552   8.700  -4.917
  607   1HH2  ARG  84          HH11      ARG  84  69.532   9.095  -3.261
  608   2HH2  ARG  84          HH12      ARG  84  70.977   9.879  -3.807
  609    H    GLN  85           HN       GLN  85  67.346   2.058  -6.897
  610    HA   GLN  85           HA       GLN  85  67.535   2.352  -9.838
  611   1HB   GLN  85           HB2      GLN  85  69.234   0.535  -8.156
  612   2HB   GLN  85           HB1      GLN  85  68.730   0.003  -9.760
  613   1HG   GLN  85           HG2      GLN  85  69.614   2.726  -9.936
  614   2HG   GLN  85           HG1      GLN  85  70.852   1.781  -9.106
  615   1HE2  GLN  85          HE22      GLN  85  71.988   0.632 -12.234
  616   2HE2  GLN  85          HE21      GLN  85  72.370   1.343 -10.741
  617    H    MET  86           HN       MET  86  65.140   2.243  -8.850
  618    HA   MET  86           HA       MET  86  64.306  -0.617  -9.093
  619   1HB   MET  86           HB2      MET  86  62.631  -0.309  -7.395
  620   2HB   MET  86           HB1      MET  86  64.149   0.290  -6.726
  621   1HG   MET  86           HG2      MET  86  62.877   2.126  -6.227
  622   2HG   MET  86           HG1      MET  86  63.236   2.555  -7.900
  623   1HE   MET  86           HE2      MET  86  61.159   0.570  -5.580
  624   2HE   MET  86           HE1      MET  86  60.245   2.064  -5.403
  625   3HE   MET  86           HE3      MET  86  59.494   0.646  -6.148
  626    H    LYS  87           HN       LYS  87  64.197   2.385 -10.472
  627    HA   LYS  87           HA       LYS  87  61.382   2.176 -11.380
  628   1HB   LYS  87           HB2      LYS  87  63.508   4.282 -11.882
  629   2HB   LYS  87           HB1      LYS  87  61.850   4.366 -12.480
  630   1HG   LYS  87           HG2      LYS  87  60.980   4.827 -10.409
  631   2HG   LYS  87           HG1      LYS  87  62.183   3.846  -9.571
  632   1HD   LYS  87           HD2      LYS  87  63.053   5.869  -8.980
  633   2HD   LYS  87           HD1      LYS  87  63.767   5.811 -10.593
  634   1HE   LYS  87           HE2      LYS  87  60.986   6.830 -10.452
  635   2HE   LYS  87           HE1      LYS  87  62.218   7.864  -9.731
  636   1HZ   LYS  87           HZ3      LYS  87  63.482   7.701 -11.803
  637   2HZ   LYS  87           HZ2      LYS  87  62.240   6.771 -12.492
  638   3HZ   LYS  87           HZ1      LYS  87  61.952   8.388 -12.052
  639    H    GLU  88           HN       GLU  88  64.406   1.043 -12.306
  640    HA   GLU  88           HA       GLU  88  65.249   0.192 -14.327
  641   1HB   GLU  88           HB2      GLU  88  62.309  -0.113 -14.998
  642   2HB   GLU  88           HB1      GLU  88  63.652  -1.062 -15.638
  643   1HG   GLU  88           HG2      GLU  88  63.652  -2.433 -13.846
  644   2HG   GLU  88           HG1      GLU  88  63.616  -1.073 -12.723
  645    H    ASP  89           HN       ASP  89  65.891   2.499 -14.818
  646    HA   ASP  89           HA       ASP  89  64.332   3.542 -17.151
  647   1HB   ASP  89           HB2      ASP  89  65.564   5.745 -16.510
  648   2HB   ASP  89           HB1      ASP  89  64.193   5.239 -15.522
  649    H    ALA  90           HN       ALA  90  65.708   1.970 -18.393
  650    HA   ALA  90           HA       ALA  90  68.042   3.336 -19.471
  651   1HB   ALA  90           HB2      ALA  90  68.724   1.983 -17.295
  652   2HB   ALA  90           HB1      ALA  90  68.670   0.609 -18.400
  653   3HB   ALA  90           HB3      ALA  90  69.756   1.959 -18.725
   
  No H/Q in entry =         653
  Start of MODEL   27
    1   1H    ALA   1           HT2      ALA   1  67.174  14.057  13.747
    2   2H    ALA   1           HT1      ALA   1  66.020  13.971  14.991
    3   3H    ALA   1           HT3      ALA   1  65.518  14.118  13.378
    4    HA   ALA   1           HA       ALA   1  65.285  16.236  14.454
    5   1HB   ALA   1           HB2      ALA   1  67.279  15.520  16.056
    6   2HB   ALA   1           HB1      ALA   1  68.249  16.380  14.860
    7   3HB   ALA   1           HB3      ALA   1  66.961  17.222  15.720
    8    H    SER   2           HN       SER   2  66.574  14.751  11.924
    9    HA   SER   2           HA       SER   2  66.650  17.155  10.301
   10   1HB   SER   2           HB2      SER   2  69.247  15.654  10.263
   11   2HB   SER   2           HB1      SER   2  68.915  17.320   9.796
   12    HG   SER   2           HG       SER   2  70.006  16.762  11.941
   13    H    MET   3           HN       MET   3  65.633  16.440   8.494
   14    HA   MET   3           HA       MET   3  65.743  13.585   7.780
   15   1HB   MET   3           HB2      MET   3  64.335  15.800   6.273
   16   2HB   MET   3           HB1      MET   3  63.980  14.073   6.239
   17   1HG   MET   3           HG2      MET   3  63.884  15.420   8.894
   18   2HG   MET   3           HG1      MET   3  62.580  15.781   7.763
   19   1HE   MET   3           HE2      MET   3  61.289  14.753   9.984
   20   2HE   MET   3           HE1      MET   3  60.523  14.719   8.398
   21   3HE   MET   3           HE3      MET   3  60.422  13.310   9.464
   22    H    THR   4           HN       THR   4  67.422  12.893   6.548
   23    HA   THR   4           HA       THR   4  69.202  14.592   5.119
   24    HB   THR   4           HB       THR   4  69.720  12.360   3.859
   25    HG1  THR   4           HG1      THR   4  68.830  10.573   4.812
   26   1HG2  THR   4          HG21      THR   4  70.606  13.468   6.198
   27   2HG2  THR   4          HG23      THR   4  70.074  11.878   6.746
   28   3HG2  THR   4          HG22      THR   4  71.284  12.011   5.469
   29    H    ASP   5           HN       ASP   5  69.332  15.092   2.885
   30    HA   ASP   5           HA       ASP   5  66.889  15.592   1.531
   31   1HB   ASP   5           HB2      ASP   5  69.703  15.317   0.434
   32   2HB   ASP   5           HB1      ASP   5  68.337  15.957  -0.482
   33    H    GLN   6           HN       GLN   6  69.188  12.892   1.232
   34    HA   GLN   6           HA       GLN   6  68.017  11.585  -0.985
   35   1HB   GLN   6           HB2      GLN   6  69.433  10.488   1.455
   36   2HB   GLN   6           HB1      GLN   6  68.940   9.472   0.101
   37   1HG   GLN   6           HG2      GLN   6  70.192  11.250  -1.355
   38   2HG   GLN   6           HG1      GLN   6  70.987  11.674   0.161
   39   1HE2  GLN   6          HE22      GLN   6  71.663   7.933  -1.424
   40   2HE2  GLN   6          HE21      GLN   6  70.223   8.745  -1.811
   41    H    GLN   7           HN       GLN   7  67.215  11.332   2.480
   42    HA   GLN   7           HA       GLN   7  65.048   9.441   1.977
   43   1HB   GLN   7           HB2      GLN   7  65.629  11.115   4.442
   44   2HB   GLN   7           HB1      GLN   7  64.548   9.723   4.360
   45   1HG   GLN   7           HG2      GLN   7  66.393   8.241   3.844
   46   2HG   GLN   7           HG1      GLN   7  67.503   9.604   3.701
   47   1HE2  GLN   7          HE22      GLN   7  68.133   8.427   7.101
   48   2HE2  GLN   7          HE21      GLN   7  68.525   8.018   5.501
   49    H    ALA   8           HN       ALA   8  65.423  12.849   1.817
   50    HA   ALA   8           HA       ALA   8  62.694  13.588   2.432
   51   1HB   ALA   8           HB3      ALA   8  65.096  14.913   1.310
   52   2HB   ALA   8           HB2      ALA   8  63.548  15.591   0.804
   53   3HB   ALA   8           HB1      ALA   8  63.950  15.494   2.518
   54    H    GLU   9           HN       GLU   9  64.447  13.217  -0.673
   55    HA   GLU   9           HA       GLU   9  61.969  13.445  -2.201
   56   1HB   GLU   9           HB2      GLU   9  64.757  13.537  -2.761
   57   2HB   GLU   9           HB1      GLU   9  64.077  12.224  -3.722
   58   1HG   GLU   9           HG2      GLU   9  62.335  13.747  -4.579
   59   2HG   GLU   9           HG1      GLU   9  63.018  15.063  -3.625
   60    H    ALA  10           HN       ALA  10  63.816  10.864  -0.763
   61    HA   ALA  10           HA       ALA  10  62.875   8.691  -2.362
   62   1HB   ALA  10           HB1      ALA  10  63.745   8.828   0.536
   63   2HB   ALA  10           HB3      ALA  10  63.365   7.315  -0.289
   64   3HB   ALA  10           HB2      ALA  10  64.709   8.311  -0.848
   65    H    ARG  11           HN       ARG  11  61.612  10.038   0.702
   66    HA   ARG  11           HA       ARG  11  59.321   8.287   0.773
   67   1HB   ARG  11           HB2      ARG  11  60.479  10.115   2.510
   68   2HB   ARG  11           HB1      ARG  11  58.950  10.883   2.075
   69   1HG   ARG  11           HG2      ARG  11  57.972   9.528   3.594
   70   2HG   ARG  11           HG1      ARG  11  58.275   8.204   2.469
   71   1HD   ARG  11           HD2      ARG  11  59.816   7.308   3.844
   72   2HD   ARG  11           HD1      ARG  11  60.682   8.841   3.948
   73    HE   ARG  11           HE       ARG  11  58.827   7.799   5.926
   74   1HH1  ARG  11          HH11      ARG  11  61.237   9.951   5.666
   75   2HH1  ARG  11          HH12      ARG  11  60.464  11.268   6.484
   76   1HH2  ARG  11          HH21      ARG  11  57.328   9.787   6.459
   77   2HH2  ARG  11          HH22      ARG  11  58.249  11.174   6.933
   78    H    ALA  12           HN       ALA  12  59.993  11.330  -0.812
   79    HA   ALA  12           HA       ALA  12  57.238  12.064  -1.291
   80   1HB   ALA  12           HB2      ALA  12  59.826  13.148  -1.846
   81   2HB   ALA  12           HB1      ALA  12  58.924  13.082  -3.360
   82   3HB   ALA  12           HB3      ALA  12  58.258  13.947  -1.975
   83    H    PHE  13           HN       PHE  13  59.637  10.172  -3.089
   84    HA   PHE  13           HA       PHE  13  57.763   9.805  -5.337
   85   1HB   PHE  13           HB2      PHE  13  60.139  10.023  -5.857
   86   2HB   PHE  13           HB1      PHE  13  60.522   8.665  -4.800
   87    HD1  PHE  13           HD2      PHE  13  59.788   6.363  -5.389
   88    HD2  PHE  13           HD1      PHE  13  59.207   9.682  -8.054
   89    HE1  PHE  13           HE2      PHE  13  59.368   4.789  -7.257
   90    HE2  PHE  13           HE1      PHE  13  58.787   8.107  -9.922
   91    HZ   PHE  13           HZ       PHE  13  58.867   5.660  -9.524
   92    H    LEU  14           HN       LEU  14  58.651   8.202  -2.404
   93    HA   LEU  14           HA       LEU  14  57.502   5.629  -3.322
   94   1HB   LEU  14           HB2      LEU  14  58.729   6.422  -0.663
   95   2HB   LEU  14           HB1      LEU  14  58.220   4.793  -1.106
   96    HG   LEU  14           HG       LEU  14  60.305   6.413  -2.597
   97   1HD1  LEU  14          HD11      LEU  14  60.448   4.472  -0.339
   98   2HD1  LEU  14          HD13      LEU  14  61.663   4.317  -1.608
   99   3HD1  LEU  14          HD12      LEU  14  61.504   5.832  -0.721
  100   1HD2  LEU  14          HD21      LEU  14  59.184   3.620  -2.891
  101   2HD2  LEU  14          HD23      LEU  14  59.303   4.883  -4.118
  102   3HD2  LEU  14          HD22      LEU  14  60.759   4.065  -3.552
  103    H    SER  15           HN       SER  15  55.376   5.206  -3.003
  104    HA   SER  15           HA       SER  15  53.789   7.034  -1.318
  105   1HB   SER  15           HB2      SER  15  53.208   4.989  -3.410
  106   2HB   SER  15           HB1      SER  15  51.960   5.282  -2.204
  107    HG   SER  15           HG       SER  15  52.251   7.560  -2.719
  108    H    GLU  16           HN       GLU  16  52.376   6.210   0.381
  109    HA   GLU  16           HA       GLU  16  53.652   4.414   2.180
  110   1HB   GLU  16           HB2      GLU  16  51.595   4.516   3.478
  111   2HB   GLU  16           HB1      GLU  16  51.927   6.118   2.817
  112   1HG   GLU  16           HG2      GLU  16  50.290   5.858   1.100
  113   2HG   GLU  16           HG1      GLU  16  50.133   4.128   1.416
  114    H    GLU  17           HN       GLU  17  51.787   3.779  -0.620
  115    HA   GLU  17           HA       GLU  17  50.645   1.251   0.165
  116   1HB   GLU  17           HB2      GLU  17  49.959   2.643  -1.842
  117   2HB   GLU  17           HB1      GLU  17  51.434   2.090  -2.637
  118   1HG   GLU  17           HG2      GLU  17  50.658  -0.289  -2.126
  119   2HG   GLU  17           HG1      GLU  17  49.099   0.414  -1.694
  120    H    MET  18           HN       MET  18  53.381   1.853  -2.076
  121    HA   MET  18           HA       MET  18  54.333  -0.857  -1.891
  122   1HB   MET  18           HB2      MET  18  55.928   1.596  -2.684
  123   2HB   MET  18           HB1      MET  18  56.249  -0.076  -3.142
  124   1HG   MET  18           HG2      MET  18  53.606   0.330  -3.926
  125   2HG   MET  18           HG1      MET  18  54.407   1.846  -4.338
  126   1HE   MET  18           HE1      MET  18  55.842   2.334  -5.776
  127   2HE   MET  18           HE3      MET  18  56.653   1.371  -7.017
  128   3HE   MET  18           HE2      MET  18  54.940   1.746  -7.170
  129    H    ILE  19           HN       ILE  19  55.379   2.183  -0.343
  130    HA   ILE  19           HA       ILE  19  57.628   1.315   1.045
  131    HB   ILE  19           HB       ILE  19  55.399   3.158   1.941
  132   1HG1  ILE  19          HG12      ILE  19  58.189   3.570   0.820
  133   2HG1  ILE  19          HG11      ILE  19  56.661   3.974   0.037
  134   1HG2  ILE  19          HG23      ILE  19  57.569   2.003   3.479
  135   2HG2  ILE  19          HG22      ILE  19  57.766   3.751   3.347
  136   3HG2  ILE  19          HG21      ILE  19  56.279   3.079   4.015
  137   1HD1  ILE  19          HD13      ILE  19  56.631   5.230   2.582
  138   2HD1  ILE  19          HD12      ILE  19  58.209   5.564   1.866
  139   3HD1  ILE  19          HD11      ILE  19  56.736   6.005   1.002
  140    H    ALA  20           HN       ALA  20  54.261   0.517   1.668
  141    HA   ALA  20           HA       ALA  20  54.644  -0.582   4.299
  142   1HB   ALA  20           HB2      ALA  20  52.526  -0.610   2.232
  143   2HB   ALA  20           HB1      ALA  20  52.535  -2.003   3.314
  144   3HB   ALA  20           HB3      ALA  20  52.394  -0.375   3.976
  145    H    GLU  21           HN       GLU  21  54.623  -2.061   1.051
  146    HA   GLU  21           HA       GLU  21  55.013  -4.749   1.867
  147   1HB   GLU  21           HB2      GLU  21  56.305  -3.567  -0.595
  148   2HB   GLU  21           HB1      GLU  21  55.654  -5.192  -0.373
  149   1HG   GLU  21           HG2      GLU  21  53.536  -3.388   0.179
  150   2HG   GLU  21           HG1      GLU  21  54.299  -2.834  -1.312
  151    H    PHE  22           HN       PHE  22  57.447  -2.263   1.034
  152    HA   PHE  22           HA       PHE  22  59.760  -3.814   1.453
  153   1HB   PHE  22           HB2      PHE  22  59.507  -0.916   2.288
  154   2HB   PHE  22           HB1      PHE  22  60.947  -1.752   1.706
  155    HD1  PHE  22           HD1      PHE  22  59.555  -3.334  -0.524
  156    HD2  PHE  22           HD2      PHE  22  59.408   0.809   0.606
  157    HE1  PHE  22           HE1      PHE  22  58.972  -2.719  -2.854
  158    HE2  PHE  22           HE2      PHE  22  58.825   1.424  -1.724
  159    HZ   PHE  22           HZ       PHE  22  58.607  -0.340  -3.455
  160    H    LYS  23           HN       LYS  23  57.609  -2.296   3.798
  161    HA   LYS  23           HA       LYS  23  59.274  -2.493   6.096
  162   1HB   LYS  23           HB2      LYS  23  56.665  -1.683   5.585
  163   2HB   LYS  23           HB1      LYS  23  56.462  -3.084   6.637
  164   1HG   LYS  23           HG2      LYS  23  58.576  -1.129   7.395
  165   2HG   LYS  23           HG1      LYS  23  56.902  -0.621   7.614
  166   1HD   LYS  23           HD2      LYS  23  56.434  -2.399   9.100
  167   2HD   LYS  23           HD1      LYS  23  57.864  -3.304   8.603
  168   1HE   LYS  23           HE2      LYS  23  58.132  -2.201  10.834
  169   2HE   LYS  23           HE1      LYS  23  59.324  -1.665   9.652
  170   1HZ   LYS  23           HZ3      LYS  23  56.811  -0.178   9.849
  171   2HZ   LYS  23           HZ2      LYS  23  57.961   0.037  11.081
  172   3HZ   LYS  23           HZ1      LYS  23  58.369   0.376   9.467
  173    H    ALA  24           HN       ALA  24  56.962  -4.836   4.722
  174    HA   ALA  24           HA       ALA  24  57.264  -6.847   6.700
  175   1HB   ALA  24           HB1      ALA  24  56.253  -6.678   3.950
  176   2HB   ALA  24           HB3      ALA  24  56.910  -8.263   4.357
  177   3HB   ALA  24           HB2      ALA  24  55.611  -7.569   5.328
  178    H    ALA  25           HN       ALA  25  59.368  -5.879   4.082
  179    HA   ALA  25           HA       ALA  25  60.978  -8.313   4.152
  180   1HB   ALA  25           HB2      ALA  25  60.831  -5.921   2.547
  181   2HB   ALA  25           HB1      ALA  25  62.495  -6.178   3.070
  182   3HB   ALA  25           HB3      ALA  25  61.645  -7.444   2.185
  183    H    PHE  26           HN       PHE  26  61.599  -4.931   5.151
  184    HA   PHE  26           HA       PHE  26  64.070  -5.280   6.395
  185   1HB   PHE  26           HB2      PHE  26  62.694  -3.128   6.108
  186   2HB   PHE  26           HB1      PHE  26  61.886  -3.579   7.608
  187    HD1  PHE  26           HD1      PHE  26  65.280  -3.042   6.131
  188    HD2  PHE  26           HD2      PHE  26  62.868  -3.074   9.685
  189    HE1  PHE  26           HE1      PHE  26  67.182  -2.122   7.431
  190    HE2  PHE  26           HE2      PHE  26  64.771  -2.156  10.985
  191    HZ   PHE  26           HZ       PHE  26  66.928  -1.679   9.857
  192    H    ASP  27           HN       ASP  27  60.887  -5.530   8.027
  193    HA   ASP  27           HA       ASP  27  61.685  -6.257  10.571
  194   1HB   ASP  27           HB2      ASP  27  59.408  -7.354   8.906
  195   2HB   ASP  27           HB1      ASP  27  59.611  -7.735  10.617
  196    H    MET  28           HN       MET  28  61.661  -8.349   7.701
  197    HA   MET  28           HA       MET  28  62.428 -10.712   9.214
  198   1HB   MET  28           HB2      MET  28  61.299 -11.322   7.287
  199   2HB   MET  28           HB1      MET  28  61.984 -10.003   6.343
  200   1HG   MET  28           HG2      MET  28  64.028 -11.138   6.026
  201   2HG   MET  28           HG1      MET  28  63.692 -12.284   7.323
  202   1HE   MET  28           HE2      MET  28  62.650 -10.781   4.102
  203   2HE   MET  28           HE1      MET  28  63.779 -11.987   3.489
  204   3HE   MET  28           HE3      MET  28  62.062 -12.094   3.085
  205    H    PHE  29           HN       PHE  29  64.108  -8.241   7.308
  206    HA   PHE  29           HA       PHE  29  66.677  -9.629   7.526
  207   1HB   PHE  29           HB2      PHE  29  65.802  -6.953   6.442
  208   2HB   PHE  29           HB1      PHE  29  67.511  -7.356   6.616
  209    HD1  PHE  29           HD2      PHE  29  64.323  -8.769   5.250
  210    HD2  PHE  29           HD1      PHE  29  68.595  -8.520   4.895
  211    HE1  PHE  29           HE2      PHE  29  64.228 -10.103   3.160
  212    HE2  PHE  29           HE1      PHE  29  68.501  -9.852   2.809
  213    HZ   PHE  29           HZ       PHE  29  66.319 -10.644   1.940
  214    H    ASP  30           HN       ASP  30  64.868  -8.190   9.790
  215    HA   ASP  30           HA       ASP  30  67.239  -6.991  11.167
  216   1HB   ASP  30           HB2      ASP  30  64.569  -5.977  10.745
  217   2HB   ASP  30           HB1      ASP  30  64.869  -6.162  12.473
  218    H    ALA  31           HN       ALA  31  66.817  -9.763  11.240
  219    HA   ALA  31           HA       ALA  31  65.239 -10.641  13.463
  220   1HB   ALA  31           HB3      ALA  31  67.584 -11.799  11.968
  221   2HB   ALA  31           HB2      ALA  31  66.959 -12.600  13.409
  222   3HB   ALA  31           HB1      ALA  31  65.912 -12.361  12.010
  223    H    ASP  32           HN       ASP  32  68.271  -8.995  13.288
  224    HA   ASP  32           HA       ASP  32  69.345  -9.878  15.822
  225   1HB   ASP  32           HB2      ASP  32  69.848  -7.428  14.114
  226   2HB   ASP  32           HB1      ASP  32  70.714  -7.738  15.620
  227    H    GLY  33           HN       GLY  33  66.999  -7.466  14.865
  228   1HA   GLY  33           HA2      GLY  33  65.457  -6.332  16.254
  229   2HA   GLY  33           HA1      GLY  33  66.221  -7.087  17.655
  230    H    GLY  34           HN       GLY  34  68.555  -5.689  15.669
  231   1HA   GLY  34           HA2      GLY  34  69.004  -3.548  17.627
  232   2HA   GLY  34           HA1      GLY  34  70.055  -3.948  16.269
  233    H    GLY  35           HN       GLY  35  67.429  -3.902  14.592
  234   1HA   GLY  35           HA2      GLY  35  66.032  -2.219  13.611
  235   2HA   GLY  35           HA1      GLY  35  66.885  -0.997  14.555
  236    H    ASP  36           HN       ASP  36  68.681  -3.402  12.760
  237    HA   ASP  36           HA       ASP  36  69.017  -1.762  10.381
  238   1HB   ASP  36           HB2      ASP  36  71.592  -1.579  10.942
  239   2HB   ASP  36           HB1      ASP  36  70.468  -0.362  11.548
  240    H    ILE  37           HN       ILE  37  70.448  -2.818   8.820
  241    HA   ILE  37           HA       ILE  37  71.246  -5.590   9.572
  242    HB   ILE  37           HB       ILE  37  69.833  -6.571   8.095
  243   1HG1  ILE  37          HG12      ILE  37  70.704  -4.408   6.155
  244   2HG1  ILE  37          HG11      ILE  37  71.202  -6.099   6.174
  245   1HG2  ILE  37          HG22      ILE  37  68.372  -4.738   9.054
  246   2HG2  ILE  37          HG21      ILE  37  68.676  -3.825   7.575
  247   3HG2  ILE  37          HG23      ILE  37  67.840  -5.376   7.498
  248   1HD1  ILE  37          HD11      ILE  37  68.357  -5.167   5.702
  249   2HD1  ILE  37          HD13      ILE  37  69.486  -5.603   4.420
  250   3HD1  ILE  37          HD12      ILE  37  68.957  -6.820   5.580
  251    H    SER  38           HN       SER  38  73.157  -6.305   8.524
  252    HA   SER  38           HA       SER  38  75.079  -4.427   7.728
  253   1HB   SER  38           HB2      SER  38  76.390  -6.238   7.165
  254   2HB   SER  38           HB1      SER  38  75.126  -7.113   8.027
  255    HG   SER  38           HG       SER  38  74.933  -8.115   6.183
  256    H    THR  39           HN       THR  39  75.448  -3.312   5.787
  257    HA   THR  39           HA       THR  39  73.263  -3.125   3.953
  258    HB   THR  39           HB       THR  39  74.483  -1.490   2.828
  259    HG1  THR  39           HG1      THR  39  76.806  -2.831   3.758
  260   1HG2  THR  39          HG22      THR  39  74.671  -1.599   5.658
  261   2HG2  THR  39          HG21      THR  39  76.212  -0.979   5.066
  262   3HG2  THR  39          HG23      THR  39  74.708  -0.168   4.629
  263    H    LYS  40           HN       LYS  40  75.777  -5.403   4.181
  264    HA   LYS  40           HA       LYS  40  75.997  -6.005   1.338
  265   1HB   LYS  40           HB2      LYS  40  76.699  -7.782   3.693
  266   2HB   LYS  40           HB1      LYS  40  77.306  -7.919   2.042
  267   1HG   LYS  40           HG2      LYS  40  77.728  -5.248   3.138
  268   2HG   LYS  40           HG1      LYS  40  78.506  -6.493   4.115
  269   1HD   LYS  40           HD2      LYS  40  79.323  -7.426   1.808
  270   2HD   LYS  40           HD1      LYS  40  78.966  -5.800   1.225
  271   1HE   LYS  40           HE2      LYS  40  81.349  -6.135   2.016
  272   2HE   LYS  40           HE1      LYS  40  80.490  -4.813   2.807
  273   1HZ   LYS  40           HZ1      LYS  40  80.309  -7.462   4.024
  274   2HZ   LYS  40           HZ3      LYS  40  81.788  -6.643   4.167
  275   3HZ   LYS  40           HZ2      LYS  40  80.363  -5.930   4.757
  276    H    ALA  41           HN       ALA  41  73.673  -6.687   3.750
  277    HA   ALA  41           HA       ALA  41  72.755  -9.188   2.490
  278   1HB   ALA  41           HB1      ALA  41  72.687  -8.643   5.018
  279   2HB   ALA  41           HB3      ALA  41  71.284  -7.646   4.628
  280   3HB   ALA  41           HB2      ALA  41  71.251  -9.380   4.305
  281    H    LEU  42           HN       LEU  42  72.464  -6.020   1.659
  282    HA   LEU  42           HA       LEU  42  69.655  -5.731   1.182
  283   1HB   LEU  42           HB2      LEU  42  72.128  -4.430   0.090
  284   2HB   LEU  42           HB1      LEU  42  70.600  -4.165  -0.743
  285    HG   LEU  42           HG       LEU  42  70.758  -2.382   0.815
  286   1HD1  LEU  42          HD12      LEU  42  68.603  -3.815   0.859
  287   2HD1  LEU  42          HD11      LEU  42  69.187  -4.388   2.422
  288   3HD1  LEU  42          HD13      LEU  42  68.862  -2.671   2.177
  289   1HD2  LEU  42          HD23      LEU  42  72.169  -4.379   2.390
  290   2HD2  LEU  42          HD22      LEU  42  72.254  -2.622   2.475
  291   3HD2  LEU  42          HD21      LEU  42  71.000  -3.489   3.363
  292    H    GLY  43           HN       GLY  43  72.285  -6.734  -1.031
  293   1HA   GLY  43           HA2      GLY  43  70.847  -7.246  -3.341
  294   2HA   GLY  43           HA1      GLY  43  72.175  -8.283  -2.813
  295    H    THR  44           HN       THR  44  70.716  -8.992  -0.315
  296    HA   THR  44           HA       THR  44  69.277 -11.290  -1.366
  297    HB   THR  44           HB       THR  44  69.697 -10.200   1.426
  298    HG1  THR  44           HG1      THR  44  71.345 -11.338  -0.003
  299   1HG2  THR  44          HG22      THR  44  67.644 -11.950   0.561
  300   2HG2  THR  44          HG21      THR  44  68.850 -12.950   1.367
  301   3HG2  THR  44          HG23      THR  44  68.122 -11.590   2.221
  302    H    VAL  45           HN       VAL  45  68.347  -8.345   0.423
  303    HA   VAL  45           HA       VAL  45  65.552  -8.912   0.539
  304    HB   VAL  45           HB       VAL  45  66.806  -6.160   0.304
  305   1HG1  VAL  45          HG11      VAL  45  64.183  -6.817   0.336
  306   2HG1  VAL  45          HG13      VAL  45  64.495  -6.765   2.072
  307   3HG1  VAL  45          HG12      VAL  45  64.810  -5.343   1.076
  308   1HG2  VAL  45          HG21      VAL  45  67.872  -7.668   2.063
  309   2HG2  VAL  45          HG23      VAL  45  67.141  -6.188   2.682
  310   3HG2  VAL  45          HG22      VAL  45  66.294  -7.725   2.847
  311    H    MET  46           HN       MET  46  67.205  -6.619  -1.659
  312    HA   MET  46           HA       MET  46  65.107  -6.103  -3.409
  313   1HB   MET  46           HB2      MET  46  68.018  -5.983  -3.539
  314   2HB   MET  46           HB1      MET  46  67.308  -6.363  -5.109
  315   1HG   MET  46           HG2      MET  46  65.624  -4.393  -4.210
  316   2HG   MET  46           HG1      MET  46  67.170  -3.871  -3.541
  317   1HE   MET  46           HE3      MET  46  67.768  -2.137  -4.387
  318   2HE   MET  46           HE2      MET  46  68.466  -1.839  -5.977
  319   3HE   MET  46           HE1      MET  46  66.753  -1.535  -5.704
  320    H    ARG  47           HN       ARG  47  67.294  -8.913  -3.462
  321    HA   ARG  47           HA       ARG  47  66.569 -10.134  -5.845
  322   1HB   ARG  47           HB2      ARG  47  67.604 -11.019  -3.275
  323   2HB   ARG  47           HB1      ARG  47  66.555 -12.240  -3.995
  324   1HG   ARG  47           HG2      ARG  47  67.863 -12.356  -5.976
  325   2HG   ARG  47           HG1      ARG  47  68.714 -10.858  -5.592
  326   1HD   ARG  47           HD2      ARG  47  69.674 -12.009  -3.567
  327   2HD   ARG  47           HD1      ARG  47  68.956 -13.512  -4.147
  328    HE   ARG  47           HE       ARG  47  70.524 -12.366  -6.244
  329   1HH1  ARG  47          HH11      ARG  47  70.464 -14.580  -3.675
  330   2HH1  ARG  47          HH12      ARG  47  72.156 -14.950  -3.743
  331   1HH2  ARG  47          HH21      ARG  47  72.858 -12.526  -6.121
  332   2HH2  ARG  47          HH22      ARG  47  73.510 -13.786  -5.129
  333    H    MET  48           HN       MET  48  64.819 -10.488  -2.739
  334    HA   MET  48           HA       MET  48  62.663 -11.988  -3.955
  335   1HB   MET  48           HB2      MET  48  61.478 -11.447  -1.759
  336   2HB   MET  48           HB1      MET  48  62.995 -12.333  -1.622
  337   1HG   MET  48           HG2      MET  48  64.196 -10.327  -1.028
  338   2HG   MET  48           HG1      MET  48  62.793  -9.319  -1.387
  339   1HE   MET  48           HE2      MET  48  63.774 -12.465   0.086
  340   2HE   MET  48           HE1      MET  48  64.228 -11.868   1.680
  341   3HE   MET  48           HE3      MET  48  62.717 -12.762   1.463
  342    H    LEU  49           HN       LEU  49  63.079  -8.556  -3.071
  343    HA   LEU  49           HA       LEU  49  60.467  -7.639  -3.514
  344   1HB   LEU  49           HB2      LEU  49  62.904  -6.155  -4.518
  345   2HB   LEU  49           HB1      LEU  49  61.394  -5.474  -3.915
  346    HG   LEU  49           HG       LEU  49  63.575  -6.854  -2.349
  347   1HD1  LEU  49          HD13      LEU  49  62.208  -4.160  -2.270
  348   2HD1  LEU  49          HD12      LEU  49  63.211  -4.750  -0.945
  349   3HD1  LEU  49          HD11      LEU  49  63.917  -4.502  -2.543
  350   1HD2  LEU  49          HD23      LEU  49  61.316  -7.769  -1.721
  351   2HD2  LEU  49          HD22      LEU  49  62.102  -6.882  -0.416
  352   3HD2  LEU  49          HD21      LEU  49  60.808  -6.122  -1.342
  353    H    GLY  50           HN       GLY  50  62.795  -8.815  -5.826
  354   1HA   GLY  50           HA2      GLY  50  61.773  -9.670  -7.956
  355   2HA   GLY  50           HA1      GLY  50  60.853  -8.166  -8.011
  356    H    GLN  51           HN       GLN  51  63.876  -7.450  -6.815
  357    HA   GLN  51           HA       GLN  51  64.859  -6.737  -9.551
  358   1HB   GLN  51           HB2      GLN  51  65.209  -5.292  -6.908
  359   2HB   GLN  51           HB1      GLN  51  66.050  -4.848  -8.393
  360   1HG   GLN  51           HG2      GLN  51  63.416  -5.035  -9.217
  361   2HG   GLN  51           HG1      GLN  51  63.272  -4.340  -7.602
  362   1HE2  GLN  51          HE22      GLN  51  64.837  -1.264  -8.492
  363   2HE2  GLN  51          HE21      GLN  51  64.371  -2.261  -7.199
  364    H    ASN  52           HN       ASN  52  66.601  -7.955 -10.095
  365    HA   ASN  52           HA       ASN  52  68.423  -8.844  -7.893
  366   1HB   ASN  52           HB2      ASN  52  69.033 -10.723  -9.414
  367   2HB   ASN  52           HB1      ASN  52  67.321 -10.733  -8.988
  368   1HD2  ASN  52          HD22      ASN  52  66.256  -9.740 -12.289
  369   2HD2  ASN  52          HD21      ASN  52  65.837  -9.604 -10.648
  370    HA   PRO  53           HA       PRO  53  70.885  -6.020 -10.537
  371   1HB   PRO  53           HB2      PRO  53  72.039  -4.710  -8.414
  372   2HB   PRO  53           HB1      PRO  53  70.495  -4.229  -9.138
  373   1HG   PRO  53           HG2      PRO  53  71.001  -5.623  -6.550
  374   2HG   PRO  53           HG1      PRO  53  69.639  -4.593  -7.022
  375   1HD   PRO  53           HD2      PRO  53  69.616  -7.422  -6.916
  376   2HD   PRO  53           HD1      PRO  53  68.393  -6.396  -7.695
  377    H    THR  54           HN       THR  54  73.421  -5.561 -10.114
  378    HA   THR  54           HA       THR  54  74.614  -8.224  -9.604
  379    HB   THR  54           HB       THR  54  76.472  -7.490 -10.846
  380    HG1  THR  54           HG1      THR  54  77.235  -5.605 -10.413
  381   1HG2  THR  54          HG23      THR  54  74.424  -7.609 -12.231
  382   2HG2  THR  54          HG22      THR  54  74.125  -5.898 -11.919
  383   3HG2  THR  54          HG21      THR  54  75.546  -6.391 -12.840
  384    H    LYS  55           HN       LYS  55  76.282  -8.539  -8.061
  385    HA   LYS  55           HA       LYS  55  76.040  -7.212  -5.589
  386   1HB   LYS  55           HB2      LYS  55  77.745  -9.230  -6.737
  387   2HB   LYS  55           HB1      LYS  55  78.720  -8.115  -5.777
  388   1HG   LYS  55           HG2      LYS  55  78.004  -9.200  -3.938
  389   2HG   LYS  55           HG1      LYS  55  76.398  -8.547  -4.258
  390   1HD   LYS  55           HD2      LYS  55  75.885 -10.488  -5.690
  391   2HD   LYS  55           HD1      LYS  55  77.493 -11.146  -5.375
  392   1HE   LYS  55           HE2      LYS  55  76.488 -12.230  -3.651
  393   2HE   LYS  55           HE1      LYS  55  76.577 -10.672  -2.830
  394   1HZ   LYS  55           HZ3      LYS  55  74.335 -10.799  -4.574
  395   2HZ   LYS  55           HZ2      LYS  55  74.299 -12.071  -3.448
  396   3HZ   LYS  55           HZ1      LYS  55  74.386 -10.460  -2.913
  397    H    GLU  56           HN       GLU  56  78.563  -6.720  -8.086
  398    HA   GLU  56           HA       GLU  56  79.967  -4.646  -6.790
  399   1HB   GLU  56           HB2      GLU  56  79.949  -5.823  -9.365
  400   2HB   GLU  56           HB1      GLU  56  79.784  -4.085  -9.613
  401   1HG   GLU  56           HG2      GLU  56  81.849  -5.231  -7.729
  402   2HG   GLU  56           HG1      GLU  56  82.180  -5.007  -9.447
  403    H    GLU  57           HN       GLU  57  76.950  -4.537  -8.622
  404    HA   GLU  57           HA       GLU  57  76.811  -1.657  -8.777
  405   1HB   GLU  57           HB2      GLU  57  74.672  -3.796  -8.943
  406   2HB   GLU  57           HB1      GLU  57  74.371  -2.084  -9.241
  407   1HG   GLU  57           HG2      GLU  57  76.654  -3.317 -10.701
  408   2HG   GLU  57           HG1      GLU  57  75.033  -3.787 -11.214
  409    H    LEU  58           HN       LEU  58  75.723  -4.047  -6.407
  410    HA   LEU  58           HA       LEU  58  74.169  -2.173  -4.847
  411   1HB   LEU  58           HB2      LEU  58  74.005  -4.722  -4.785
  412   2HB   LEU  58           HB1      LEU  58  75.475  -4.695  -3.808
  413    HG   LEU  58           HG       LEU  58  73.750  -2.746  -2.700
  414   1HD1  LEU  58          HD12      LEU  58  72.088  -4.303  -4.096
  415   2HD1  LEU  58          HD11      LEU  58  72.266  -5.338  -2.678
  416   3HD1  LEU  58          HD13      LEU  58  71.655  -3.693  -2.499
  417   1HD2  LEU  58          HD23      LEU  58  75.444  -4.249  -1.582
  418   2HD2  LEU  58          HD22      LEU  58  73.898  -4.156  -0.738
  419   3HD2  LEU  58          HD21      LEU  58  74.281  -5.567  -1.723
  420    H    ASP  59           HN       ASP  59  77.542  -3.252  -4.763
  421    HA   ASP  59           HA       ASP  59  78.264  -2.092  -2.266
  422   1HB   ASP  59           HB2      ASP  59  79.888  -2.532  -4.788
  423   2HB   ASP  59           HB1      ASP  59  80.585  -2.035  -3.246
  424    H    ALA  60           HN       ALA  60  78.371  -0.709  -5.560
  425    HA   ALA  60           HA       ALA  60  79.371   1.851  -4.724
  426   1HB   ALA  60           HB2      ALA  60  79.257   0.833  -7.108
  427   2HB   ALA  60           HB1      ALA  60  77.604   1.444  -7.135
  428   3HB   ALA  60           HB3      ALA  60  78.954   2.561  -6.937
  429    H    ILE  61           HN       ILE  61  76.132   0.482  -4.956
  430    HA   ILE  61           HA       ILE  61  74.702   2.963  -4.675
  431    HB   ILE  61           HB       ILE  61  73.976   0.085  -4.085
  432   1HG1  ILE  61          HG12      ILE  61  73.205   2.071  -6.248
  433   2HG1  ILE  61          HG11      ILE  61  74.220   0.642  -6.449
  434   1HG2  ILE  61          HG22      ILE  61  72.665   2.529  -3.217
  435   2HG2  ILE  61          HG21      ILE  61  71.626   1.601  -4.299
  436   3HG2  ILE  61          HG23      ILE  61  72.266   0.854  -2.835
  437   1HD1  ILE  61          HD12      ILE  61  71.424   0.375  -5.364
  438   2HD1  ILE  61          HD11      ILE  61  71.699   0.481  -7.104
  439   3HD1  ILE  61          HD13      ILE  61  72.416  -0.836  -6.175
  440    H    ILE  62           HN       ILE  62  76.001   0.628  -2.349
  441    HA   ILE  62           HA       ILE  62  74.804   1.751  -0.007
  442    HB   ILE  62           HB       ILE  62  77.464   0.314  -0.280
  443   1HG1  ILE  62          HG12      ILE  62  74.877  -0.944   0.599
  444   2HG1  ILE  62          HG11      ILE  62  75.216  -0.765  -1.122
  445   1HG2  ILE  62          HG21      ILE  62  75.620   0.715   2.096
  446   2HG2  ILE  62          HG23      ILE  62  77.089  -0.262   2.094
  447   3HG2  ILE  62          HG22      ILE  62  77.191   1.483   1.872
  448   1HD1  ILE  62          HD13      ILE  62  77.586  -1.758   0.094
  449   2HD1  ILE  62          HD12      ILE  62  76.245  -2.729   0.702
  450   3HD1  ILE  62          HD11      ILE  62  76.520  -2.594  -1.035
  451    H    GLU  63           HN       GLU  63  77.438   2.803  -2.004
  452    HA   GLU  63           HA       GLU  63  78.836   4.390  -0.061
  453   1HB   GLU  63           HB2      GLU  63  79.205   3.746  -2.731
  454   2HB   GLU  63           HB1      GLU  63  78.846   5.473  -2.785
  455   1HG   GLU  63           HG2      GLU  63  80.546   5.503  -0.719
  456   2HG   GLU  63           HG1      GLU  63  81.150   4.053  -1.524
  457    H    GLU  64           HN       GLU  64  75.957   4.962  -1.996
  458    HA   GLU  64           HA       GLU  64  75.907   7.794  -1.091
  459   1HB   GLU  64           HB2      GLU  64  74.929   6.364  -3.417
  460   2HB   GLU  64           HB1      GLU  64  73.629   7.276  -2.650
  461   1HG   GLU  64           HG2      GLU  64  74.542   9.279  -3.206
  462   2HG   GLU  64           HG1      GLU  64  76.179   8.737  -2.832
  463    H    VAL  65           HN       VAL  65  74.384   4.707  -0.550
  464    HA   VAL  65           HA       VAL  65  72.010   5.791   0.743
  465    HB   VAL  65           HB       VAL  65  73.253   3.024   0.841
  466   1HG1  VAL  65          HG11      VAL  65  70.715   4.186   1.973
  467   2HG1  VAL  65          HG13      VAL  65  70.790   2.485   1.511
  468   3HG1  VAL  65          HG12      VAL  65  71.882   3.113   2.747
  469   1HG2  VAL  65          HG23      VAL  65  71.069   4.299  -0.820
  470   2HG2  VAL  65          HG22      VAL  65  72.534   3.496  -1.390
  471   3HG2  VAL  65          HG21      VAL  65  71.235   2.549  -0.658
  472    H    ASP  66           HN       ASP  66  75.239   4.845   1.760
  473    HA   ASP  66           HA       ASP  66  74.551   5.026   4.612
  474   1HB   ASP  66           HB2      ASP  66  76.615   3.819   3.121
  475   2HB   ASP  66           HB1      ASP  66  77.393   5.093   4.061
  476    H    GLU  67           HN       GLU  67  73.733   7.321   4.255
  477    HA   GLU  67           HA       GLU  67  75.438   9.476   3.553
  478   1HB   GLU  67           HB2      GLU  67  73.871  10.864   4.956
  479   2HB   GLU  67           HB1      GLU  67  73.052   9.832   3.782
  480   1HG   GLU  67           HG2      GLU  67  73.207   8.145   5.919
  481   2HG   GLU  67           HG1      GLU  67  73.041   9.700   6.737
  482    H    ASP  68           HN       ASP  68  75.154   7.637   6.529
  483    HA   ASP  68           HA       ASP  68  77.055   9.496   7.869
  484   1HB   ASP  68           HB2      ASP  68  76.523   7.900   9.861
  485   2HB   ASP  68           HB1      ASP  68  75.281   9.040   9.347
  486    H    GLY  69           HN       GLY  69  76.805   6.327   6.455
  487   1HA   GLY  69           HA2      GLY  69  78.569   4.859   5.888
  488   2HA   GLY  69           HA1      GLY  69  79.695   5.971   6.667
  489    H    SER  70           HN       SER  70  76.857   4.795   8.347
  490    HA   SER  70           HA       SER  70  78.453   3.800  10.538
  491   1HB   SER  70           HB2      SER  70  76.115   2.731  11.134
  492   2HB   SER  70           HB1      SER  70  76.337   4.475  11.233
  493    HG   SER  70           HG       SER  70  74.632   4.388   9.958
  494    H    GLY  71           HN       GLY  71  77.654   2.471   7.524
  495   1HA   GLY  71           HA2      GLY  71  78.259   0.363   6.650
  496   2HA   GLY  71           HA1      GLY  71  78.866  -0.081   8.247
  497    H    THR  72           HN       THR  72  75.669   1.175   8.185
  498    HA   THR  72           HA       THR  72  74.468  -1.535   8.019
  499    HB   THR  72           HB       THR  72  73.153  -0.922  10.154
  500    HG1  THR  72           HG1      THR  72  73.817   0.747  11.251
  501   1HG2  THR  72          HG23      THR  72  75.976  -1.837   9.912
  502   2HG2  THR  72          HG22      THR  72  75.389  -1.473  11.534
  503   3HG2  THR  72          HG21      THR  72  74.569  -2.687  10.553
  504    H    ILE  73           HN       ILE  73  72.406  -1.472   7.150
  505    HA   ILE  73           HA       ILE  73  71.409   1.212   6.359
  506    HB   ILE  73           HB       ILE  73  70.582  -1.565   5.462
  507   1HG1  ILE  73          HG12      ILE  73  72.883  -0.680   4.785
  508   2HG1  ILE  73          HG11      ILE  73  71.806  -1.102   3.455
  509   1HG2  ILE  73          HG21      ILE  73  69.750   1.185   4.490
  510   2HG2  ILE  73          HG23      ILE  73  69.330  -0.336   3.700
  511   3HG2  ILE  73          HG22      ILE  73  68.719   0.018   5.316
  512   1HD1  ILE  73          HD12      ILE  73  71.498   1.671   4.375
  513   2HD1  ILE  73          HD11      ILE  73  73.099   1.316   3.726
  514   3HD1  ILE  73          HD13      ILE  73  71.664   1.043   2.735
  515    H    ASP  74           HN       ASP  74  69.425   1.983   7.036
  516    HA   ASP  74           HA       ASP  74  67.949   0.285   9.011
  517   1HB   ASP  74           HB2      ASP  74  68.015   3.314   8.938
  518   2HB   ASP  74           HB1      ASP  74  67.369   2.287  10.218
  519    H    PHE  75           HN       PHE  75  65.556   0.915   9.120
  520    HA   PHE  75           HA       PHE  75  64.270   0.552   6.673
  521   1HB   PHE  75           HB2      PHE  75  63.287   0.545   9.072
  522   2HB   PHE  75           HB1      PHE  75  63.040   2.273   8.821
  523    HD1  PHE  75           HD2      PHE  75  62.735  -0.711   6.571
  524    HD2  PHE  75           HD1      PHE  75  60.801   2.701   8.324
  525    HE1  PHE  75           HE2      PHE  75  60.690  -1.191   5.250
  526    HE2  PHE  75           HE1      PHE  75  58.756   2.220   7.005
  527    HZ   PHE  75           HZ       PHE  75  58.701   0.275   5.467
  528    H    GLU  76           HN       GLU  76  65.031   3.654   8.272
  529    HA   GLU  76           HA       GLU  76  63.835   5.352   6.332
  530   1HB   GLU  76           HB2      GLU  76  65.297   7.102   7.205
  531   2HB   GLU  76           HB1      GLU  76  64.712   6.114   8.544
  532   1HG   GLU  76           HG2      GLU  76  66.864   4.740   8.258
  533   2HG   GLU  76           HG1      GLU  76  67.439   6.064   7.245
  534    H    GLU  77           HN       GLU  77  67.125   3.984   6.489
  535    HA   GLU  77           HA       GLU  77  67.988   5.268   4.037
  536   1HB   GLU  77           HB2      GLU  77  69.112   2.795   5.391
  537   2HB   GLU  77           HB1      GLU  77  69.936   3.802   4.200
  538   1HG   GLU  77           HG2      GLU  77  69.735   5.742   5.758
  539   2HG   GLU  77           HG1      GLU  77  69.030   4.664   6.963
  540    H    PHE  78           HN       PHE  78  66.009   2.561   4.731
  541    HA   PHE  78           HA       PHE  78  66.578   0.955   2.410
  542   1HB   PHE  78           HB2      PHE  78  64.893   0.766   4.638
  543   2HB   PHE  78           HB1      PHE  78  63.794   0.856   3.261
  544    HD1  PHE  78           HD2      PHE  78  64.058  -0.762   1.354
  545    HD2  PHE  78           HD1      PHE  78  66.235  -1.166   5.033
  546    HE1  PHE  78           HE2      PHE  78  64.574  -3.121   0.788
  547    HE2  PHE  78           HE1      PHE  78  66.751  -3.526   4.469
  548    HZ   PHE  78           HZ       PHE  78  65.920  -4.503   2.347
  549    H    LEU  79           HN       LEU  79  63.755   3.060   3.050
  550    HA   LEU  79           HA       LEU  79  62.672   3.145   0.489
  551   1HB   LEU  79           HB2      LEU  79  62.971   5.576   2.280
  552   2HB   LEU  79           HB1      LEU  79  61.722   5.303   1.064
  553    HG   LEU  79           HG       LEU  79  62.130   3.729   3.624
  554   1HD1  LEU  79          HD13      LEU  79  60.160   5.784   2.665
  555   2HD1  LEU  79          HD12      LEU  79  59.650   4.564   3.831
  556   3HD1  LEU  79          HD11      LEU  79  60.971   5.664   4.227
  557   1HD2  LEU  79          HD21      LEU  79  60.121   3.349   1.380
  558   2HD2  LEU  79          HD23      LEU  79  61.449   2.255   1.766
  559   3HD2  LEU  79          HD22      LEU  79  60.123   2.469   2.907
  560    H    VAL  80           HN       VAL  80  65.621   4.604   1.650
  561    HA   VAL  80           HA       VAL  80  66.005   6.438  -0.550
  562    HB   VAL  80           HB       VAL  80  67.895   5.195   1.461
  563   1HG1  VAL  80          HG11      VAL  80  68.429   7.063  -0.848
  564   2HG1  VAL  80          HG13      VAL  80  69.443   7.083   0.595
  565   3HG1  VAL  80          HG12      VAL  80  69.321   5.617  -0.375
  566   1HG2  VAL  80          HG21      VAL  80  66.452   7.813   1.138
  567   2HG2  VAL  80          HG23      VAL  80  66.591   6.790   2.568
  568   3HG2  VAL  80          HG22      VAL  80  67.968   7.756   2.038
  569    H    MET  81           HN       MET  81  67.504   3.263   0.178
  570    HA   MET  81           HA       MET  81  68.939   2.979  -2.223
  571   1HB   MET  81           HB2      MET  81  69.009   1.461  -0.183
  572   2HB   MET  81           HB1      MET  81  67.541   0.703  -0.802
  573   1HG   MET  81           HG2      MET  81  68.659   0.061  -2.848
  574   2HG   MET  81           HG1      MET  81  70.100   0.972  -2.397
  575   1HE   MET  81           HE2      MET  81  71.422   0.683  -0.482
  576   2HE   MET  81           HE1      MET  81  70.401   0.172   0.859
  577   3HE   MET  81           HE3      MET  81  71.771  -0.827   0.354
  578    H    MET  82           HN       MET  82  65.522   2.368  -1.549
  579    HA   MET  82           HA       MET  82  64.870   0.967  -3.936
  580   1HB   MET  82           HB2      MET  82  63.363   2.617  -1.955
  581   2HB   MET  82           HB1      MET  82  62.579   2.277  -3.499
  582   1HG   MET  82           HG2      MET  82  62.104   0.563  -1.717
  583   2HG   MET  82           HG1      MET  82  62.831  -0.106  -3.176
  584   1HE   MET  82           HE3      MET  82  64.008  -1.749  -3.056
  585   2HE   MET  82           HE2      MET  82  65.626  -1.058  -3.153
  586   3HE   MET  82           HE1      MET  82  65.262  -2.264  -1.920
  587    H    VAL  83           HN       VAL  83  63.808   4.324  -3.412
  588    HA   VAL  83           HA       VAL  83  63.530   4.969  -6.136
  589    HB   VAL  83           HB       VAL  83  64.285   6.813  -3.849
  590   1HG1  VAL  83          HG13      VAL  83  63.266   7.313  -6.652
  591   2HG1  VAL  83          HG12      VAL  83  63.102   8.505  -5.361
  592   3HG1  VAL  83          HG11      VAL  83  64.704   7.985  -5.884
  593   1HG2  VAL  83          HG22      VAL  83  61.756   5.553  -4.792
  594   2HG2  VAL  83          HG21      VAL  83  62.230   6.039  -3.165
  595   3HG2  VAL  83          HG23      VAL  83  61.663   7.249  -4.316
  596    H    ARG  84           HN       ARG  84  66.426   4.565  -4.306
  597    HA   ARG  84           HA       ARG  84  68.263   6.268  -5.497
  598   1HB   ARG  84           HB2      ARG  84  68.720   4.520  -3.729
  599   2HB   ARG  84           HB1      ARG  84  68.752   3.318  -5.019
  600   1HG   ARG  84           HG2      ARG  84  70.945   3.825  -5.204
  601   2HG   ARG  84           HG1      ARG  84  70.391   5.294  -6.006
  602   1HD   ARG  84           HD2      ARG  84  70.127   5.942  -3.338
  603   2HD   ARG  84           HD1      ARG  84  71.592   4.959  -3.347
  604    HE   ARG  84           HE       ARG  84  71.592   7.612  -4.135
  605   1HH1  ARG  84          HH11      ARG  84  73.743   5.325  -4.482
  606   2HH1  ARG  84          HH12      ARG  84  74.193   5.617  -6.129
  607   1HH2  ARG  84          HH21      ARG  84  71.481   7.677  -6.781
  608   2HH2  ARG  84          HH22      ARG  84  72.912   6.948  -7.431
  609    H    GLN  85           HN       GLN  85  67.735   2.924  -6.681
  610    HA   GLN  85           HA       GLN  85  68.532   3.882  -9.386
  611   1HB   GLN  85           HB2      GLN  85  68.753   1.320  -7.916
  612   2HB   GLN  85           HB1      GLN  85  68.362   1.177  -9.631
  613   1HG   GLN  85           HG2      GLN  85  70.637   2.887  -8.596
  614   2HG   GLN  85           HG1      GLN  85  70.846   1.209  -9.098
  615   1HE2  GLN  85          HE22      GLN  85  70.849   4.040 -11.908
  616   2HE2  GLN  85          HE21      GLN  85  71.061   4.348 -10.253
  617    H    MET  86           HN       MET  86  65.752   3.316  -7.631
  618    HA   MET  86           HA       MET  86  64.136   1.924  -9.566
  619   1HB   MET  86           HB2      MET  86  63.718   3.343  -7.035
  620   2HB   MET  86           HB1      MET  86  62.383   3.552  -8.167
  621   1HG   MET  86           HG2      MET  86  62.759   0.918  -8.486
  622   2HG   MET  86           HG1      MET  86  63.370   1.071  -6.839
  623   1HE   MET  86           HE1      MET  86  62.262   2.922  -5.392
  624   2HE   MET  86           HE3      MET  86  61.163   3.911  -6.364
  625   3HE   MET  86           HE2      MET  86  60.536   2.932  -5.041
  626    H    LYS  87           HN       LYS  87  65.053   5.287  -9.134
  627    HA   LYS  87           HA       LYS  87  63.091   6.504 -10.790
  628   1HB   LYS  87           HB2      LYS  87  65.451   7.311  -9.458
  629   2HB   LYS  87           HB1      LYS  87  65.665   7.760 -11.152
  630   1HG   LYS  87           HG2      LYS  87  63.626   9.023 -11.165
  631   2HG   LYS  87           HG1      LYS  87  63.149   8.386  -9.591
  632   1HD   LYS  87           HD2      LYS  87  65.207   9.472  -8.618
  633   2HD   LYS  87           HD1      LYS  87  65.460  10.253 -10.180
  634   1HE   LYS  87           HE2      LYS  87  63.551  11.580  -9.977
  635   2HE   LYS  87           HE1      LYS  87  62.786  10.479  -8.833
  636   1HZ   LYS  87           HZ3      LYS  87  65.109  11.266  -7.614
  637   2HZ   LYS  87           HZ2      LYS  87  64.514  12.685  -8.331
  638   3HZ   LYS  87           HZ1      LYS  87  63.545  11.808  -7.247
  639    H    GLU  88           HN       GLU  88  66.319   5.216 -11.636
  640    HA   GLU  88           HA       GLU  88  67.048   4.315 -13.689
  641   1HB   GLU  88           HB2      GLU  88  64.594   3.486 -13.753
  642   2HB   GLU  88           HB1      GLU  88  64.307   4.855 -14.827
  643   1HG   GLU  88           HG2      GLU  88  64.831   3.106 -16.315
  644   2HG   GLU  88           HG1      GLU  88  66.362   3.968 -16.148
  645    H    ASP  89           HN       ASP  89  68.413   5.651 -14.766
  646    HA   ASP  89           HA       ASP  89  67.317   8.234 -15.797
  647   1HB   ASP  89           HB2      ASP  89  70.208   7.502 -15.241
  648   2HB   ASP  89           HB1      ASP  89  69.594   9.095 -15.686
  649    H    ALA  90           HN       ALA  90  67.852   5.236 -16.891
  650    HA   ALA  90           HA       ALA  90  68.328   4.326 -19.001
  651   1HB   ALA  90           HB2      ALA  90  66.580   5.947 -19.678
  652   2HB   ALA  90           HB1      ALA  90  67.818   7.186 -19.877
  653   3HB   ALA  90           HB3      ALA  90  67.812   5.770 -20.928
   
  No H/Q in entry =         653
  Start of MODEL   28
    1   1H    ALA   1           HT1      ALA   1  65.145  14.476  15.405
    2   2H    ALA   1           HT3      ALA   1  65.223  13.385  16.702
    3   3H    ALA   1           HT2      ALA   1  66.375  14.626  16.568
    4    HA   ALA   1           HA       ALA   1  67.513  12.761  15.819
    5   1HB   ALA   1           HB3      ALA   1  65.235  11.501  15.631
    6   2HB   ALA   1           HB2      ALA   1  65.260  12.044  13.953
    7   3HB   ALA   1           HB1      ALA   1  66.556  11.017  14.567
    8    H    SER   2           HN       SER   2  68.384  12.336  13.491
    9    HA   SER   2           HA       SER   2  68.162  14.901  11.971
   10   1HB   SER   2           HB2      SER   2  70.415  14.009  13.043
   11   2HB   SER   2           HB1      SER   2  70.447  12.995  11.603
   12    HG   SER   2           HG       SER   2  70.925  15.655  11.878
   13    H    MET   3           HN       MET   3  68.942  14.402   9.539
   14    HA   MET   3           HA       MET   3  68.331  11.870   8.379
   15   1HB   MET   3           HB2      MET   3  66.117  12.336   7.415
   16   2HB   MET   3           HB1      MET   3  66.039  12.382   9.176
   17   1HG   MET   3           HG2      MET   3  66.738  14.996   8.338
   18   2HG   MET   3           HG1      MET   3  65.415  14.473   7.295
   19   1HE   MET   3           HE3      MET   3  66.548  16.125   9.864
   20   2HE   MET   3           HE2      MET   3  65.013  16.830  10.368
   21   3HE   MET   3           HE1      MET   3  65.833  15.677  11.419
   22    H    THR   4           HN       THR   4  69.346  11.953   6.432
   23    HA   THR   4           HA       THR   4  70.363  14.420   5.366
   24    HB   THR   4           HB       THR   4  71.058  13.038   3.432
   25    HG1  THR   4           HG1      THR   4  70.458  10.662   3.997
   26   1HG2  THR   4          HG21      THR   4  71.488  12.120   6.248
   27   2HG2  THR   4          HG23      THR   4  72.146  11.147   4.934
   28   3HG2  THR   4          HG22      THR   4  72.637  12.831   5.115
   29    H    ASP   5           HN       ASP   5  69.780  15.398   3.294
   30    HA   ASP   5           HA       ASP   5  66.955  15.774   2.978
   31   1HB   ASP   5           HB2      ASP   5  68.959  16.350   0.800
   32   2HB   ASP   5           HB1      ASP   5  67.506  17.253   1.227
   33    H    GLN   6           HN       GLN   6  69.058  13.316   1.863
   34    HA   GLN   6           HA       GLN   6  67.767  12.632  -0.604
   35   1HB   GLN   6           HB2      GLN   6  69.476  11.129   1.366
   36   2HB   GLN   6           HB1      GLN   6  68.722  10.280   0.018
   37   1HG   GLN   6           HG2      GLN   6  69.791  11.788  -1.579
   38   2HG   GLN   6           HG1      GLN   6  70.481  12.735  -0.259
   39   1HE2  GLN   6          HE22      GLN   6  71.960   8.951  -0.092
   40   2HE2  GLN   6          HE21      GLN   6  70.303   9.253   0.119
   41    H    GLN   7           HN       GLN   7  66.916  12.107   2.734
   42    HA   GLN   7           HA       GLN   7  65.042   9.943   2.227
   43   1HB   GLN   7           HB2      GLN   7  64.901  11.830   4.576
   44   2HB   GLN   7           HB1      GLN   7  64.468  10.121   4.512
   45   1HG   GLN   7           HG2      GLN   7  67.252  11.308   4.395
   46   2HG   GLN   7           HG1      GLN   7  66.580  10.284   5.665
   47   1HE2  GLN   7          HE22      GLN   7  67.208   7.266   3.930
   48   2HE2  GLN   7          HE21      GLN   7  66.540   7.996   5.310
   49    H    ALA   8           HN       ALA   8  64.916  13.436   2.133
   50    HA   ALA   8           HA       ALA   8  62.034  13.665   2.247
   51   1HB   ALA   8           HB1      ALA   8  64.250  15.490   1.314
   52   2HB   ALA   8           HB3      ALA   8  62.555  15.937   1.131
   53   3HB   ALA   8           HB2      ALA   8  63.223  15.652   2.738
   54    H    GLU   9           HN       GLU   9  64.367  13.114  -0.333
   55    HA   GLU   9           HA       GLU   9  62.329  13.483  -2.424
   56   1HB   GLU   9           HB2      GLU   9  65.182  12.461  -2.575
   57   2HB   GLU   9           HB1      GLU   9  64.155  12.815  -3.964
   58   1HG   GLU   9           HG2      GLU   9  64.010  15.113  -2.361
   59   2HG   GLU   9           HG1      GLU   9  65.710  14.641  -2.325
   60    H    ALA  10           HN       ALA  10  63.911  10.842  -0.705
   61    HA   ALA  10           HA       ALA  10  62.961   8.738  -2.433
   62   1HB   ALA  10           HB3      ALA  10  64.059   8.865   0.361
   63   2HB   ALA  10           HB2      ALA  10  63.337   7.366  -0.223
   64   3HB   ALA  10           HB1      ALA  10  64.726   8.059  -1.059
   65    H    ARG  11           HN       ARG  11  61.825   9.791   0.802
   66    HA   ARG  11           HA       ARG  11  59.442   8.175   0.688
   67   1HB   ARG  11           HB2      ARG  11  60.483  10.354   2.446
   68   2HB   ARG  11           HB1      ARG  11  58.754  10.008   2.508
   69   1HG   ARG  11           HG2      ARG  11  59.280   7.604   2.897
   70   2HG   ARG  11           HG1      ARG  11  60.996   8.012   2.933
   71   1HD   ARG  11           HD2      ARG  11  60.819   9.166   4.949
   72   2HD   ARG  11           HD1      ARG  11  59.102   9.497   4.724
   73    HE   ARG  11           HE       ARG  11  59.343   6.700   4.955
   74   1HH1  ARG  11          HH21      ARG  11  58.053   8.991   6.751
   75   2HH1  ARG  11          HH22      ARG  11  58.645   8.479   8.296
   76   1HH2  ARG  11          HH11      ARG  11  60.956   6.257   6.970
   77   2HH2  ARG  11          HH12      ARG  11  60.287   6.930   8.420
   78    H    ALA  12           HN       ALA  12  60.107  11.585  -0.078
   79    HA   ALA  12           HA       ALA  12  57.411  12.384  -0.522
   80   1HB   ALA  12           HB2      ALA  12  59.947  13.356  -1.873
   81   2HB   ALA  12           HB1      ALA  12  58.391  14.185  -1.924
   82   3HB   ALA  12           HB3      ALA  12  59.245  14.007  -0.393
   83    H    PHE  13           HN       PHE  13  59.682  10.623  -2.557
   84    HA   PHE  13           HA       PHE  13  57.886  10.799  -4.889
   85   1HB   PHE  13           HB2      PHE  13  60.292  10.836  -5.299
   86   2HB   PHE  13           HB1      PHE  13  60.486   9.301  -4.452
   87    HD1  PHE  13           HD1      PHE  13  58.909  10.911  -7.417
   88    HD2  PHE  13           HD2      PHE  13  60.074   7.226  -5.543
   89    HE1  PHE  13           HE1      PHE  13  58.415   9.687  -9.516
   90    HE2  PHE  13           HE2      PHE  13  59.582   6.001  -7.641
   91    HZ   PHE  13           HZ       PHE  13  58.751   7.233  -9.628
   92    H    LEU  14           HN       LEU  14  58.612   8.602  -2.274
   93    HA   LEU  14           HA       LEU  14  57.110   6.409  -3.584
   94   1HB   LEU  14           HB2      LEU  14  58.484   6.517  -0.881
   95   2HB   LEU  14           HB1      LEU  14  57.792   5.077  -1.630
   96    HG   LEU  14           HG       LEU  14  60.014   6.746  -2.843
   97   1HD1  LEU  14          HD13      LEU  14  60.116   4.861  -0.728
   98   2HD1  LEU  14          HD12      LEU  14  60.740   4.042  -2.160
   99   3HD1  LEU  14          HD11      LEU  14  61.473   5.552  -1.616
  100   1HD2  LEU  14          HD21      LEU  14  58.213   4.936  -4.006
  101   2HD2  LEU  14          HD23      LEU  14  59.728   5.500  -4.706
  102   3HD2  LEU  14          HD22      LEU  14  59.693   4.007  -3.769
  103    H    SER  15           HN       SER  15  55.190   5.530  -2.628
  104    HA   SER  15           HA       SER  15  53.723   7.501  -0.939
  105   1HB   SER  15           HB2      SER  15  52.401   7.079  -2.826
  106   2HB   SER  15           HB1      SER  15  52.873   5.385  -2.899
  107    HG   SER  15           HG       SER  15  51.069   5.082  -1.860
  108    H    GLU  16           HN       GLU  16  52.390   6.630   0.829
  109    HA   GLU  16           HA       GLU  16  53.810   4.847   2.526
  110   1HB   GLU  16           HB2      GLU  16  51.413   6.399   2.654
  111   2HB   GLU  16           HB1      GLU  16  51.037   4.767   3.205
  112   1HG   GLU  16           HG2      GLU  16  53.505   5.313   4.377
  113   2HG   GLU  16           HG1      GLU  16  52.625   6.836   4.512
  114    H    GLU  17           HN       GLU  17  51.772   4.191  -0.155
  115    HA   GLU  17           HA       GLU  17  50.771   1.620   0.681
  116   1HB   GLU  17           HB2      GLU  17  51.265   2.696  -2.112
  117   2HB   GLU  17           HB1      GLU  17  50.297   1.274  -1.718
  118   1HG   GLU  17           HG2      GLU  17  48.780   2.679  -0.367
  119   2HG   GLU  17           HG1      GLU  17  49.744   4.102  -0.768
  120    H    MET  18           HN       MET  18  53.180   2.203  -1.903
  121    HA   MET  18           HA       MET  18  54.282  -0.446  -1.654
  122   1HB   MET  18           HB2      MET  18  55.669   1.962  -2.858
  123   2HB   MET  18           HB1      MET  18  55.912   0.263  -3.265
  124   1HG   MET  18           HG2      MET  18  54.142   0.241  -4.675
  125   2HG   MET  18           HG1      MET  18  53.116   1.094  -3.522
  126   1HE   MET  18           HE3      MET  18  56.294   1.370  -5.303
  127   2HE   MET  18           HE2      MET  18  55.501   1.748  -6.831
  128   3HE   MET  18           HE1      MET  18  56.409   2.998  -5.987
  129    H    ILE  19           HN       ILE  19  54.777   2.457   0.121
  130    HA   ILE  19           HA       ILE  19  57.495   1.886   0.975
  131    HB   ILE  19           HB       ILE  19  55.331   3.749   1.970
  132   1HG1  ILE  19          HG12      ILE  19  58.057   4.160   0.698
  133   2HG1  ILE  19          HG11      ILE  19  56.504   4.356  -0.109
  134   1HG2  ILE  19          HG23      ILE  19  57.635   2.731   3.417
  135   2HG2  ILE  19          HG22      ILE  19  57.778   4.469   3.154
  136   3HG2  ILE  19          HG21      ILE  19  56.362   3.817   3.976
  137   1HD1  ILE  19          HD13      ILE  19  55.953   6.058   1.742
  138   2HD1  ILE  19          HD12      ILE  19  57.677   6.026   2.114
  139   3HD1  ILE  19          HD11      ILE  19  57.127   6.554   0.524
  140    H    ALA  20           HN       ALA  20  54.256   1.190   2.228
  141    HA   ALA  20           HA       ALA  20  55.138   0.163   4.770
  142   1HB   ALA  20           HB2      ALA  20  52.618  -0.159   3.142
  143   2HB   ALA  20           HB1      ALA  20  52.850  -1.041   4.651
  144   3HB   ALA  20           HB3      ALA  20  52.844   0.722   4.654
  145    H    GLU  21           HN       GLU  21  54.683  -1.288   1.579
  146    HA   GLU  21           HA       GLU  21  54.863  -4.024   2.343
  147   1HB   GLU  21           HB2      GLU  21  55.867  -2.713  -0.203
  148   2HB   GLU  21           HB1      GLU  21  55.551  -4.434   0.014
  149   1HG   GLU  21           HG2      GLU  21  53.166  -3.634   0.749
  150   2HG   GLU  21           HG1      GLU  21  53.593  -2.156  -0.115
  151    H    PHE  22           HN       PHE  22  57.412  -1.664   1.551
  152    HA   PHE  22           HA       PHE  22  59.618  -3.452   1.662
  153   1HB   PHE  22           HB2      PHE  22  59.368  -0.502   2.283
  154   2HB   PHE  22           HB1      PHE  22  60.914  -1.350   2.339
  155    HD1  PHE  22           HD1      PHE  22  61.429  -2.863   0.213
  156    HD2  PHE  22           HD2      PHE  22  58.699   0.452   0.264
  157    HE1  PHE  22           HE1      PHE  22  61.632  -2.660  -2.251
  158    HE2  PHE  22           HE2      PHE  22  58.901   0.656  -2.199
  159    HZ   PHE  22           HZ       PHE  22  60.367  -0.899  -3.456
  160    H    LYS  23           HN       LYS  23  57.741  -1.945   4.227
  161    HA   LYS  23           HA       LYS  23  59.600  -2.413   6.365
  162   1HB   LYS  23           HB2      LYS  23  57.142  -1.182   6.143
  163   2HB   LYS  23           HB1      LYS  23  56.757  -2.622   7.085
  164   1HG   LYS  23           HG2      LYS  23  58.877  -0.552   7.728
  165   2HG   LYS  23           HG1      LYS  23  57.382  -0.843   8.617
  166   1HD   LYS  23           HD2      LYS  23  58.332  -3.308   8.779
  167   2HD   LYS  23           HD1      LYS  23  59.877  -2.499   8.513
  168   1HE   LYS  23           HE2      LYS  23  59.861  -2.162  10.758
  169   2HE   LYS  23           HE1      LYS  23  58.711  -0.874  10.397
  170   1HZ   LYS  23           HZ2      LYS  23  57.832  -3.667  10.801
  171   2HZ   LYS  23           HZ1      LYS  23  58.031  -2.600  12.108
  172   3HZ   LYS  23           HZ3      LYS  23  56.909  -2.244  10.888
  173    H    ALA  24           HN       ALA  24  57.257  -4.458   4.740
  174    HA   ALA  24           HA       ALA  24  57.143  -6.528   6.728
  175   1HB   ALA  24           HB1      ALA  24  55.740  -6.084   4.496
  176   2HB   ALA  24           HB3      ALA  24  56.913  -7.221   3.833
  177   3HB   ALA  24           HB2      ALA  24  55.889  -7.699   5.187
  178    H    ALA  25           HN       ALA  25  59.028  -6.336   3.683
  179    HA   ALA  25           HA       ALA  25  60.555  -8.706   4.227
  180   1HB   ALA  25           HB2      ALA  25  60.260  -7.501   1.982
  181   2HB   ALA  25           HB1      ALA  25  61.500  -6.380   2.543
  182   3HB   ALA  25           HB3      ALA  25  61.881  -8.090   2.348
  183    H    PHE  26           HN       PHE  26  60.880  -5.383   5.259
  184    HA   PHE  26           HA       PHE  26  63.590  -5.176   5.877
  185   1HB   PHE  26           HB2      PHE  26  61.749  -3.455   6.286
  186   2HB   PHE  26           HB1      PHE  26  61.411  -4.314   7.790
  187    HD1  PHE  26           HD1      PHE  26  64.024  -2.466   5.904
  188    HD2  PHE  26           HD2      PHE  26  62.842  -4.108   9.692
  189    HE1  PHE  26           HE1      PHE  26  65.906  -1.281   7.003
  190    HE2  PHE  26           HE2      PHE  26  64.723  -2.922  10.794
  191    HZ   PHE  26           HZ       PHE  26  66.254  -1.509   9.449
  192    H    ASP  27           HN       ASP  27  61.197  -6.140   8.361
  193    HA   ASP  27           HA       ASP  27  63.072  -7.214  10.173
  194   1HB   ASP  27           HB2      ASP  27  60.168  -7.902   9.675
  195   2HB   ASP  27           HB1      ASP  27  61.096  -8.602  11.000
  196    H    MET  28           HN       MET  28  61.975  -8.499   7.162
  197    HA   MET  28           HA       MET  28  62.341 -11.288   7.650
  198   1HB   MET  28           HB2      MET  28  61.630  -9.724   5.468
  199   2HB   MET  28           HB1      MET  28  63.172 -10.429   4.980
  200   1HG   MET  28           HG2      MET  28  61.697 -12.489   6.260
  201   2HG   MET  28           HG1      MET  28  60.597 -11.697   5.133
  202   1HE   MET  28           HE2      MET  28  64.026 -12.830   5.793
  203   2HE   MET  28           HE1      MET  28  64.613 -13.667   4.361
  204   3HE   MET  28           HE3      MET  28  64.661 -11.901   4.437
  205    H    PHE  29           HN       PHE  29  64.633  -8.753   6.661
  206    HA   PHE  29           HA       PHE  29  66.835 -10.736   6.662
  207   1HB   PHE  29           HB2      PHE  29  67.675  -7.963   6.363
  208   2HB   PHE  29           HB1      PHE  29  67.894  -9.318   5.259
  209    HD1  PHE  29           HD1      PHE  29  65.692 -10.086   3.985
  210    HD2  PHE  29           HD2      PHE  29  66.301  -6.199   5.708
  211    HE1  PHE  29           HE1      PHE  29  63.940  -9.152   2.499
  212    HE2  PHE  29           HE2      PHE  29  64.549  -5.265   4.222
  213    HZ   PHE  29           HZ       PHE  29  63.368  -6.742   2.617
  214    H    ASP  30           HN       ASP  30  65.247  -8.933   8.947
  215    HA   ASP  30           HA       ASP  30  67.726  -8.472  10.545
  216   1HB   ASP  30           HB2      ASP  30  65.780  -6.692  10.083
  217   2HB   ASP  30           HB1      ASP  30  65.063  -7.499  11.478
  218    H    ALA  31           HN       ALA  31  67.582 -10.969  10.748
  219    HA   ALA  31           HA       ALA  31  65.519 -12.208  12.275
  220   1HB   ALA  31           HB2      ALA  31  67.551 -13.242  10.964
  221   2HB   ALA  31           HB1      ALA  31  68.383 -13.086  12.511
  222   3HB   ALA  31           HB3      ALA  31  66.925 -14.071  12.388
  223    H    ASP  32           HN       ASP  32  68.229 -10.210  13.208
  224    HA   ASP  32           HA       ASP  32  68.052 -10.952  16.040
  225   1HB   ASP  32           HB2      ASP  32  70.140 -10.086  14.733
  226   2HB   ASP  32           HB1      ASP  32  69.438  -8.489  15.002
  227    H    GLY  33           HN       GLY  33  67.053  -8.226  13.986
  228   1HA   GLY  33           HA2      GLY  33  65.086  -6.907  14.387
  229   2HA   GLY  33           HA1      GLY  33  65.053  -7.505  16.046
  230    H    GLY  34           HN       GLY  34  67.740  -6.004  14.249
  231   1HA   GLY  34           HA2      GLY  34  68.110  -4.136  16.515
  232   2HA   GLY  34           HA1      GLY  34  69.249  -4.389  15.191
  233    H    GLY  35           HN       GLY  35  66.156  -4.113  13.931
  234   1HA   GLY  35           HA2      GLY  35  65.022  -2.371  12.837
  235   2HA   GLY  35           HA1      GLY  35  65.822  -1.251  13.943
  236    H    ASP  36           HN       ASP  36  67.965  -3.316  12.263
  237    HA   ASP  36           HA       ASP  36  68.281  -1.654   9.892
  238   1HB   ASP  36           HB2      ASP  36  70.548  -0.825  10.482
  239   2HB   ASP  36           HB1      ASP  36  69.310  -0.168  11.554
  240    H    ILE  37           HN       ILE  37  69.272  -2.884   8.334
  241    HA   ILE  37           HA       ILE  37  70.584  -5.403   9.258
  242    HB   ILE  37           HB       ILE  37  69.823  -6.467   7.304
  243   1HG1  ILE  37          HG12      ILE  37  69.303  -3.714   6.128
  244   2HG1  ILE  37          HG11      ILE  37  70.658  -4.763   5.712
  245   1HG2  ILE  37          HG23      ILE  37  67.973  -4.915   8.804
  246   2HG2  ILE  37          HG22      ILE  37  67.462  -4.849   7.116
  247   3HG2  ILE  37          HG21      ILE  37  67.665  -6.408   7.917
  248   1HD1  ILE  37          HD11      ILE  37  68.171  -6.223   5.507
  249   2HD1  ILE  37          HD13      ILE  37  68.095  -4.752   4.535
  250   3HD1  ILE  37          HD12      ILE  37  69.385  -5.924   4.263
  251    H    SER  38           HN       SER  38  72.730  -5.687   8.781
  252    HA   SER  38           HA       SER  38  74.447  -3.655   7.993
  253   1HB   SER  38           HB2      SER  38  75.851  -5.674   6.998
  254   2HB   SER  38           HB1      SER  38  75.592  -5.536   8.735
  255    HG   SER  38           HG       SER  38  74.375  -7.253   8.671
  256    H    THR  39           HN       THR  39  75.398  -3.051   5.942
  257    HA   THR  39           HA       THR  39  73.528  -2.990   3.768
  258    HB   THR  39           HB       THR  39  75.247  -1.863   2.522
  259    HG1  THR  39           HG1      THR  39  77.383  -1.851   3.826
  260   1HG2  THR  39          HG21      THR  39  75.058  -1.283   5.453
  261   2HG2  THR  39          HG23      THR  39  76.217  -0.371   4.486
  262   3HG2  THR  39          HG22      THR  39  74.501  -0.323   4.083
  263    H    LYS  40           HN       LYS  40  75.564  -5.470   4.824
  264    HA   LYS  40           HA       LYS  40  76.219  -6.586   2.214
  265   1HB   LYS  40           HB2      LYS  40  77.070  -8.484   3.437
  266   2HB   LYS  40           HB1      LYS  40  77.527  -7.032   4.326
  267   1HG   LYS  40           HG2      LYS  40  75.656  -7.339   5.865
  268   2HG   LYS  40           HG1      LYS  40  75.092  -8.732   4.942
  269   1HD   LYS  40           HD2      LYS  40  77.132  -9.959   5.460
  270   2HD   LYS  40           HD1      LYS  40  77.800  -8.553   6.289
  271   1HE   LYS  40           HE2      LYS  40  76.927  -9.577   8.138
  272   2HE   LYS  40           HE1      LYS  40  75.441  -8.790   7.604
  273   1HZ   LYS  40           HZ1      LYS  40  75.923 -11.277   6.268
  274   2HZ   LYS  40           HZ3      LYS  40  75.793 -11.465   7.950
  275   3HZ   LYS  40           HZ2      LYS  40  74.532 -10.733   7.077
  276    H    ALA  41           HN       ALA  41  73.698  -7.166   4.657
  277    HA   ALA  41           HA       ALA  41  72.534  -9.416   3.261
  278   1HB   ALA  41           HB2      ALA  41  72.117  -8.073   5.721
  279   2HB   ALA  41           HB1      ALA  41  70.589  -7.992   4.843
  280   3HB   ALA  41           HB3      ALA  41  71.340  -9.556   5.163
  281    H    LEU  42           HN       LEU  42  72.612  -6.129   2.541
  282    HA   LEU  42           HA       LEU  42  69.978  -5.686   1.519
  283   1HB   LEU  42           HB2      LEU  42  72.675  -4.481   0.889
  284   2HB   LEU  42           HB1      LEU  42  71.218  -3.978   0.031
  285    HG   LEU  42           HG       LEU  42  71.786  -2.564   2.050
  286   1HD1  LEU  42          HD11      LEU  42  69.311  -3.553   1.150
  287   2HD1  LEU  42          HD13      LEU  42  69.235  -3.628   2.912
  288   3HD1  LEU  42          HD12      LEU  42  69.587  -2.098   2.108
  289   1HD2  LEU  42          HD22      LEU  42  72.565  -4.526   3.427
  290   2HD2  LEU  42          HD21      LEU  42  71.412  -3.484   4.257
  291   3HD2  LEU  42          HD23      LEU  42  70.880  -5.022   3.576
  292    H    GLY  43           HN       GLY  43  72.859  -7.182   0.127
  293   1HA   GLY  43           HA2      GLY  43  71.923  -7.312  -2.579
  294   2HA   GLY  43           HA1      GLY  43  73.153  -8.363  -1.879
  295    H    THR  44           HN       THR  44  71.283  -9.283   0.254
  296    HA   THR  44           HA       THR  44  70.128 -11.501  -1.225
  297    HB   THR  44           HB       THR  44  69.852 -10.665   1.678
  298    HG1  THR  44           HG1      THR  44  71.705 -11.599   1.836
  299   1HG2  THR  44          HG21      THR  44  68.690 -12.896   0.082
  300   2HG2  THR  44          HG23      THR  44  69.294 -13.288   1.692
  301   3HG2  THR  44          HG22      THR  44  68.038 -12.065   1.495
  302    H    VAL  45           HN       VAL  45  68.830  -8.634   0.431
  303    HA   VAL  45           HA       VAL  45  66.065  -9.295  -0.035
  304    HB   VAL  45           HB       VAL  45  67.249  -6.529   0.311
  305   1HG1  VAL  45          HG12      VAL  45  64.547  -7.724   0.998
  306   2HG1  VAL  45          HG11      VAL  45  65.047  -6.067   1.337
  307   3HG1  VAL  45          HG13      VAL  45  64.873  -6.613  -0.332
  308   1HG2  VAL  45          HG22      VAL  45  66.887  -8.801   2.213
  309   2HG2  VAL  45          HG21      VAL  45  68.102  -7.521   2.210
  310   3HG2  VAL  45          HG23      VAL  45  66.470  -7.188   2.792
  311    H    MET  46           HN       MET  46  68.533  -7.661  -1.926
  312    HA   MET  46           HA       MET  46  66.969  -6.289  -3.806
  313   1HB   MET  46           HB2      MET  46  69.659  -7.521  -3.790
  314   2HB   MET  46           HB1      MET  46  68.953  -7.286  -5.389
  315   1HG   MET  46           HG2      MET  46  68.923  -5.073  -3.340
  316   2HG   MET  46           HG1      MET  46  70.323  -5.331  -4.382
  317   1HE   MET  46           HE2      MET  46  69.484  -2.896  -4.335
  318   2HE   MET  46           HE1      MET  46  70.016  -2.860  -6.013
  319   3HE   MET  46           HE3      MET  46  68.434  -2.206  -5.569
  320    H    ARG  47           HN       ARG  47  68.082  -9.693  -4.044
  321    HA   ARG  47           HA       ARG  47  66.320 -10.151  -6.337
  322   1HB   ARG  47           HB2      ARG  47  67.269 -12.329  -6.428
  323   2HB   ARG  47           HB1      ARG  47  68.589 -11.276  -5.923
  324   1HG   ARG  47           HG2      ARG  47  68.827 -12.883  -4.302
  325   2HG   ARG  47           HG1      ARG  47  67.600 -11.903  -3.499
  326   1HD   ARG  47           HD2      ARG  47  65.976 -13.475  -3.787
  327   2HD   ARG  47           HD1      ARG  47  66.541 -13.901  -5.402
  328    HE   ARG  47           HE       ARG  47  68.346 -14.814  -3.308
  329   1HH1  ARG  47          HH21      ARG  47  65.287 -15.405  -4.768
  330   2HH1  ARG  47          HH22      ARG  47  65.434 -17.129  -4.696
  331   1HH2  ARG  47          HH11      ARG  47  68.627 -17.070  -3.347
  332   2HH2  ARG  47          HH12      ARG  47  67.323 -18.072  -3.890
  333    H    MET  48           HN       MET  48  66.026 -10.350  -2.906
  334    HA   MET  48           HA       MET  48  64.065 -12.443  -2.770
  335   1HB   MET  48           HB2      MET  48  63.993 -11.976  -0.531
  336   2HB   MET  48           HB1      MET  48  65.442 -11.048  -0.898
  337   1HG   MET  48           HG2      MET  48  64.221  -9.424   0.204
  338   2HG   MET  48           HG1      MET  48  63.644  -9.147  -1.440
  339   1HE   MET  48           HE1      MET  48  63.431 -11.210   1.563
  340   2HE   MET  48           HE3      MET  48  61.725 -11.353   2.013
  341   3HE   MET  48           HE2      MET  48  62.414 -12.433   0.804
  342    H    LEU  49           HN       LEU  49  63.873  -9.025  -3.548
  343    HA   LEU  49           HA       LEU  49  60.918  -9.089  -3.494
  344   1HB   LEU  49           HB2      LEU  49  62.652  -6.826  -4.497
  345   2HB   LEU  49           HB1      LEU  49  61.004  -6.741  -3.877
  346    HG   LEU  49           HG       LEU  49  63.463  -7.476  -2.262
  347   1HD1  LEU  49          HD13      LEU  49  61.691  -5.011  -2.234
  348   2HD1  LEU  49          HD12      LEU  49  63.021  -5.326  -1.117
  349   3HD1  LEU  49          HD11      LEU  49  63.348  -5.082  -2.834
  350   1HD2  LEU  49          HD22      LEU  49  61.122  -8.511  -1.712
  351   2HD2  LEU  49          HD21      LEU  49  62.045  -7.763  -0.410
  352   3HD2  LEU  49          HD23      LEU  49  60.719  -6.882  -1.168
  353    H    GLY  50           HN       GLY  50  63.534  -9.469  -5.737
  354   1HA   GLY  50           HA2      GLY  50  62.651 -10.689  -7.836
  355   2HA   GLY  50           HA1      GLY  50  61.617  -9.270  -8.020
  356    H    GLN  51           HN       GLN  51  62.981  -7.118  -7.874
  357    HA   GLN  51           HA       GLN  51  64.631  -6.917 -10.125
  358   1HB   GLN  51           HB2      GLN  51  65.552  -4.829  -8.996
  359   2HB   GLN  51           HB1      GLN  51  63.793  -4.905  -9.119
  360   1HG   GLN  51           HG2      GLN  51  63.655  -5.739  -6.806
  361   2HG   GLN  51           HG1      GLN  51  65.413  -5.690  -6.678
  362   1HE2  GLN  51          HE22      GLN  51  65.290  -2.352  -5.592
  363   2HE2  GLN  51          HE21      GLN  51  65.992  -3.892  -5.454
  364    H    ASN  52           HN       ASN  52  66.715  -7.510 -10.548
  365    HA   ASN  52           HA       ASN  52  68.564  -7.953  -8.260
  366   1HB   ASN  52           HB2      ASN  52  67.582 -10.150  -8.802
  367   2HB   ASN  52           HB1      ASN  52  68.071  -9.954 -10.486
  368   1HD2  ASN  52          HD22      ASN  52  71.227 -10.170  -7.861
  369   2HD2  ASN  52          HD21      ASN  52  69.931  -9.126  -7.522
  370    HA   PRO  53           HA       PRO  53  70.695  -5.646 -11.544
  371   1HB   PRO  53           HB2      PRO  53  72.169  -4.139  -9.779
  372   2HB   PRO  53           HB1      PRO  53  70.533  -3.709 -10.304
  373   1HG   PRO  53           HG2      PRO  53  71.430  -4.835  -7.691
  374   2HG   PRO  53           HG1      PRO  53  70.016  -3.831  -8.054
  375   1HD   PRO  53           HD2      PRO  53  69.996  -6.630  -7.642
  376   2HD   PRO  53           HD1      PRO  53  68.674  -5.669  -8.338
  377    H    THR  54           HN       THR  54  73.333  -5.039 -11.286
  378    HA   THR  54           HA       THR  54  74.584  -7.693 -11.134
  379    HB   THR  54           HB       THR  54  76.622  -5.895 -11.599
  380    HG1  THR  54           HG1      THR  54  75.351  -4.623 -13.310
  381   1HG2  THR  54          HG21      THR  54  74.850  -7.638 -13.186
  382   2HG2  THR  54          HG23      THR  54  75.668  -6.381 -14.115
  383   3HG2  THR  54          HG22      THR  54  76.609  -7.536 -13.171
  384    H    LYS  55           HN       LYS  55  76.470  -8.122  -9.798
  385    HA   LYS  55           HA       LYS  55  76.204  -7.436  -7.082
  386   1HB   LYS  55           HB2      LYS  55  78.090  -8.880  -8.714
  387   2HB   LYS  55           HB1      LYS  55  78.962  -7.897  -7.538
  388   1HG   LYS  55           HG2      LYS  55  76.594  -9.296  -6.461
  389   2HG   LYS  55           HG1      LYS  55  77.901 -10.357  -6.990
  390   1HD   LYS  55           HD2      LYS  55  79.448  -9.402  -5.491
  391   2HD   LYS  55           HD1      LYS  55  78.472  -7.951  -5.266
  392   1HE   LYS  55           HE2      LYS  55  77.967  -9.079  -3.306
  393   2HE   LYS  55           HE1      LYS  55  76.693  -9.702  -4.354
  394   1HZ   LYS  55           HZ3      LYS  55  78.551 -11.446  -4.922
  395   2HZ   LYS  55           HZ2      LYS  55  79.115 -11.023  -3.377
  396   3HZ   LYS  55           HZ1      LYS  55  77.545 -11.642  -3.571
  397    H    GLU  56           HN       GLU  56  78.690  -6.165  -9.332
  398    HA   GLU  56           HA       GLU  56  79.775  -4.204  -7.653
  399   1HB   GLU  56           HB2      GLU  56  80.186  -4.916 -10.240
  400   2HB   GLU  56           HB1      GLU  56  79.356  -3.378 -10.473
  401   1HG   GLU  56           HG2      GLU  56  80.976  -2.348  -8.835
  402   2HG   GLU  56           HG1      GLU  56  81.870  -3.869  -8.856
  403    H    GLU  57           HN       GLU  57  77.039  -3.806  -9.926
  404    HA   GLU  57           HA       GLU  57  76.427  -1.126  -9.413
  405   1HB   GLU  57           HB2      GLU  57  75.208  -2.318 -11.112
  406   2HB   GLU  57           HB1      GLU  57  74.576  -3.467  -9.931
  407   1HG   GLU  57           HG2      GLU  57  72.834  -2.110  -9.510
  408   2HG   GLU  57           HG1      GLU  57  73.938  -0.810  -9.058
  409    H    LEU  58           HN       LEU  58  75.657  -3.976  -7.453
  410    HA   LEU  58           HA       LEU  58  73.925  -2.588  -5.612
  411   1HB   LEU  58           HB2      LEU  58  74.191  -5.136  -5.970
  412   2HB   LEU  58           HB1      LEU  58  75.586  -5.004  -4.897
  413    HG   LEU  58           HG       LEU  58  73.233  -3.597  -3.868
  414   1HD1  LEU  58          HD11      LEU  58  72.139  -5.502  -5.079
  415   2HD1  LEU  58          HD13      LEU  58  73.105  -6.617  -4.112
  416   3HD1  LEU  58          HD12      LEU  58  71.918  -5.569  -3.332
  417   1HD2  LEU  58          HD23      LEU  58  75.316  -5.545  -2.925
  418   2HD2  LEU  58          HD22      LEU  58  74.945  -3.931  -2.318
  419   3HD2  LEU  58          HD21      LEU  58  73.876  -5.284  -1.941
  420    H    ASP  59           HN       ASP  59  77.417  -3.195  -5.703
  421    HA   ASP  59           HA       ASP  59  78.048  -2.336  -3.069
  422   1HB   ASP  59           HB2      ASP  59  79.634  -2.104  -5.644
  423   2HB   ASP  59           HB1      ASP  59  80.299  -1.774  -4.044
  424    H    ALA  60           HN       ALA  60  77.834  -0.446  -6.099
  425    HA   ALA  60           HA       ALA  60  78.467   2.074  -4.880
  426   1HB   ALA  60           HB3      ALA  60  77.509   1.117  -7.473
  427   2HB   ALA  60           HB2      ALA  60  76.787   2.662  -7.020
  428   3HB   ALA  60           HB1      ALA  60  78.541   2.498  -7.101
  429    H    ILE  61           HN       ILE  61  75.616   0.123  -4.879
  430    HA   ILE  61           HA       ILE  61  73.763   2.299  -4.284
  431    HB   ILE  61           HB       ILE  61  73.572  -0.718  -4.134
  432   1HG1  ILE  61          HG12      ILE  61  72.070   1.291  -5.836
  433   2HG1  ILE  61          HG11      ILE  61  73.556   0.497  -6.362
  434   1HG2  ILE  61          HG23      ILE  61  71.995   1.234  -2.729
  435   2HG2  ILE  61          HG22      ILE  61  71.001   0.477  -3.975
  436   3HG2  ILE  61          HG21      ILE  61  71.803  -0.519  -2.761
  437   1HD1  ILE  61          HD13      ILE  61  71.847  -1.533  -5.348
  438   2HD1  ILE  61          HD12      ILE  61  70.871  -0.524  -6.415
  439   3HD1  ILE  61          HD11      ILE  61  72.344  -1.279  -7.020
  440    H    ILE  62           HN       ILE  62  75.531  -0.152  -2.416
  441    HA   ILE  62           HA       ILE  62  74.367   0.410   0.128
  442    HB   ILE  62           HB       ILE  62  77.076  -0.660  -0.695
  443   1HG1  ILE  62          HG12      ILE  62  74.684  -1.962   0.643
  444   2HG1  ILE  62          HG11      ILE  62  75.023  -2.041  -1.086
  445   1HG2  ILE  62          HG23      ILE  62  75.943  -0.124   2.052
  446   2HG2  ILE  62          HG22      ILE  62  77.144  -1.387   1.784
  447   3HG2  ILE  62          HG21      ILE  62  77.537   0.293   1.423
  448   1HD1  ILE  62          HD13      ILE  62  77.436  -2.782   0.048
  449   2HD1  ILE  62          HD12      ILE  62  76.252  -3.525   1.124
  450   3HD1  ILE  62          HD11      ILE  62  76.230  -3.894  -0.601
  451    H    GLU  63           HN       GLU  63  77.207   1.813  -1.511
  452    HA   GLU  63           HA       GLU  63  77.934   3.551   0.661
  453   1HB   GLU  63           HB2      GLU  63  79.085   2.862  -1.727
  454   2HB   GLU  63           HB1      GLU  63  78.532   4.503  -2.068
  455   1HG   GLU  63           HG2      GLU  63  80.363   5.242  -0.982
  456   2HG   GLU  63           HG1      GLU  63  79.623   4.650   0.506
  457    H    GLU  64           HN       GLU  64  75.925   4.035  -2.242
  458    HA   GLU  64           HA       GLU  64  75.414   6.820  -1.756
  459   1HB   GLU  64           HB2      GLU  64  74.732   4.908  -3.722
  460   2HB   GLU  64           HB1      GLU  64  73.207   5.534  -3.098
  461   1HG   GLU  64           HG2      GLU  64  75.037   7.721  -3.398
  462   2HG   GLU  64           HG1      GLU  64  75.002   6.804  -4.904
  463    H    VAL  65           HN       VAL  65  74.034   3.893  -0.436
  464    HA   VAL  65           HA       VAL  65  71.655   5.270   0.600
  465    HB   VAL  65           HB       VAL  65  72.744   2.521   1.278
  466   1HG1  VAL  65          HG13      VAL  65  70.394   4.101   2.100
  467   2HG1  VAL  65          HG12      VAL  65  70.014   2.468   1.552
  468   3HG1  VAL  65          HG11      VAL  65  71.145   2.712   2.883
  469   1HG2  VAL  65          HG21      VAL  65  71.983   3.270  -1.197
  470   2HG2  VAL  65          HG23      VAL  65  71.635   1.667  -0.549
  471   3HG2  VAL  65          HG22      VAL  65  70.394   2.921  -0.511
  472    H    ASP  66           HN       ASP  66  74.806   4.211   1.808
  473    HA   ASP  66           HA       ASP  66  74.148   4.998   4.560
  474   1HB   ASP  66           HB2      ASP  66  76.009   3.276   3.430
  475   2HB   ASP  66           HB1      ASP  66  76.988   4.651   3.942
  476    H    GLU  67           HN       GLU  67  73.564   7.249   3.629
  477    HA   GLU  67           HA       GLU  67  75.668   9.006   2.759
  478   1HB   GLU  67           HB2      GLU  67  72.840   9.204   3.418
  479   2HB   GLU  67           HB1      GLU  67  73.740  10.596   4.023
  480   1HG   GLU  67           HG2      GLU  67  74.497   9.758   1.299
  481   2HG   GLU  67           HG1      GLU  67  72.837  10.339   1.446
  482    H    ASP  68           HN       ASP  68  75.012   7.618   5.778
  483    HA   ASP  68           HA       ASP  68  76.368   9.840   7.231
  484   1HB   ASP  68           HB2      ASP  68  75.708   8.264   9.243
  485   2HB   ASP  68           HB1      ASP  68  74.490   9.297   8.495
  486    H    GLY  69           HN       GLY  69  76.466   6.261   7.046
  487   1HA   GLY  69           HA2      GLY  69  78.592   5.113   6.610
  488   2HA   GLY  69           HA1      GLY  69  79.425   6.460   7.386
  489    H    SER  70           HN       SER  70  76.503   5.058   8.732
  490    HA   SER  70           HA       SER  70  77.882   4.522  11.243
  491   1HB   SER  70           HB2      SER  70  75.463   3.339  11.563
  492   2HB   SER  70           HB1      SER  70  75.728   5.067  11.774
  493    HG   SER  70           HG       SER  70  74.060   4.030  10.151
  494    H    GLY  71           HN       GLY  71  77.597   2.813   8.362
  495   1HA   GLY  71           HA2      GLY  71  78.327   0.635   7.839
  496   2HA   GLY  71           HA1      GLY  71  78.761   0.428   9.536
  497    H    THR  72           HN       THR  72  75.534   1.409   8.582
  498    HA   THR  72           HA       THR  72  74.460  -1.313   8.723
  499    HB   THR  72           HB       THR  72  72.905  -0.138  10.679
  500    HG1  THR  72           HG1      THR  72  74.488   0.641  12.167
  501   1HG2  THR  72          HG22      THR  72  75.351  -1.904  10.964
  502   2HG2  THR  72          HG21      THR  72  74.133  -1.668  12.220
  503   3HG2  THR  72          HG23      THR  72  73.692  -2.443  10.698
  504    H    ILE  73           HN       ILE  73  72.379  -1.402   7.828
  505    HA   ILE  73           HA       ILE  73  71.411   1.167   6.669
  506    HB   ILE  73           HB       ILE  73  70.870  -1.725   5.951
  507   1HG1  ILE  73          HG12      ILE  73  73.055  -0.549   5.279
  508   2HG1  ILE  73          HG11      ILE  73  72.113  -1.260   3.969
  509   1HG2  ILE  73          HG22      ILE  73  69.420   0.775   5.290
  510   2HG2  ILE  73          HG21      ILE  73  69.779  -0.283   3.925
  511   3HG2  ILE  73          HG23      ILE  73  68.848  -0.894   5.293
  512   1HD1  ILE  73          HD11      ILE  73  71.106   0.943   3.491
  513   2HD1  ILE  73          HD13      ILE  73  72.050   1.657   4.800
  514   3HD1  ILE  73          HD12      ILE  73  72.864   1.013   3.374
  515    H    ASP  74           HN       ASP  74  69.269   1.840   6.999
  516    HA   ASP  74           HA       ASP  74  67.666   0.232   8.943
  517   1HB   ASP  74           HB2      ASP  74  66.883   2.666   9.668
  518   2HB   ASP  74           HB1      ASP  74  68.330   1.939  10.367
  519    H    PHE  75           HN       PHE  75  65.296   1.035   8.909
  520    HA   PHE  75           HA       PHE  75  64.210   0.744   6.332
  521   1HB   PHE  75           HB2      PHE  75  63.076   0.719   8.713
  522   2HB   PHE  75           HB1      PHE  75  62.761   2.418   8.356
  523    HD1  PHE  75           HD2      PHE  75  62.716  -0.812   6.433
  524    HD2  PHE  75           HD1      PHE  75  60.661   2.823   7.441
  525    HE1  PHE  75           HE2      PHE  75  60.830  -1.470   4.962
  526    HE2  PHE  75           HE1      PHE  75  58.775   2.165   5.971
  527    HZ   PHE  75           HZ       PHE  75  58.859   0.019   4.732
  528    H    GLU  76           HN       GLU  76  64.972   3.741   8.103
  529    HA   GLU  76           HA       GLU  76  63.893   5.593   6.263
  530   1HB   GLU  76           HB2      GLU  76  66.465   5.888   7.846
  531   2HB   GLU  76           HB1      GLU  76  65.494   7.202   7.182
  532   1HG   GLU  76           HG2      GLU  76  63.554   6.267   8.572
  533   2HG   GLU  76           HG1      GLU  76  64.764   5.291   9.405
  534    H    GLU  77           HN       GLU  77  67.101   4.036   6.286
  535    HA   GLU  77           HA       GLU  77  67.896   5.355   3.803
  536   1HB   GLU  77           HB2      GLU  77  69.143   2.989   5.235
  537   2HB   GLU  77           HB1      GLU  77  69.899   3.949   3.962
  538   1HG   GLU  77           HG2      GLU  77  69.714   5.965   5.403
  539   2HG   GLU  77           HG1      GLU  77  69.035   4.962   6.687
  540    H    PHE  78           HN       PHE  78  66.018   2.622   4.619
  541    HA   PHE  78           HA       PHE  78  66.606   0.891   2.416
  542   1HB   PHE  78           HB2      PHE  78  64.892   0.836   4.600
  543   2HB   PHE  78           HB1      PHE  78  63.790   0.932   3.226
  544    HD1  PHE  78           HD2      PHE  78  63.801  -0.803   1.474
  545    HD2  PHE  78           HD1      PHE  78  66.312  -1.093   4.946
  546    HE1  PHE  78           HE2      PHE  78  64.196  -3.205   0.987
  547    HE2  PHE  78           HE1      PHE  78  66.707  -3.494   4.460
  548    HZ   PHE  78           HZ       PHE  78  65.650  -4.549   2.482
  549    H    LEU  79           HN       LEU  79  63.871   3.161   2.820
  550    HA   LEU  79           HA       LEU  79  62.842   3.022   0.218
  551   1HB   LEU  79           HB2      LEU  79  63.071   5.548   1.886
  552   2HB   LEU  79           HB1      LEU  79  61.902   5.240   0.602
  553    HG   LEU  79           HG       LEU  79  62.117   3.596   3.142
  554   1HD1  LEU  79          HD12      LEU  79  60.280   5.868   2.353
  555   2HD1  LEU  79          HD11      LEU  79  59.913   4.744   3.661
  556   3HD1  LEU  79          HD13      LEU  79  61.337   5.780   3.763
  557   1HD2  LEU  79          HD21      LEU  79  61.066   2.842   0.752
  558   2HD2  LEU  79          HD23      LEU  79  60.431   2.296   2.303
  559   3HD2  LEU  79          HD22      LEU  79  59.671   3.649   1.465
  560    H    VAL  80           HN       VAL  80  65.717   4.669   1.380
  561    HA   VAL  80           HA       VAL  80  66.167   6.343  -0.898
  562    HB   VAL  80           HB       VAL  80  68.166   5.070   0.998
  563   1HG1  VAL  80          HG13      VAL  80  68.461   6.751  -1.370
  564   2HG1  VAL  80          HG12      VAL  80  69.150   7.508   0.066
  565   3HG1  VAL  80          HG11      VAL  80  69.697   5.907  -0.437
  566   1HG2  VAL  80          HG22      VAL  80  66.597   7.654   1.019
  567   2HG2  VAL  80          HG21      VAL  80  66.709   6.434   2.288
  568   3HG2  VAL  80          HG23      VAL  80  68.092   7.472   1.938
  569    H    MET  81           HN       MET  81  67.387   3.074  -0.110
  570    HA   MET  81           HA       MET  81  68.950   2.630  -2.397
  571   1HB   MET  81           HB2      MET  81  68.189   1.098  -0.278
  572   2HB   MET  81           HB1      MET  81  67.255   0.346  -1.573
  573   1HG   MET  81           HG2      MET  81  69.211  -0.116  -2.852
  574   2HG   MET  81           HG1      MET  81  70.203   0.946  -1.854
  575   1HE   MET  81           HE3      MET  81  69.962   0.862   0.543
  576   2HE   MET  81           HE2      MET  81  69.051  -0.382   1.397
  577   3HE   MET  81           HE1      MET  81  70.807  -0.495   1.303
  578    H    MET  82           HN       MET  82  65.444   2.108  -1.994
  579    HA   MET  82           HA       MET  82  64.832   1.015  -4.500
  580   1HB   MET  82           HB2      MET  82  63.394   2.556  -2.445
  581   2HB   MET  82           HB1      MET  82  62.718   2.717  -4.067
  582   1HG   MET  82           HG2      MET  82  61.635   0.812  -3.200
  583   2HG   MET  82           HG1      MET  82  62.929   0.145  -4.193
  584   1HE   MET  82           HE2      MET  82  64.398  -1.080  -3.807
  585   2HE   MET  82           HE1      MET  82  65.514  -1.051  -2.444
  586   3HE   MET  82           HE3      MET  82  64.235  -2.271  -2.518
  587    H    VAL  83           HN       VAL  83  64.240   4.466  -3.807
  588    HA   VAL  83           HA       VAL  83  64.082   5.306  -6.484
  589    HB   VAL  83           HB       VAL  83  65.307   6.992  -4.292
  590   1HG1  VAL  83          HG11      VAL  83  64.423   7.455  -6.975
  591   2HG1  VAL  83          HG13      VAL  83  63.331   8.304  -5.881
  592   3HG1  VAL  83          HG12      VAL  83  65.065   8.624  -5.822
  593   1HG2  VAL  83          HG23      VAL  83  62.816   5.613  -4.217
  594   2HG2  VAL  83          HG22      VAL  83  63.408   6.833  -3.091
  595   3HG2  VAL  83          HG21      VAL  83  62.461   7.318  -4.498
  596    H    ARG  84           HN       ARG  84  66.879   4.393  -4.654
  597    HA   ARG  84           HA       ARG  84  68.853   5.829  -6.179
  598   1HB   ARG  84           HB2      ARG  84  68.834   3.994  -4.009
  599   2HB   ARG  84           HB1      ARG  84  69.875   3.305  -5.256
  600   1HG   ARG  84           HG2      ARG  84  71.334   4.690  -4.025
  601   2HG   ARG  84           HG1      ARG  84  70.901   5.679  -5.419
  602   1HD   ARG  84           HD2      ARG  84  69.006   5.953  -3.201
  603   2HD   ARG  84           HD1      ARG  84  70.645   6.444  -2.769
  604    HE   ARG  84           HE       ARG  84  70.559   8.046  -4.669
  605   1HH1  ARG  84          HH21      ARG  84  68.660   7.675  -6.546
  606   2HH1  ARG  84          HH22      ARG  84  67.184   8.369  -5.966
  607   1HH2  ARG  84          HH11      ARG  84  68.210   8.452  -2.656
  608   2HH2  ARG  84          HH12      ARG  84  66.927   8.807  -3.764
  609    H    GLN  85           HN       GLN  85  67.434   2.578  -6.498
  610    HA   GLN  85           HA       GLN  85  69.052   1.834  -8.770
  611   1HB   GLN  85           HB2      GLN  85  66.668   0.751  -7.365
  612   2HB   GLN  85           HB1      GLN  85  66.865   0.268  -9.051
  613   1HG   GLN  85           HG2      GLN  85  69.323   0.170  -7.397
  614   2HG   GLN  85           HG1      GLN  85  68.077  -1.008  -6.981
  615   1HE2  GLN  85          HE22      GLN  85  69.995  -1.295 -10.592
  616   2HE2  GLN  85          HE21      GLN  85  70.136   0.125  -9.673
  617    H    MET  86           HN       MET  86  65.562   2.653  -8.618
  618    HA   MET  86           HA       MET  86  64.988   2.825 -11.314
  619   1HB   MET  86           HB2      MET  86  63.241   4.382 -10.776
  620   2HB   MET  86           HB1      MET  86  63.422   3.328  -9.372
  621   1HG   MET  86           HG2      MET  86  64.832   5.018  -8.271
  622   2HG   MET  86           HG1      MET  86  64.682   6.070  -9.679
  623   1HE   MET  86           HE3      MET  86  62.985   7.215 -10.447
  624   2HE   MET  86           HE2      MET  86  61.520   7.727  -9.613
  625   3HE   MET  86           HE1      MET  86  63.093   8.245  -9.013
  626    H    LYS  87           HN       LYS  87  66.856   5.124  -9.398
  627    HA   LYS  87           HA       LYS  87  67.281   6.750 -11.868
  628   1HB   LYS  87           HB2      LYS  87  66.923   7.422  -9.055
  629   2HB   LYS  87           HB1      LYS  87  68.408   8.120  -9.703
  630   1HG   LYS  87           HG2      LYS  87  67.293   9.496 -11.153
  631   2HG   LYS  87           HG1      LYS  87  66.008   8.321 -11.440
  632   1HD   LYS  87           HD2      LYS  87  65.383   8.824  -8.932
  633   2HD   LYS  87           HD1      LYS  87  66.286  10.314  -9.211
  634   1HE   LYS  87           HE2      LYS  87  64.545   9.811 -11.453
  635   2HE   LYS  87           HE1      LYS  87  63.611   9.763  -9.958
  636   1HZ   LYS  87           HZ2      LYS  87  64.993  11.885  -9.425
  637   2HZ   LYS  87           HZ1      LYS  87  65.156  11.973 -11.113
  638   3HZ   LYS  87           HZ3      LYS  87  63.613  11.988 -10.410
  639    H    GLU  88           HN       GLU  88  68.816   4.987 -12.532
  640    HA   GLU  88           HA       GLU  88  71.168   4.350 -11.061
  641   1HB   GLU  88           HB2      GLU  88  72.060   3.528 -13.165
  642   2HB   GLU  88           HB1      GLU  88  70.343   3.128 -13.099
  643   1HG   GLU  88           HG2      GLU  88  70.318   5.642 -14.232
  644   2HG   GLU  88           HG1      GLU  88  71.773   4.928 -14.928
  645    H    ASP  89           HN       ASP  89  73.119   5.404 -10.853
  646    HA   ASP  89           HA       ASP  89  74.681   7.151 -10.980
  647   1HB   ASP  89           HB2      ASP  89  73.424   7.123 -13.696
  648   2HB   ASP  89           HB1      ASP  89  74.436   8.501 -13.262
  649    H    ALA  90           HN       ALA  90  72.240   7.632  -9.601
  650    HA   ALA  90           HA       ALA  90  72.311  10.455  -9.302
  651   1HB   ALA  90           HB2      ALA  90  70.408   9.408 -11.335
  652   2HB   ALA  90           HB1      ALA  90  69.786  10.632 -10.229
  653   3HB   ALA  90           HB3      ALA  90  71.190  10.986 -11.235
   
  No H/Q in entry =         653
  Start of MODEL   29
    1   1H    ALA   1           HT3      ALA   1  68.451   8.810  14.892
    2   2H    ALA   1           HT2      ALA   1  67.330   7.845  14.057
    3   3H    ALA   1           HT1      ALA   1  68.437   7.131  15.130
    4    HA   ALA   1           HA       ALA   1  70.152   7.212  13.679
    5   1HB   ALA   1           HB2      ALA   1  68.290   5.959  12.592
    6   2HB   ALA   1           HB1      ALA   1  67.790   7.448  11.790
    7   3HB   ALA   1           HB3      ALA   1  69.358   6.729  11.417
    8    H    SER   2           HN       SER   2  70.391   8.321  11.102
    9    HA   SER   2           HA       SER   2  70.677  11.203  11.807
   10   1HB   SER   2           HB2      SER   2  72.339   9.293  10.406
   11   2HB   SER   2           HB1      SER   2  71.996  10.676   9.371
   12    HG   SER   2           HG       SER   2  73.079  11.939  10.689
   13    H    MET   3           HN       MET   3  70.205  12.783  10.070
   14    HA   MET   3           HA       MET   3  67.937  11.837   8.369
   15   1HB   MET   3           HB2      MET   3  67.902  13.836  10.208
   16   2HB   MET   3           HB1      MET   3  68.360  14.745   8.767
   17   1HG   MET   3           HG2      MET   3  65.989  14.777   8.758
   18   2HG   MET   3           HG1      MET   3  66.418  13.522   7.596
   19   1HE   MET   3           HE1      MET   3  65.465  14.655  10.821
   20   2HE   MET   3           HE3      MET   3  63.867  13.900  10.760
   21   3HE   MET   3           HE2      MET   3  65.094  13.283  11.863
   22    H    THR   4           HN       THR   4  68.279  11.831   6.196
   23    HA   THR   4           HA       THR   4  70.425  13.613   5.118
   24    HB   THR   4           HB       THR   4  70.994  11.802   3.512
   25    HG1  THR   4           HG1      THR   4  69.034  10.696   3.550
   26   1HG2  THR   4          HG21      THR   4  71.687  12.001   6.199
   27   2HG2  THR   4          HG23      THR   4  71.289  10.295   5.993
   28   3HG2  THR   4          HG22      THR   4  72.527  11.041   4.981
   29    H    ASP   5           HN       ASP   5  69.905  14.654   3.198
   30    HA   ASP   5           HA       ASP   5  67.205  15.069   2.499
   31   1HB   ASP   5           HB2      ASP   5  69.777  15.441   0.962
   32   2HB   ASP   5           HB1      ASP   5  68.214  15.849   0.253
   33    H    GLN   6           HN       GLN   6  69.293  12.430   1.721
   34    HA   GLN   6           HA       GLN   6  68.100  11.541  -0.713
   35   1HB   GLN   6           HB2      GLN   6  69.371   9.942   1.530
   36   2HB   GLN   6           HB1      GLN   6  68.988   9.300  -0.068
   37   1HG   GLN   6           HG2      GLN   6  70.552  11.816  -0.048
   38   2HG   GLN   6           HG1      GLN   6  71.394  10.394   0.566
   39   1HE2  GLN   6          HE22      GLN   6  72.089   9.401  -2.735
   40   2HE2  GLN   6          HE21      GLN   6  72.662   9.655  -1.159
   41    H    GLN   7           HN       GLN   7  67.303  10.806   2.685
   42    HA   GLN   7           HA       GLN   7  65.094   9.063   1.987
   43   1HB   GLN   7           HB2      GLN   7  66.024  10.395   4.523
   44   2HB   GLN   7           HB1      GLN   7  64.476   9.554   4.470
   45   1HG   GLN   7           HG2      GLN   7  65.851   7.799   5.093
   46   2HG   GLN   7           HG1      GLN   7  65.950   7.649   3.337
   47   1HE2  GLN   7          HE22      GLN   7  69.255   8.682   5.454
   48   2HE2  GLN   7          HE21      GLN   7  67.771   8.392   6.225
   49    H    ALA   8           HN       ALA   8  65.499  12.459   2.049
   50    HA   ALA   8           HA       ALA   8  62.778  13.196   2.701
   51   1HB   ALA   8           HB1      ALA   8  65.228  14.540   1.920
   52   2HB   ALA   8           HB3      ALA   8  63.847  15.196   1.039
   53   3HB   ALA   8           HB2      ALA   8  63.842  15.180   2.803
   54    H    GLU   9           HN       GLU   9  64.536  12.788  -0.383
   55    HA   GLU   9           HA       GLU   9  62.072  13.218  -1.920
   56   1HB   GLU   9           HB2      GLU   9  64.916  13.117  -2.462
   57   2HB   GLU   9           HB1      GLU   9  64.032  12.096  -3.598
   58   1HG   GLU   9           HG2      GLU   9  62.707  13.894  -4.366
   59   2HG   GLU   9           HG1      GLU   9  63.103  14.897  -2.969
   60    H    ALA  10           HN       ALA  10  63.973  10.516  -0.733
   61    HA   ALA  10           HA       ALA  10  62.871   8.476  -2.407
   62   1HB   ALA  10           HB1      ALA  10  63.928   8.353   0.432
   63   2HB   ALA  10           HB3      ALA  10  63.535   6.933  -0.537
   64   3HB   ALA  10           HB2      ALA  10  64.831   8.018  -1.046
   65    H    ARG  11           HN       ARG  11  62.004   9.226   0.993
   66    HA   ARG  11           HA       ARG  11  59.614   7.662   0.971
   67   1HB   ARG  11           HB2      ARG  11  60.101  10.134   2.653
   68   2HB   ARG  11           HB1      ARG  11  59.067   8.760   3.041
   69   1HG   ARG  11           HG2      ARG  11  61.188   7.322   2.890
   70   2HG   ARG  11           HG1      ARG  11  62.084   8.842   2.917
   71   1HD   ARG  11           HD2      ARG  11  60.181   7.809   5.037
   72   2HD   ARG  11           HD1      ARG  11  61.922   8.042   5.194
   73    HE   ARG  11           HE       ARG  11  60.409  10.470   4.521
   74   1HH1  ARG  11          HH21      ARG  11  61.007   8.361   7.131
   75   2HH1  ARG  11          HH22      ARG  11  61.431   9.616   8.247
   76   1HH2  ARG  11          HH11      ARG  11  61.287  12.140   5.873
   77   2HH2  ARG  11          HH12      ARG  11  61.587  11.755   7.536
   78    H    ALA  12           HN       ALA  12  60.185  11.109   0.291
   79    HA   ALA  12           HA       ALA  12  57.459  11.871  -0.005
   80   1HB   ALA  12           HB2      ALA  12  60.004  12.932  -1.248
   81   2HB   ALA  12           HB1      ALA  12  58.431  13.680  -1.525
   82   3HB   ALA  12           HB3      ALA  12  59.098  13.607   0.107
   83    H    PHE  13           HN       PHE  13  59.599  10.087  -2.111
   84    HA   PHE  13           HA       PHE  13  57.817  10.416  -4.436
   85   1HB   PHE  13           HB2      PHE  13  60.322  10.261  -4.660
   86   2HB   PHE  13           HB1      PHE  13  60.212   8.585  -4.121
   87    HD1  PHE  13           HD2      PHE  13  58.877   6.932  -5.460
   88    HD2  PHE  13           HD1      PHE  13  59.733  10.888  -6.888
   89    HE1  PHE  13           HE2      PHE  13  58.303   6.222  -7.767
   90    HE2  PHE  13           HE1      PHE  13  59.160  10.182  -9.196
   91    HZ   PHE  13           HZ       PHE  13  58.445   7.848  -9.635
   92    H    LEU  14           HN       LEU  14  58.417   8.122  -1.864
   93    HA   LEU  14           HA       LEU  14  56.763   6.062  -3.205
   94   1HB   LEU  14           HB2      LEU  14  57.973   5.925  -0.436
   95   2HB   LEU  14           HB1      LEU  14  57.453   4.584  -1.458
   96    HG   LEU  14           HG       LEU  14  59.578   6.473  -2.436
   97   1HD1  LEU  14          HD13      LEU  14  60.126   5.575  -0.095
   98   2HD1  LEU  14          HD12      LEU  14  60.177   3.975  -0.840
   99   3HD1  LEU  14          HD11      LEU  14  61.303   5.229  -1.362
  100   1HD2  LEU  14          HD23      LEU  14  58.288   4.428  -3.641
  101   2HD2  LEU  14          HD22      LEU  14  59.966   4.832  -4.001
  102   3HD2  LEU  14          HD21      LEU  14  59.596   3.526  -2.876
  103    H    SER  15           HN       SER  15  54.716   5.457  -2.451
  104    HA   SER  15           HA       SER  15  53.440   7.407  -0.603
  105   1HB   SER  15           HB2      SER  15  51.395   5.853  -1.499
  106   2HB   SER  15           HB1      SER  15  51.952   7.303  -2.329
  107    HG   SER  15           HG       SER  15  51.808   5.250  -3.572
  108    H    GLU  16           HN       GLU  16  51.649   6.322   0.812
  109    HA   GLU  16           HA       GLU  16  52.906   4.575   2.675
  110   1HB   GLU  16           HB2      GLU  16  50.518   6.026   2.547
  111   2HB   GLU  16           HB1      GLU  16  50.005   4.344   2.692
  112   1HG   GLU  16           HG2      GLU  16  51.674   4.125   4.602
  113   2HG   GLU  16           HG1      GLU  16  51.838   5.881   4.544
  114    H    GLU  17           HN       GLU  17  50.617   3.894   0.034
  115    HA   GLU  17           HA       GLU  17  50.250   1.126   0.593
  116   1HB   GLU  17           HB2      GLU  17  49.466   0.944  -1.708
  117   2HB   GLU  17           HB1      GLU  17  48.872   2.451  -1.010
  118   1HG   GLU  17           HG2      GLU  17  50.044   3.714  -2.474
  119   2HG   GLU  17           HG1      GLU  17  51.504   2.746  -2.258
  120    H    MET  18           HN       MET  18  53.007   2.797  -0.607
  121    HA   MET  18           HA       MET  18  54.120   0.312  -1.797
  122   1HB   MET  18           HB2      MET  18  54.678   3.212  -2.049
  123   2HB   MET  18           HB1      MET  18  56.091   2.157  -2.099
  124   1HG   MET  18           HG2      MET  18  55.056   0.826  -3.888
  125   2HG   MET  18           HG1      MET  18  53.616   1.843  -3.825
  126   1HE   MET  18           HE3      MET  18  55.565   1.101  -6.287
  127   2HE   MET  18           HE2      MET  18  56.810   2.287  -6.675
  128   3HE   MET  18           HE1      MET  18  57.018   1.226  -5.283
  129    H    ILE  19           HN       ILE  19  55.390   2.879   0.359
  130    HA   ILE  19           HA       ILE  19  57.566   1.502   1.408
  131    HB   ILE  19           HB       ILE  19  55.669   3.371   2.857
  132   1HG1  ILE  19          HG12      ILE  19  58.287   4.403   2.176
  133   2HG1  ILE  19          HG11      ILE  19  57.485   3.779   0.733
  134   1HG2  ILE  19          HG22      ILE  19  57.093   1.958   4.374
  135   2HG2  ILE  19          HG21      ILE  19  58.517   2.616   3.571
  136   3HG2  ILE  19          HG23      ILE  19  57.446   3.683   4.477
  137   1HD1  ILE  19          HD11      ILE  19  55.664   5.285   2.450
  138   2HD1  ILE  19          HD13      ILE  19  57.026   6.261   1.897
  139   3HD1  ILE  19          HD12      ILE  19  55.979   5.461   0.724
  140    H    ALA  20           HN       ALA  20  54.165   0.999   2.118
  141    HA   ALA  20           HA       ALA  20  54.533  -0.543   4.521
  142   1HB   ALA  20           HB1      ALA  20  52.354   0.360   3.001
  143   2HB   ALA  20           HB3      ALA  20  52.247  -1.399   2.948
  144   3HB   ALA  20           HB2      ALA  20  52.279  -0.564   4.500
  145    H    GLU  21           HN       GLU  21  54.210  -1.471   1.091
  146    HA   GLU  21           HA       GLU  21  54.326  -4.286   1.488
  147   1HB   GLU  21           HB2      GLU  21  54.757  -2.420  -0.776
  148   2HB   GLU  21           HB1      GLU  21  55.532  -3.997  -0.930
  149   1HG   GLU  21           HG2      GLU  21  53.510  -5.147  -0.909
  150   2HG   GLU  21           HG1      GLU  21  52.675  -3.870  -0.024
  151    H    PHE  22           HN       PHE  22  56.957  -1.947   0.851
  152    HA   PHE  22           HA       PHE  22  59.061  -3.896   0.920
  153   1HB   PHE  22           HB2      PHE  22  59.371  -1.010   1.760
  154   2HB   PHE  22           HB1      PHE  22  60.559  -2.053   0.978
  155    HD1  PHE  22           HD1      PHE  22  58.911  -3.329  -1.131
  156    HD2  PHE  22           HD2      PHE  22  59.045   0.749   0.212
  157    HE1  PHE  22           HE1      PHE  22  58.119  -2.570  -3.355
  158    HE2  PHE  22           HE2      PHE  22  58.252   1.507  -2.013
  159    HZ   PHE  22           HZ       PHE  22  57.789  -0.153  -3.796
  160    H    LYS  23           HN       LYS  23  57.436  -2.042   3.448
  161    HA   LYS  23           HA       LYS  23  59.260  -2.471   5.569
  162   1HB   LYS  23           HB2      LYS  23  57.400  -0.976   5.899
  163   2HB   LYS  23           HB1      LYS  23  56.238  -2.262   5.569
  164   1HG   LYS  23           HG2      LYS  23  56.527  -1.774   8.019
  165   2HG   LYS  23           HG1      LYS  23  56.881  -3.446   7.583
  166   1HD   LYS  23           HD2      LYS  23  59.118  -3.227   8.013
  167   2HD   LYS  23           HD1      LYS  23  59.167  -1.556   7.452
  168   1HE   LYS  23           HE2      LYS  23  59.075  -0.848   9.584
  169   2HE   LYS  23           HE1      LYS  23  57.504  -1.629   9.763
  170   1HZ   LYS  23           HZ1      LYS  23  59.724  -3.456   9.833
  171   2HZ   LYS  23           HZ3      LYS  23  59.751  -2.322  11.094
  172   3HZ   LYS  23           HZ2      LYS  23  58.395  -3.322  10.881
  173    H    ALA  24           HN       ALA  24  56.879  -4.620   4.124
  174    HA   ALA  24           HA       ALA  24  56.919  -6.614   6.197
  175   1HB   ALA  24           HB3      ALA  24  56.060  -6.507   3.335
  176   2HB   ALA  24           HB2      ALA  24  56.270  -8.093   4.078
  177   3HB   ALA  24           HB1      ALA  24  55.128  -6.939   4.770
  178    H    ALA  25           HN       ALA  25  58.970  -5.985   3.399
  179    HA   ALA  25           HA       ALA  25  60.381  -8.526   3.589
  180   1HB   ALA  25           HB2      ALA  25  60.155  -6.919   1.541
  181   2HB   ALA  25           HB1      ALA  25  61.515  -6.068   2.275
  182   3HB   ALA  25           HB3      ALA  25  61.684  -7.758   1.798
  183    H    PHE  26           HN       PHE  26  60.960  -5.207   4.713
  184    HA   PHE  26           HA       PHE  26  63.613  -5.575   5.660
  185   1HB   PHE  26           HB2      PHE  26  62.214  -3.404   5.494
  186   2HB   PHE  26           HB1      PHE  26  61.586  -3.850   7.081
  187    HD1  PHE  26           HD1      PHE  26  64.752  -3.247   5.194
  188    HD2  PHE  26           HD2      PHE  26  62.849  -3.454   9.039
  189    HE1  PHE  26           HE1      PHE  26  66.804  -2.352   6.259
  190    HE2  PHE  26           HE2      PHE  26  64.902  -2.559  10.104
  191    HZ   PHE  26           HZ       PHE  26  66.881  -2.008   8.714
  192    H    ASP  27           HN       ASP  27  60.499  -6.025   7.358
  193    HA   ASP  27           HA       ASP  27  61.469  -6.705   9.898
  194   1HB   ASP  27           HB2      ASP  27  59.002  -6.660   8.761
  195   2HB   ASP  27           HB1      ASP  27  59.255  -8.400   8.894
  196    H    MET  28           HN       MET  28  61.771  -8.473   6.944
  197    HA   MET  28           HA       MET  28  62.223 -11.064   8.199
  198   1HB   MET  28           HB2      MET  28  61.604 -11.522   6.056
  199   2HB   MET  28           HB1      MET  28  62.126  -9.949   5.469
  200   1HG   MET  28           HG2      MET  28  63.456 -11.747   4.442
  201   2HG   MET  28           HG1      MET  28  64.472 -10.734   5.468
  202   1HE   MET  28           HE3      MET  28  66.194 -12.293   5.382
  203   2HE   MET  28           HE2      MET  28  66.198 -11.893   7.097
  204   3HE   MET  28           HE1      MET  28  66.425 -13.564   6.590
  205    H    PHE  29           HN       PHE  29  64.267  -8.445   6.928
  206    HA   PHE  29           HA       PHE  29  66.726  -9.918   7.551
  207   1HB   PHE  29           HB2      PHE  29  66.304  -7.033   6.718
  208   2HB   PHE  29           HB1      PHE  29  67.861  -7.860   6.795
  209    HD1  PHE  29           HD2      PHE  29  64.518  -7.927   5.150
  210    HD2  PHE  29           HD1      PHE  29  68.597  -9.264   5.022
  211    HE1  PHE  29           HE2      PHE  29  64.146  -8.845   2.877
  212    HE2  PHE  29           HE1      PHE  29  68.226 -10.179   2.752
  213    HZ   PHE  29           HZ       PHE  29  66.001  -9.971   1.678
  214    H    ASP  30           HN       ASP  30  64.569  -7.861   9.263
  215    HA   ASP  30           HA       ASP  30  66.683  -7.287  11.293
  216   1HB   ASP  30           HB2      ASP  30  65.129  -5.565  12.153
  217   2HB   ASP  30           HB1      ASP  30  65.500  -5.298  10.449
  218    H    ALA  31           HN       ALA  31  65.708  -9.898  11.231
  219    HA   ALA  31           HA       ALA  31  63.460 -10.274  13.010
  220   1HB   ALA  31           HB1      ALA  31  65.724 -12.149  12.263
  221   2HB   ALA  31           HB3      ALA  31  64.261 -12.626  13.124
  222   3HB   ALA  31           HB2      ALA  31  64.157 -12.044  11.462
  223    H    ASP  32           HN       ASP  32  66.765  -9.460  13.498
  224    HA   ASP  32           HA       ASP  32  67.069 -10.576  16.150
  225   1HB   ASP  32           HB2      ASP  32  68.992  -9.884  14.721
  226   2HB   ASP  32           HB1      ASP  32  68.492  -8.203  14.908
  227    H    GLY  33           HN       GLY  33  65.399  -7.846  14.886
  228   1HA   GLY  33           HA2      GLY  33  63.841  -6.531  16.147
  229   2HA   GLY  33           HA1      GLY  33  64.622  -7.073  17.633
  230    H    GLY  34           HN       GLY  34  66.852  -6.101  15.253
  231   1HA   GLY  34           HA2      GLY  34  67.578  -3.752  16.857
  232   2HA   GLY  34           HA1      GLY  34  68.464  -4.367  15.461
  233    H    GLY  35           HN       GLY  35  66.657  -4.334  13.444
  234   1HA   GLY  35           HA2      GLY  35  64.966  -2.861  12.405
  235   2HA   GLY  35           HA1      GLY  35  65.592  -1.543  13.398
  236    H    ASP  36           HN       ASP  36  68.235  -3.273  12.433
  237    HA   ASP  36           HA       ASP  36  68.490  -2.017   9.769
  238   1HB   ASP  36           HB2      ASP  36  70.819  -1.146  10.614
  239   2HB   ASP  36           HB1      ASP  36  69.370  -0.196  10.947
  240    H    ILE  37           HN       ILE  37  69.833  -3.226   8.443
  241    HA   ILE  37           HA       ILE  37  71.392  -5.406   9.767
  242    HB   ILE  37           HB       ILE  37  70.625  -6.997   8.255
  243   1HG1  ILE  37          HG12      ILE  37  71.251  -5.647   6.227
  244   2HG1  ILE  37          HG11      ILE  37  69.732  -6.522   6.041
  245   1HG2  ILE  37          HG23      ILE  37  68.748  -5.803   9.633
  246   2HG2  ILE  37          HG22      ILE  37  68.224  -5.201   8.060
  247   3HG2  ILE  37          HG21      ILE  37  68.293  -6.936   8.363
  248   1HD1  ILE  37          HD12      ILE  37  68.713  -4.262   7.010
  249   2HD1  ILE  37          HD11      ILE  37  70.199  -3.585   6.346
  250   3HD1  ILE  37          HD13      ILE  37  69.071  -4.436   5.292
  251    H    SER  38           HN       SER  38  73.456  -5.809   8.900
  252    HA   SER  38           HA       SER  38  74.923  -3.738   7.752
  253   1HB   SER  38           HB2      SER  38  75.255  -6.732   7.618
  254   2HB   SER  38           HB1      SER  38  76.377  -5.669   6.774
  255    HG   SER  38           HG       SER  38  75.943  -6.042   9.505
  256    H    THR  39           HN       THR  39  75.350  -3.076   5.600
  257    HA   THR  39           HA       THR  39  73.249  -3.525   3.707
  258    HB   THR  39           HB       THR  39  74.336  -2.029   2.325
  259    HG1  THR  39           HG1      THR  39  76.747  -3.085   3.380
  260   1HG2  THR  39          HG22      THR  39  74.491  -1.514   5.060
  261   2HG2  THR  39          HG21      THR  39  76.097  -1.105   4.457
  262   3HG2  THR  39          HG23      THR  39  74.671  -0.330   3.768
  263    H    LYS  40           HN       LYS  40  75.979  -5.405   4.522
  264    HA   LYS  40           HA       LYS  40  76.537  -6.627   1.998
  265   1HB   LYS  40           HB2      LYS  40  77.559  -8.417   3.272
  266   2HB   LYS  40           HB1      LYS  40  77.913  -6.900   4.099
  267   1HG   LYS  40           HG2      LYS  40  76.327  -7.318   5.799
  268   2HG   LYS  40           HG1      LYS  40  75.506  -8.555   4.849
  269   1HD   LYS  40           HD2      LYS  40  77.201 -10.140   5.203
  270   2HD   LYS  40           HD1      LYS  40  78.386  -8.910   5.645
  271   1HE   LYS  40           HE2      LYS  40  75.964  -9.052   7.356
  272   2HE   LYS  40           HE1      LYS  40  77.073 -10.419   7.473
  273   1HZ   LYS  40           HZ3      LYS  40  78.242  -7.745   7.490
  274   2HZ   LYS  40           HZ2      LYS  40  77.391  -8.220   8.881
  275   3HZ   LYS  40           HZ1      LYS  40  78.710  -9.139   8.336
  276    H    ALA  41           HN       ALA  41  73.999  -7.080   4.370
  277    HA   ALA  41           HA       ALA  41  72.953  -9.463   2.972
  278   1HB   ALA  41           HB3      ALA  41  72.920  -9.000   5.553
  279   2HB   ALA  41           HB2      ALA  41  71.514  -8.005   5.177
  280   3HB   ALA  41           HB1      ALA  41  71.504  -9.727   4.796
  281    H    LEU  42           HN       LEU  42  72.514  -6.024   3.038
  282    HA   LEU  42           HA       LEU  42  69.846  -5.716   2.259
  283   1HB   LEU  42           HB2      LEU  42  72.315  -4.173   1.973
  284   2HB   LEU  42           HB1      LEU  42  71.239  -3.937   0.602
  285    HG   LEU  42           HG       LEU  42  70.495  -2.277   2.046
  286   1HD1  LEU  42          HD12      LEU  42  68.760  -4.307   1.633
  287   2HD1  LEU  42          HD11      LEU  42  68.781  -4.283   3.398
  288   3HD1  LEU  42          HD13      LEU  42  68.331  -2.832   2.500
  289   1HD2  LEU  42          HD23      LEU  42  71.370  -4.178   4.179
  290   2HD2  LEU  42          HD22      LEU  42  71.743  -2.466   3.977
  291   3HD2  LEU  42          HD21      LEU  42  70.163  -2.958   4.584
  292    H    GLY  43           HN       GLY  43  72.603  -6.809   0.349
  293   1HA   GLY  43           HA2      GLY  43  71.501  -6.672  -2.240
  294   2HA   GLY  43           HA1      GLY  43  72.647  -7.910  -1.727
  295    H    THR  44           HN       THR  44  71.158  -9.249   0.203
  296    HA   THR  44           HA       THR  44  69.509 -10.962  -1.394
  297    HB   THR  44           HB       THR  44  69.821 -10.613   1.598
  298    HG1  THR  44           HG1      THR  44  70.435 -12.884   0.077
  299   1HG2  THR  44          HG22      THR  44  67.651 -11.854   0.208
  300   2HG2  THR  44          HG21      THR  44  68.631 -13.120   0.946
  301   3HG2  THR  44          HG23      THR  44  67.963 -11.828   1.942
  302    H    VAL  45           HN       VAL  45  68.868  -8.112   0.529
  303    HA   VAL  45           HA       VAL  45  66.014  -8.380   0.691
  304    HB   VAL  45           HB       VAL  45  67.637  -5.821   0.601
  305   1HG1  VAL  45          HG11      VAL  45  64.848  -6.376   0.850
  306   2HG1  VAL  45          HG13      VAL  45  65.425  -5.795   2.411
  307   3HG1  VAL  45          HG12      VAL  45  65.662  -4.815   0.964
  308   1HG2  VAL  45          HG22      VAL  45  68.331  -7.676   2.290
  309   2HG2  VAL  45          HG21      VAL  45  68.044  -6.052   2.914
  310   3HG2  VAL  45          HG23      VAL  45  66.812  -7.298   3.099
  311    H    MET  46           HN       MET  46  68.156  -6.781  -1.662
  312    HA   MET  46           HA       MET  46  66.077  -5.685  -3.286
  313   1HB   MET  46           HB2      MET  46  68.905  -6.545  -3.959
  314   2HB   MET  46           HB1      MET  46  67.852  -5.687  -5.087
  315   1HG   MET  46           HG2      MET  46  67.597  -3.865  -3.390
  316   2HG   MET  46           HG1      MET  46  68.773  -4.698  -2.372
  317   1HE   MET  46           HE3      MET  46  67.913  -3.077  -5.628
  318   2HE   MET  46           HE2      MET  46  68.495  -1.765  -4.608
  319   3HE   MET  46           HE1      MET  46  69.372  -2.183  -6.078
  320    H    ARG  47           HN       ARG  47  67.828  -8.794  -3.508
  321    HA   ARG  47           HA       ARG  47  66.423  -9.709  -5.842
  322   1HB   ARG  47           HB2      ARG  47  68.598 -10.635  -4.755
  323   2HB   ARG  47           HB1      ARG  47  67.506 -11.558  -3.722
  324   1HG   ARG  47           HG2      ARG  47  66.560 -12.713  -5.570
  325   2HG   ARG  47           HG1      ARG  47  67.241 -11.574  -6.731
  326   1HD   ARG  47           HD2      ARG  47  69.215 -12.673  -6.808
  327   2HD   ARG  47           HD1      ARG  47  69.286 -12.825  -5.052
  328    HE   ARG  47           HE       ARG  47  68.442 -15.008  -5.289
  329   1HH1  ARG  47          HH21      ARG  47  65.910 -15.125  -6.220
  330   2HH1  ARG  47          HH22      ARG  47  65.973 -15.518  -7.906
  331   1HH2  ARG  47          HH11      ARG  47  69.307 -14.633  -8.260
  332   2HH2  ARG  47          HH12      ARG  47  67.895 -15.239  -9.061
  333    H    MET  48           HN       MET  48  65.604  -9.604  -2.462
  334    HA   MET  48           HA       MET  48  63.549 -11.642  -2.549
  335   1HB   MET  48           HB2      MET  48  64.725  -9.950  -0.584
  336   2HB   MET  48           HB1      MET  48  62.984  -9.670  -0.548
  337   1HG   MET  48           HG2      MET  48  62.558 -12.051  -0.289
  338   2HG   MET  48           HG1      MET  48  64.273 -12.413  -0.483
  339   1HE   MET  48           HE2      MET  48  61.586 -10.670   1.234
  340   2HE   MET  48           HE1      MET  48  61.968 -10.629   2.953
  341   3HE   MET  48           HE3      MET  48  62.610  -9.387   1.871
  342    H    LEU  49           HN       LEU  49  63.542  -8.098  -2.905
  343    HA   LEU  49           HA       LEU  49  60.672  -7.881  -3.122
  344   1HB   LEU  49           HB2      LEU  49  62.464  -5.928  -4.516
  345   2HB   LEU  49           HB1      LEU  49  61.026  -5.630  -3.542
  346    HG   LEU  49           HG       LEU  49  63.816  -6.286  -2.596
  347   1HD1  LEU  49          HD13      LEU  49  61.943  -3.983  -2.499
  348   2HD1  LEU  49          HD12      LEU  49  62.893  -4.279  -1.044
  349   3HD1  LEU  49          HD11      LEU  49  63.704  -3.999  -2.585
  350   1HD2  LEU  49          HD22      LEU  49  61.293  -7.118  -1.434
  351   2HD2  LEU  49          HD21      LEU  49  62.933  -7.458  -0.879
  352   3HD2  LEU  49          HD23      LEU  49  62.116  -5.982  -0.365
  353    H    GLY  50           HN       GLY  50  63.242  -7.785  -5.622
  354   1HA   GLY  50           HA2      GLY  50  62.186  -9.506  -7.486
  355   2HA   GLY  50           HA1      GLY  50  61.263  -8.029  -7.762
  356    H    GLN  51           HN       GLN  51  63.444  -6.226  -7.072
  357    HA   GLN  51           HA       GLN  51  64.673  -5.960  -9.635
  358   1HB   GLN  51           HB2      GLN  51  65.320  -4.784  -6.926
  359   2HB   GLN  51           HB1      GLN  51  66.238  -4.370  -8.374
  360   1HG   GLN  51           HG2      GLN  51  63.313  -4.237  -8.723
  361   2HG   GLN  51           HG1      GLN  51  63.958  -3.074  -7.563
  362   1HE2  GLN  51          HE22      GLN  51  65.775  -1.224 -10.022
  363   2HE2  GLN  51          HE21      GLN  51  65.655  -1.562  -8.363
  364    H    ASN  52           HN       ASN  52  66.523  -6.856 -10.458
  365    HA   ASN  52           HA       ASN  52  68.395  -8.200  -8.565
  366   1HB   ASN  52           HB2      ASN  52  68.571 -10.053 -10.332
  367   2HB   ASN  52           HB1      ASN  52  67.098 -10.032  -9.361
  368   1HD2  ASN  52          HD22      ASN  52  65.572 -10.285 -12.604
  369   2HD2  ASN  52          HD21      ASN  52  66.114 -11.208 -11.287
  370    HA   PRO  53           HA       PRO  53  70.562  -5.615 -11.724
  371   1HB   PRO  53           HB2      PRO  53  71.913  -4.074  -9.891
  372   2HB   PRO  53           HB1      PRO  53  70.313  -3.660 -10.524
  373   1HG   PRO  53           HG2      PRO  53  71.048  -4.733  -7.841
  374   2HG   PRO  53           HG1      PRO  53  69.651  -3.749  -8.311
  375   1HD   PRO  53           HD2      PRO  53  69.638  -6.547  -7.858
  376   2HD   PRO  53           HD1      PRO  53  68.344  -5.605  -8.629
  377    H    THR  54           HN       THR  54  73.163  -5.064 -11.420
  378    HA   THR  54           HA       THR  54  74.375  -7.710 -10.951
  379    HB   THR  54           HB       THR  54  76.474  -6.187 -11.664
  380    HG1  THR  54           HG1      THR  54  75.828  -4.493 -12.896
  381   1HG2  THR  54          HG23      THR  54  74.625  -7.922 -12.956
  382   2HG2  THR  54          HG22      THR  54  74.956  -6.587 -14.059
  383   3HG2  THR  54          HG21      THR  54  76.284  -7.562 -13.429
  384    H    LYS  55           HN       LYS  55  76.050  -8.080  -9.424
  385    HA   LYS  55           HA       LYS  55  75.805  -6.861  -6.896
  386   1HB   LYS  55           HB2      LYS  55  77.466  -8.853  -8.103
  387   2HB   LYS  55           HB1      LYS  55  78.502  -7.751  -7.192
  388   1HG   LYS  55           HG2      LYS  55  76.529  -8.027  -5.393
  389   2HG   LYS  55           HG1      LYS  55  76.359  -9.578  -6.218
  390   1HD   LYS  55           HD2      LYS  55  79.023  -8.550  -5.219
  391   2HD   LYS  55           HD1      LYS  55  77.962  -9.558  -4.234
  392   1HE   LYS  55           HE2      LYS  55  78.431 -11.436  -5.432
  393   2HE   LYS  55           HE1      LYS  55  78.418 -10.570  -6.969
  394   1HZ   LYS  55           HZ3      LYS  55  80.602  -9.559  -5.799
  395   2HZ   LYS  55           HZ2      LYS  55  80.623 -11.145  -5.188
  396   3HZ   LYS  55           HZ1      LYS  55  80.619 -10.878  -6.866
  397    H    GLU  56           HN       GLU  56  77.940  -6.037  -9.601
  398    HA   GLU  56           HA       GLU  56  79.662  -4.218  -8.321
  399   1HB   GLU  56           HB2      GLU  56  79.650  -3.023 -10.599
  400   2HB   GLU  56           HB1      GLU  56  80.117  -4.723 -10.597
  401   1HG   GLU  56           HG2      GLU  56  77.318  -4.736 -10.834
  402   2HG   GLU  56           HG1      GLU  56  77.869  -3.454 -11.914
  403    H    GLU  57           HN       GLU  57  76.395  -3.641  -9.634
  404    HA   GLU  57           HA       GLU  57  76.412  -0.829  -8.908
  405   1HB   GLU  57           HB2      GLU  57  74.523  -2.744 -10.108
  406   2HB   GLU  57           HB1      GLU  57  73.756  -1.513  -9.105
  407   1HG   GLU  57           HG2      GLU  57  73.947  -0.101 -10.851
  408   2HG   GLU  57           HG1      GLU  57  75.691  -0.124 -10.582
  409    H    LEU  58           HN       LEU  58  75.653  -3.807  -7.268
  410    HA   LEU  58           HA       LEU  58  73.986  -2.704  -5.199
  411   1HB   LEU  58           HB2      LEU  58  74.014  -5.093  -5.517
  412   2HB   LEU  58           HB1      LEU  58  75.761  -5.157  -5.282
  413    HG   LEU  58           HG       LEU  58  75.398  -4.253  -2.953
  414   1HD1  LEU  58          HD12      LEU  58  72.760  -3.921  -3.975
  415   2HD1  LEU  58          HD11      LEU  58  72.676  -5.115  -2.679
  416   3HD1  LEU  58          HD13      LEU  58  73.356  -3.518  -2.364
  417   1HD2  LEU  58          HD23      LEU  58  74.305  -6.902  -3.882
  418   2HD2  LEU  58          HD22      LEU  58  75.803  -6.567  -3.014
  419   3HD2  LEU  58          HD21      LEU  58  74.257  -6.474  -2.171
  420    H    ASP  59           HN       ASP  59  77.486  -3.478  -5.243
  421    HA   ASP  59           HA       ASP  59  78.065  -2.479  -2.650
  422   1HB   ASP  59           HB2      ASP  59  79.746  -2.693  -5.155
  423   2HB   ASP  59           HB1      ASP  59  80.406  -2.124  -3.622
  424    H    ALA  60           HN       ALA  60  78.238  -0.811  -5.811
  425    HA   ALA  60           HA       ALA  60  79.071   1.715  -4.818
  426   1HB   ALA  60           HB2      ALA  60  78.493   0.703  -7.300
  427   2HB   ALA  60           HB1      ALA  60  77.135   1.800  -7.046
  428   3HB   ALA  60           HB3      ALA  60  78.789   2.410  -6.967
  429    H    ILE  61           HN       ILE  61  75.867   0.245  -5.045
  430    HA   ILE  61           HA       ILE  61  74.342   2.579  -4.404
  431    HB   ILE  61           HB       ILE  61  73.869  -0.388  -4.167
  432   1HG1  ILE  61          HG12      ILE  61  72.543   1.849  -5.729
  433   2HG1  ILE  61          HG11      ILE  61  73.702   0.690  -6.374
  434   1HG2  ILE  61          HG23      ILE  61  72.507   1.708  -2.664
  435   2HG2  ILE  61          HG22      ILE  61  71.403   0.848  -3.737
  436   3HG2  ILE  61          HG21      ILE  61  72.344  -0.044  -2.542
  437   1HD1  ILE  61          HD11      ILE  61  71.312  -0.416  -4.978
  438   2HD1  ILE  61          HD13      ILE  61  71.057   0.302  -6.569
  439   3HD1  ILE  61          HD12      ILE  61  72.185  -1.040  -6.378
  440    H    ILE  62           HN       ILE  62  75.569  -0.049  -2.304
  441    HA   ILE  62           HA       ILE  62  74.640   0.873   0.168
  442    HB   ILE  62           HB       ILE  62  77.362  -0.336  -0.409
  443   1HG1  ILE  62          HG12      ILE  62  75.070  -1.940   0.611
  444   2HG1  ILE  62          HG11      ILE  62  74.996  -1.450  -1.082
  445   1HG2  ILE  62          HG21      ILE  62  77.052   0.695   1.860
  446   2HG2  ILE  62          HG23      ILE  62  75.686  -0.388   2.114
  447   3HG2  ILE  62          HG22      ILE  62  77.308  -1.048   1.910
  448   1HD1  ILE  62          HD12      ILE  62  77.655  -2.323  -0.585
  449   2HD1  ILE  62          HD11      ILE  62  76.575  -3.535   0.105
  450   3HD1  ILE  62          HD13      ILE  62  76.437  -3.097  -1.598
  451    H    GLU  63           HN       GLU  63  77.443   1.991  -1.699
  452    HA   GLU  63           HA       GLU  63  78.489   3.724   0.344
  453   1HB   GLU  63           HB2      GLU  63  78.861   3.432  -2.610
  454   2HB   GLU  63           HB1      GLU  63  79.446   4.902  -1.833
  455   1HG   GLU  63           HG2      GLU  63  80.233   2.767  -0.158
  456   2HG   GLU  63           HG1      GLU  63  80.613   2.264  -1.806
  457    H    GLU  64           HN       GLU  64  76.196   4.260  -2.326
  458    HA   GLU  64           HA       GLU  64  75.946   7.107  -1.683
  459   1HB   GLU  64           HB2      GLU  64  74.441   5.279  -3.570
  460   2HB   GLU  64           HB1      GLU  64  74.081   6.996  -3.391
  461   1HG   GLU  64           HG2      GLU  64  76.934   6.293  -3.828
  462   2HG   GLU  64           HG1      GLU  64  75.853   6.062  -5.202
  463    H    VAL  65           HN       VAL  65  74.721   4.312  -0.282
  464    HA   VAL  65           HA       VAL  65  72.139   5.575   0.464
  465    HB   VAL  65           HB       VAL  65  73.208   2.837   1.208
  466   1HG1  VAL  65          HG12      VAL  65  71.015   4.316   2.155
  467   2HG1  VAL  65          HG11      VAL  65  70.332   3.172   0.999
  468   3HG1  VAL  65          HG13      VAL  65  71.287   2.586   2.360
  469   1HG2  VAL  65          HG22      VAL  65  72.659   3.671  -1.336
  470   2HG2  VAL  65          HG21      VAL  65  72.440   2.012  -0.778
  471   3HG2  VAL  65          HG23      VAL  65  71.067   3.119  -0.815
  472    H    ASP  66           HN       ASP  66  75.019   4.169   2.050
  473    HA   ASP  66           HA       ASP  66  74.204   5.156   4.667
  474   1HB   ASP  66           HB2      ASP  66  76.519   3.662   3.540
  475   2HB   ASP  66           HB1      ASP  66  76.810   4.576   5.020
  476    H    GLU  67           HN       GLU  67  73.928   7.447   4.037
  477    HA   GLU  67           HA       GLU  67  76.134   9.029   3.085
  478   1HB   GLU  67           HB2      GLU  67  73.406   9.481   4.010
  479   2HB   GLU  67           HB1      GLU  67  74.505  10.741   4.575
  480   1HG   GLU  67           HG2      GLU  67  74.262   9.813   1.696
  481   2HG   GLU  67           HG1      GLU  67  73.537  11.283   2.350
  482    H    ASP  68           HN       ASP  68  74.911   8.285   6.341
  483    HA   ASP  68           HA       ASP  68  76.976   9.939   7.607
  484   1HB   ASP  68           HB2      ASP  68  76.069   8.795   9.716
  485   2HB   ASP  68           HB1      ASP  68  74.929   9.801   8.820
  486    H    GLY  69           HN       GLY  69  77.130   7.053   6.044
  487   1HA   GLY  69           HA2      GLY  69  78.516   5.151   6.234
  488   2HA   GLY  69           HA1      GLY  69  79.709   6.343   6.757
  489    H    SER  70           HN       SER  70  76.714   5.287   8.372
  490    HA   SER  70           HA       SER  70  78.118   5.049  10.912
  491   1HB   SER  70           HB2      SER  70  75.872   4.159  11.691
  492   2HB   SER  70           HB1      SER  70  75.826   5.769  10.980
  493    HG   SER  70           HG       SER  70  74.694   3.435  10.131
  494    H    GLY  71           HN       GLY  71  77.961   3.046   8.251
  495   1HA   GLY  71           HA2      GLY  71  78.840   0.860   8.030
  496   2HA   GLY  71           HA1      GLY  71  78.998   0.782   9.786
  497    H    THR  72           HN       THR  72  75.918   1.844   9.135
  498    HA   THR  72           HA       THR  72  74.783  -0.876   8.790
  499    HB   THR  72           HB       THR  72  73.149  -0.032  10.746
  500    HG1  THR  72           HG1      THR  72  75.693   1.077  11.327
  501   1HG2  THR  72          HG23      THR  72  74.941  -2.034  10.457
  502   2HG2  THR  72          HG22      THR  72  75.714  -1.131  11.760
  503   3HG2  THR  72          HG21      THR  72  74.071  -1.738  11.963
  504    H    ILE  73           HN       ILE  73  72.540  -0.818   8.112
  505    HA   ILE  73           HA       ILE  73  71.706   1.866   7.086
  506    HB   ILE  73           HB       ILE  73  71.383  -0.892   5.897
  507   1HG1  ILE  73          HG12      ILE  73  72.772   1.683   5.151
  508   2HG1  ILE  73          HG11      ILE  73  73.452   0.059   5.256
  509   1HG2  ILE  73          HG21      ILE  73  69.239   0.372   5.756
  510   2HG2  ILE  73          HG23      ILE  73  70.101   1.709   4.995
  511   3HG2  ILE  73          HG22      ILE  73  69.983   0.154   4.172
  512   1HD1  ILE  73          HD12      ILE  73  71.385   0.931   3.222
  513   2HD1  ILE  73          HD11      ILE  73  73.115   0.809   2.901
  514   3HD1  ILE  73          HD13      ILE  73  72.186  -0.639   3.292
  515    H    ASP  74           HN       ASP  74  69.349   2.200   6.995
  516    HA   ASP  74           HA       ASP  74  67.838   0.448   8.889
  517   1HB   ASP  74           HB2      ASP  74  68.233   3.415   8.933
  518   2HB   ASP  74           HB1      ASP  74  66.664   2.777   9.427
  519    H    PHE  75           HN       PHE  75  65.423   0.733   8.602
  520    HA   PHE  75           HA       PHE  75  64.589   0.269   5.978
  521   1HB   PHE  75           HB2      PHE  75  63.273   0.012   8.189
  522   2HB   PHE  75           HB1      PHE  75  62.819   1.702   7.958
  523    HD1  PHE  75           HD2      PHE  75  63.268  -1.183   5.608
  524    HD2  PHE  75           HD1      PHE  75  60.642   1.852   7.134
  525    HE1  PHE  75           HE2      PHE  75  61.528  -1.873   3.979
  526    HE2  PHE  75           HE1      PHE  75  58.899   1.163   5.506
  527    HZ   PHE  75           HZ       PHE  75  59.343  -0.700   3.928
  528    H    GLU  76           HN       GLU  76  64.790   3.380   7.690
  529    HA   GLU  76           HA       GLU  76  63.551   4.981   5.690
  530   1HB   GLU  76           HB2      GLU  76  64.644   6.867   6.745
  531   2HB   GLU  76           HB1      GLU  76  64.162   5.739   8.012
  532   1HG   GLU  76           HG2      GLU  76  66.524   4.740   7.781
  533   2HG   GLU  76           HG1      GLU  76  66.920   6.200   6.874
  534    H    GLU  77           HN       GLU  77  66.913   3.892   6.054
  535    HA   GLU  77           HA       GLU  77  67.783   5.388   3.690
  536   1HB   GLU  77           HB2      GLU  77  69.144   3.277   5.387
  537   2HB   GLU  77           HB1      GLU  77  69.920   4.108   4.039
  538   1HG   GLU  77           HG2      GLU  77  69.632   6.260   5.130
  539   2HG   GLU  77           HG1      GLU  77  68.694   5.516   6.427
  540    H    PHE  78           HN       PHE  78  66.286   2.361   4.294
  541    HA   PHE  78           HA       PHE  78  67.361   0.888   2.068
  542   1HB   PHE  78           HB2      PHE  78  66.302  -0.572   3.496
  543   2HB   PHE  78           HB1      PHE  78  65.089   0.612   3.973
  544    HD1  PHE  78           HD2      PHE  78  63.271   1.215   2.280
  545    HD2  PHE  78           HD1      PHE  78  65.799  -2.230   1.887
  546    HE1  PHE  78           HE2      PHE  78  61.635   0.194   0.713
  547    HE2  PHE  78           HE1      PHE  78  64.169  -3.253   0.321
  548    HZ   PHE  78           HZ       PHE  78  62.086  -2.040  -0.266
  549    H    LEU  79           HN       LEU  79  64.508   2.971   2.489
  550    HA   LEU  79           HA       LEU  79  63.354   2.606  -0.070
  551   1HB   LEU  79           HB2      LEU  79  63.466   5.182   1.533
  552   2HB   LEU  79           HB1      LEU  79  62.290   4.780   0.279
  553    HG   LEU  79           HG       LEU  79  62.671   3.160   2.811
  554   1HD1  LEU  79          HD13      LEU  79  60.648   5.310   2.125
  555   2HD1  LEU  79          HD12      LEU  79  60.496   4.211   3.496
  556   3HD1  LEU  79          HD11      LEU  79  61.836   5.356   3.426
  557   1HD2  LEU  79          HD22      LEU  79  61.399   2.596   0.363
  558   2HD2  LEU  79          HD21      LEU  79  61.219   1.708   1.876
  559   3HD2  LEU  79          HD23      LEU  79  60.098   3.011   1.479
  560    H    VAL  80           HN       VAL  80  66.143   4.478   0.955
  561    HA   VAL  80           HA       VAL  80  66.421   6.067  -1.424
  562    HB   VAL  80           HB       VAL  80  68.416   5.116   0.648
  563   1HG1  VAL  80          HG12      VAL  80  69.557   5.475  -1.518
  564   2HG1  VAL  80          HG11      VAL  80  68.835   7.081  -1.628
  565   3HG1  VAL  80          HG13      VAL  80  69.997   6.720  -0.350
  566   1HG2  VAL  80          HG23      VAL  80  66.955   7.707   0.088
  567   2HG2  VAL  80          HG22      VAL  80  66.889   6.722   1.549
  568   3HG2  VAL  80          HG21      VAL  80  68.355   7.622   1.157
  569    H    MET  81           HN       MET  81  67.493   2.826  -0.520
  570    HA   MET  81           HA       MET  81  69.205   2.384  -2.777
  571   1HB   MET  81           HB2      MET  81  67.626   0.176  -1.476
  572   2HB   MET  81           HB1      MET  81  69.284   0.146  -2.079
  573   1HG   MET  81           HG2      MET  81  69.789   1.890  -0.250
  574   2HG   MET  81           HG1      MET  81  68.237   1.426   0.446
  575   1HE   MET  81           HE2      MET  81  71.529   0.398  -0.931
  576   2HE   MET  81           HE1      MET  81  71.955   0.738   0.744
  577   3HE   MET  81           HE3      MET  81  72.115  -0.903   0.102
  578    H    MET  82           HN       MET  82  65.730   2.079  -2.291
  579    HA   MET  82           HA       MET  82  65.219   0.609  -4.730
  580   1HB   MET  82           HB2      MET  82  63.466   2.253  -2.895
  581   2HB   MET  82           HB1      MET  82  62.839   1.452  -4.336
  582   1HG   MET  82           HG2      MET  82  64.373   0.011  -2.157
  583   2HG   MET  82           HG1      MET  82  62.613   0.097  -2.217
  584   1HE   MET  82           HE1      MET  82  65.356  -1.792  -2.569
  585   2HE   MET  82           HE3      MET  82  65.201  -2.949  -3.898
  586   3HE   MET  82           HE2      MET  82  65.876  -1.347  -4.192
  587    H    VAL  83           HN       VAL  83  64.322   3.989  -3.932
  588    HA   VAL  83           HA       VAL  83  63.751   4.801  -6.563
  589    HB   VAL  83           HB       VAL  83  65.104   6.638  -4.590
  590   1HG1  VAL  83          HG13      VAL  83  63.251   6.849  -6.909
  591   2HG1  VAL  83          HG12      VAL  83  62.962   7.955  -5.567
  592   3HG1  VAL  83          HG11      VAL  83  64.526   7.948  -6.384
  593   1HG2  VAL  83          HG23      VAL  83  62.499   5.194  -4.359
  594   2HG2  VAL  83          HG22      VAL  83  63.602   5.727  -3.091
  595   3HG2  VAL  83          HG21      VAL  83  62.535   6.891  -3.877
  596    H    ARG  84           HN       ARG  84  66.857   5.076  -4.819
  597    HA   ARG  84           HA       ARG  84  68.409   6.280  -6.800
  598   1HB   ARG  84           HB2      ARG  84  69.018   4.234  -4.687
  599   2HB   ARG  84           HB1      ARG  84  70.269   4.676  -5.849
  600   1HG   ARG  84           HG2      ARG  84  69.865   7.089  -5.262
  601   2HG   ARG  84           HG1      ARG  84  68.785   6.540  -3.979
  602   1HD   ARG  84           HD2      ARG  84  70.941   6.894  -2.972
  603   2HD   ARG  84           HD1      ARG  84  70.708   5.149  -3.091
  604    HE   ARG  84           HE       ARG  84  72.578   5.100  -4.509
  605   1HH1  ARG  84          HH11      ARG  84  71.428   8.301  -4.108
  606   2HH1  ARG  84          HH12      ARG  84  72.422   8.970  -5.358
  607   1HH2  ARG  84          HH21      ARG  84  73.721   5.905  -6.330
  608   2HH2  ARG  84          HH22      ARG  84  73.722   7.613  -6.616
  609    H    GLN  85           HN       GLN  85  67.325   2.919  -6.609
  610    HA   GLN  85           HA       GLN  85  68.959   2.054  -8.861
  611   1HB   GLN  85           HB2      GLN  85  67.427   0.790  -6.875
  612   2HB   GLN  85           HB1      GLN  85  66.617   0.407  -8.395
  613   1HG   GLN  85           HG2      GLN  85  69.181   0.029  -9.153
  614   2HG   GLN  85           HG1      GLN  85  69.321  -0.375  -7.443
  615   1HE2  GLN  85          HE22      GLN  85  67.570  -3.001  -9.943
  616   2HE2  GLN  85          HE21      GLN  85  68.359  -1.604 -10.496
  617    H    MET  86           HN       MET  86  65.589   3.086  -8.412
  618    HA   MET  86           HA       MET  86  65.056   2.717 -11.297
  619   1HB   MET  86           HB2      MET  86  62.771   3.203 -10.774
  620   2HB   MET  86           HB1      MET  86  63.361   2.177  -9.465
  621   1HG   MET  86           HG2      MET  86  63.998   4.532  -8.394
  622   2HG   MET  86           HG1      MET  86  62.691   5.090  -9.438
  623   1HE   MET  86           HE1      MET  86  61.291   5.920  -7.719
  624   2HE   MET  86           HE3      MET  86  60.226   4.981  -8.775
  625   3HE   MET  86           HE2      MET  86  60.020   4.916  -7.026
  626    H    LYS  87           HN       LYS  87  67.007   4.754 -10.267
  627    HA   LYS  87           HA       LYS  87  65.643   7.197 -11.331
  628   1HB   LYS  87           HB2      LYS  87  67.534   6.776  -9.076
  629   2HB   LYS  87           HB1      LYS  87  67.790   8.222 -10.052
  630   1HG   LYS  87           HG2      LYS  87  64.971   7.890  -9.531
  631   2HG   LYS  87           HG1      LYS  87  65.867   7.856  -8.011
  632   1HD   LYS  87           HD2      LYS  87  66.842   9.922  -9.842
  633   2HD   LYS  87           HD1      LYS  87  65.147  10.146  -9.404
  634   1HE   LYS  87           HE2      LYS  87  66.295  11.269  -7.683
  635   2HE   LYS  87           HE1      LYS  87  65.946   9.693  -6.972
  636   1HZ   LYS  87           HZ2      LYS  87  68.410   9.815  -8.471
  637   2HZ   LYS  87           HZ1      LYS  87  68.387  10.806  -7.093
  638   3HZ   LYS  87           HZ3      LYS  87  68.098   9.142  -6.943
  639    H    GLU  88           HN       GLU  88  68.998   5.996 -10.919
  640    HA   GLU  88           HA       GLU  88  69.427   6.398 -13.829
  641   1HB   GLU  88           HB2      GLU  88  70.183   8.357 -12.043
  642   2HB   GLU  88           HB1      GLU  88  71.655   7.395 -12.189
  643   1HG   GLU  88           HG2      GLU  88  71.320   7.517 -14.719
  644   2HG   GLU  88           HG1      GLU  88  70.100   8.751 -14.399
  645    H    ASP  89           HN       ASP  89  71.612   5.467 -14.472
  646    HA   ASP  89           HA       ASP  89  72.312   3.185 -12.666
  647   1HB   ASP  89           HB2      ASP  89  71.225   3.008 -15.198
  648   2HB   ASP  89           HB1      ASP  89  72.953   2.849 -15.515
  649    H    ALA  90           HN       ALA  90  73.457   6.030 -13.240
  650    HA   ALA  90           HA       ALA  90  76.270   5.085 -13.602
  651   1HB   ALA  90           HB1      ALA  90  75.001   6.604 -15.455
  652   2HB   ALA  90           HB3      ALA  90  75.622   7.871 -14.400
  653   3HB   ALA  90           HB2      ALA  90  76.732   6.718 -15.140
   
  No H/Q in entry =         653
  Start of MODEL   30
    1   1H    ALA   1           HT1      ALA   1  69.126  17.015  12.391
    2   2H    ALA   1           HT3      ALA   1  70.765  17.030  11.951
    3   3H    ALA   1           HT2      ALA   1  69.925  18.494  12.137
    4    HA   ALA   1           HA       ALA   1  69.922  18.298   9.870
    5   1HB   ALA   1           HB1      ALA   1  69.784  15.345  10.464
    6   2HB   ALA   1           HB3      ALA   1  69.383  15.959   8.860
    7   3HB   ALA   1           HB2      ALA   1  70.993  16.226   9.529
    8    H    SER   2           HN       SER   2  67.683  15.799  11.127
    9    HA   SER   2           HA       SER   2  65.338  15.733  11.115
   10   1HB   SER   2           HB2      SER   2  66.058  18.438  11.711
   11   2HB   SER   2           HB1      SER   2  64.672  18.464  10.625
   12    HG   SER   2           HG       SER   2  63.538  17.225  12.055
   13    H    MET   3           HN       MET   3  63.903  15.281   9.481
   14    HA   MET   3           HA       MET   3  63.181  15.009   7.261
   15   1HB   MET   3           HB2      MET   3  62.971  17.681   7.975
   16   2HB   MET   3           HB1      MET   3  63.835  17.744   6.438
   17   1HG   MET   3           HG2      MET   3  61.726  17.629   5.564
   18   2HG   MET   3           HG1      MET   3  61.944  15.900   5.832
   19   1HE   MET   3           HE1      MET   3  61.255  14.603   7.638
   20   2HE   MET   3           HE3      MET   3  59.714  14.840   8.473
   21   3HE   MET   3           HE2      MET   3  59.760  14.727   6.715
   22    H    THR   4           HN       THR   4  65.672  14.005   7.452
   23    HA   THR   4           HA       THR   4  67.814  15.090   6.058
   24    HB   THR   4           HB       THR   4  68.019  12.570   5.171
   25    HG1  THR   4           HG1      THR   4  66.883  11.425   7.054
   26   1HG2  THR   4          HG22      THR   4  68.790  14.017   7.501
   27   2HG2  THR   4          HG21      THR   4  68.338  12.389   8.006
   28   3HG2  THR   4          HG23      THR   4  69.584  12.617   6.778
   29    H    ASP   5           HN       ASP   5  68.434  15.147   3.836
   30    HA   ASP   5           HA       ASP   5  66.284  15.668   1.985
   31   1HB   ASP   5           HB2      ASP   5  69.269  15.527   1.823
   32   2HB   ASP   5           HB1      ASP   5  68.345  15.480   0.319
   33    H    GLN   6           HN       GLN   6  68.527  12.936   2.417
   34    HA   GLN   6           HA       GLN   6  67.792  11.428   0.146
   35   1HB   GLN   6           HB2      GLN   6  69.139  10.937   2.681
   36   2HB   GLN   6           HB1      GLN   6  68.168   9.549   2.186
   37   1HG   GLN   6           HG2      GLN   6  69.742   8.998   0.678
   38   2HG   GLN   6           HG1      GLN   6  69.480  10.540  -0.140
   39   1HE2  GLN   6          HE22      GLN   6  73.045  10.499   0.907
   40   2HE2  GLN   6          HE21      GLN   6  72.079   9.615  -0.172
   41    H    GLN   7           HN       GLN   7  66.314  11.490   3.392
   42    HA   GLN   7           HA       GLN   7  64.231   9.597   2.619
   43   1HB   GLN   7           HB2      GLN   7  64.138  11.461   4.996
   44   2HB   GLN   7           HB1      GLN   7  63.398   9.869   4.827
   45   1HG   GLN   7           HG2      GLN   7  66.376  10.433   4.939
   46   2HG   GLN   7           HG1      GLN   7  65.409   9.732   6.237
   47   1HE2  GLN   7          HE22      GLN   7  66.988   6.946   4.273
   48   2HE2  GLN   7          HE21      GLN   7  67.597   8.281   5.126
   49    H    ALA   8           HN       ALA   8  64.733  12.970   2.253
   50    HA   ALA   8           HA       ALA   8  61.962  13.803   2.282
   51   1HB   ALA   8           HB2      ALA   8  64.570  14.993   1.652
   52   2HB   ALA   8           HB1      ALA   8  63.264  15.594   0.630
   53   3HB   ALA   8           HB3      ALA   8  63.147  15.732   2.384
   54    H    GLU   9           HN       GLU   9  64.241  12.976  -0.342
   55    HA   GLU   9           HA       GLU   9  62.140  13.210  -2.365
   56   1HB   GLU   9           HB2      GLU   9  64.495  13.727  -2.907
   57   2HB   GLU   9           HB1      GLU   9  64.939  12.057  -2.554
   58   1HG   GLU   9           HG2      GLU   9  63.904  11.233  -4.457
   59   2HG   GLU   9           HG1      GLU   9  62.742  12.558  -4.525
   60    H    ALA  10           HN       ALA  10  63.643  10.639  -0.490
   61    HA   ALA  10           HA       ALA  10  62.632   8.449  -2.065
   62   1HB   ALA  10           HB2      ALA  10  64.252   8.747   0.216
   63   2HB   ALA  10           HB1      ALA  10  62.861   7.805   0.752
   64   3HB   ALA  10           HB3      ALA  10  63.841   7.237  -0.600
   65    H    ARG  11           HN       ARG  11  61.467   9.860   1.016
   66    HA   ARG  11           HA       ARG  11  59.042   8.301   1.029
   67   1HB   ARG  11           HB2      ARG  11  60.336   9.890   2.857
   68   2HB   ARG  11           HB1      ARG  11  58.958  10.899   2.417
   69   1HG   ARG  11           HG2      ARG  11  57.410   9.097   2.946
   70   2HG   ARG  11           HG1      ARG  11  58.751   7.995   3.260
   71   1HD   ARG  11           HD2      ARG  11  59.510   9.478   5.103
   72   2HD   ARG  11           HD1      ARG  11  58.118  10.521   4.815
   73    HE   ARG  11           HE       ARG  11  58.021   7.789   5.971
   74   1HH1  ARG  11          HH21      ARG  11  55.623   7.327   5.044
   75   2HH1  ARG  11          HH22      ARG  11  54.491   8.437   5.742
   76   1HH2  ARG  11          HH11      ARG  11  56.926  10.666   6.800
   77   2HH2  ARG  11          HH12      ARG  11  55.229  10.328   6.736
   78    H    ALA  12           HN       ALA  12  59.984  11.264  -0.530
   79    HA   ALA  12           HA       ALA  12  57.261  12.207  -0.983
   80   1HB   ALA  12           HB3      ALA  12  60.003  13.041  -1.798
   81   2HB   ALA  12           HB2      ALA  12  58.669  13.554  -2.831
   82   3HB   ALA  12           HB1      ALA  12  58.688  14.005  -1.125
   83    H    PHE  13           HN       PHE  13  59.572  10.186  -2.706
   84    HA   PHE  13           HA       PHE  13  57.931  10.175  -5.148
   85   1HB   PHE  13           HB2      PHE  13  60.385  10.027  -5.324
   86   2HB   PHE  13           HB1      PHE  13  60.363   8.532  -4.389
   87    HD1  PHE  13           HD2      PHE  13  59.000   6.557  -5.298
   88    HD2  PHE  13           HD1      PHE  13  60.035   9.990  -7.662
   89    HE1  PHE  13           HE2      PHE  13  58.562   5.263  -7.368
   90    HE2  PHE  13           HE1      PHE  13  59.599   8.696  -9.732
   91    HZ   PHE  13           HZ       PHE  13  58.862   6.332  -9.584
   92    H    LEU  14           HN       LEU  14  58.437   8.165  -2.310
   93    HA   LEU  14           HA       LEU  14  56.803   5.992  -3.486
   94   1HB   LEU  14           HB2      LEU  14  57.924   6.102  -0.681
   95   2HB   LEU  14           HB1      LEU  14  57.464   4.677  -1.614
   96    HG   LEU  14           HG       LEU  14  59.632   6.536  -2.578
   97   1HD1  LEU  14          HD13      LEU  14  59.768   4.355  -0.511
   98   2HD1  LEU  14          HD12      LEU  14  61.148   4.661  -1.565
   99   3HD1  LEU  14          HD11      LEU  14  60.548   5.936  -0.505
  100   1HD2  LEU  14          HD21      LEU  14  58.341   4.426  -3.759
  101   2HD2  LEU  14          HD23      LEU  14  59.979   4.939  -4.166
  102   3HD2  LEU  14          HD22      LEU  14  59.727   3.618  -3.026
  103    H    SER  15           HN       SER  15  54.779   5.374  -2.606
  104    HA   SER  15           HA       SER  15  53.467   7.507  -0.980
  105   1HB   SER  15           HB2      SER  15  52.398   7.095  -3.145
  106   2HB   SER  15           HB1      SER  15  52.280   5.374  -2.785
  107    HG   SER  15           HG       SER  15  51.178   7.328  -1.070
  108    H    GLU  16           HN       GLU  16  51.863   6.715   0.648
  109    HA   GLU  16           HA       GLU  16  52.921   5.001   2.556
  110   1HB   GLU  16           HB2      GLU  16  50.251   6.062   1.957
  111   2HB   GLU  16           HB1      GLU  16  50.209   4.520   2.815
  112   1HG   GLU  16           HG2      GLU  16  52.250   6.111   4.011
  113   2HG   GLU  16           HG1      GLU  16  50.807   7.116   3.868
  114    H    GLU  17           HN       GLU  17  51.139   4.136  -0.354
  115    HA   GLU  17           HA       GLU  17  50.699   1.375   0.351
  116   1HB   GLU  17           HB2      GLU  17  50.613   2.981  -2.176
  117   2HB   GLU  17           HB1      GLU  17  50.634   1.221  -2.294
  118   1HG   GLU  17           HG2      GLU  17  48.747   2.456  -0.337
  119   2HG   GLU  17           HG1      GLU  17  48.341   2.567  -2.050
  120    H    MET  18           HN       MET  18  53.217   2.997  -1.603
  121    HA   MET  18           HA       MET  18  54.671   0.574  -2.156
  122   1HB   MET  18           HB2      MET  18  55.229   3.505  -2.366
  123   2HB   MET  18           HB1      MET  18  56.596   2.393  -2.431
  124   1HG   MET  18           HG2      MET  18  55.045   1.098  -4.143
  125   2HG   MET  18           HG1      MET  18  54.300   2.687  -4.332
  126   1HE   MET  18           HE1      MET  18  54.702   4.112  -5.557
  127   2HE   MET  18           HE3      MET  18  56.241   4.937  -5.836
  128   3HE   MET  18           HE2      MET  18  55.632   3.782  -7.017
  129    H    ILE  19           HN       ILE  19  55.550   3.272   0.038
  130    HA   ILE  19           HA       ILE  19  57.680   2.087   1.365
  131    HB   ILE  19           HB       ILE  19  55.484   3.884   2.411
  132   1HG1  ILE  19          HG12      ILE  19  58.181   4.920   2.432
  133   2HG1  ILE  19          HG11      ILE  19  57.801   4.271   0.836
  134   1HG2  ILE  19          HG22      ILE  19  57.935   2.816   3.830
  135   2HG2  ILE  19          HG21      ILE  19  57.098   4.281   4.342
  136   3HG2  ILE  19          HG23      ILE  19  56.257   2.732   4.365
  137   1HD1  ILE  19          HD13      ILE  19  55.712   5.601   0.802
  138   2HD1  ILE  19          HD12      ILE  19  56.125   6.271   2.381
  139   3HD1  ILE  19          HD11      ILE  19  57.132   6.632   0.979
  140    H    ALA  20           HN       ALA  20  54.271   1.313   1.665
  141    HA   ALA  20           HA       ALA  20  54.477  -0.214   4.100
  142   1HB   ALA  20           HB3      ALA  20  52.346   0.662   2.950
  143   2HB   ALA  20           HB2      ALA  20  52.486  -0.740   1.889
  144   3HB   ALA  20           HB1      ALA  20  52.273  -0.966   3.625
  145    H    GLU  21           HN       GLU  21  54.535  -1.155   0.653
  146    HA   GLU  21           HA       GLU  21  54.880  -3.954   1.118
  147   1HB   GLU  21           HB2      GLU  21  55.243  -2.094  -1.170
  148   2HB   GLU  21           HB1      GLU  21  56.130  -3.615  -1.257
  149   1HG   GLU  21           HG2      GLU  21  54.209  -4.892  -1.354
  150   2HG   GLU  21           HG1      GLU  21  53.262  -3.727  -0.429
  151    H    PHE  22           HN       PHE  22  57.236  -1.315   0.722
  152    HA   PHE  22           HA       PHE  22  59.561  -3.005   0.785
  153   1HB   PHE  22           HB2      PHE  22  59.323  -0.108   1.657
  154   2HB   PHE  22           HB1      PHE  22  60.806  -0.947   1.202
  155    HD1  PHE  22           HD1      PHE  22  59.906  -2.526  -1.132
  156    HD2  PHE  22           HD2      PHE  22  59.025   1.528  -0.019
  157    HE1  PHE  22           HE1      PHE  22  59.494  -1.963  -3.512
  158    HE2  PHE  22           HE2      PHE  22  58.615   2.092  -2.398
  159    HZ   PHE  22           HZ       PHE  22  58.848   0.348  -4.145
  160    H    LYS  23           HN       LYS  23  57.553  -1.565   3.292
  161    HA   LYS  23           HA       LYS  23  59.307  -1.846   5.502
  162   1HB   LYS  23           HB2      LYS  23  57.142  -0.659   5.626
  163   2HB   LYS  23           HB1      LYS  23  56.295  -2.195   5.441
  164   1HG   LYS  23           HG2      LYS  23  56.354  -1.709   7.796
  165   2HG   LYS  23           HG1      LYS  23  57.517  -3.004   7.509
  166   1HD   LYS  23           HD2      LYS  23  59.368  -1.482   7.589
  167   2HD   LYS  23           HD1      LYS  23  58.297  -0.080   7.553
  168   1HE   LYS  23           HE2      LYS  23  57.901  -2.049   9.760
  169   2HE   LYS  23           HE1      LYS  23  59.323  -1.009   9.846
  170   1HZ   LYS  23           HZ1      LYS  23  56.813   0.285   9.145
  171   2HZ   LYS  23           HZ3      LYS  23  56.939  -0.281  10.740
  172   3HZ   LYS  23           HZ2      LYS  23  58.078   0.829  10.141
  173    H    ALA  24           HN       ALA  24  56.990  -4.174   4.116
  174    HA   ALA  24           HA       ALA  24  57.372  -6.267   5.975
  175   1HB   ALA  24           HB2      ALA  24  56.510  -6.086   3.129
  176   2HB   ALA  24           HB1      ALA  24  56.979  -7.679   3.724
  177   3HB   ALA  24           HB3      ALA  24  55.675  -6.792   4.513
  178    H    ALA  25           HN       ALA  25  59.281  -5.387   3.111
  179    HA   ALA  25           HA       ALA  25  61.002  -7.651   3.089
  180   1HB   ALA  25           HB2      ALA  25  61.181  -4.838   2.090
  181   2HB   ALA  25           HB1      ALA  25  62.662  -5.794   2.143
  182   3HB   ALA  25           HB3      ALA  25  61.284  -6.355   1.195
  183    H    PHE  26           HN       PHE  26  61.406  -4.489   4.714
  184    HA   PHE  26           HA       PHE  26  63.916  -5.060   5.918
  185   1HB   PHE  26           HB2      PHE  26  62.575  -2.831   5.815
  186   2HB   PHE  26           HB1      PHE  26  61.814  -3.403   7.300
  187    HD1  PHE  26           HD1      PHE  26  65.125  -2.699   5.726
  188    HD2  PHE  26           HD2      PHE  26  62.935  -3.260   9.380
  189    HE1  PHE  26           HE1      PHE  26  67.107  -1.970   7.025
  190    HE2  PHE  26           HE2      PHE  26  64.919  -2.529  10.680
  191    HZ   PHE  26           HZ       PHE  26  67.003  -1.886   9.503
  192    H    ASP  27           HN       ASP  27  60.603  -5.648   7.098
  193    HA   ASP  27           HA       ASP  27  61.247  -6.577   9.687
  194   1HB   ASP  27           HB2      ASP  27  58.928  -6.249   8.417
  195   2HB   ASP  27           HB1      ASP  27  59.103  -7.984   8.147
  196    H    MET  28           HN       MET  28  61.781  -8.068   6.599
  197    HA   MET  28           HA       MET  28  62.044 -10.778   7.645
  198   1HB   MET  28           HB2      MET  28  62.712  -9.462   5.012
  199   2HB   MET  28           HB1      MET  28  63.178 -11.129   5.351
  200   1HG   MET  28           HG2      MET  28  60.679 -11.422   6.057
  201   2HG   MET  28           HG1      MET  28  60.417  -9.954   5.116
  202   1HE   MET  28           HE2      MET  28  62.565  -9.978   3.169
  203   2HE   MET  28           HE1      MET  28  62.173 -10.953   1.755
  204   3HE   MET  28           HE3      MET  28  60.995  -9.797   2.392
  205    H    PHE  29           HN       PHE  29  64.212  -8.063   7.013
  206    HA   PHE  29           HA       PHE  29  66.513  -9.749   7.883
  207   1HB   PHE  29           HB2      PHE  29  66.470  -7.013   6.572
  208   2HB   PHE  29           HB1      PHE  29  67.923  -7.923   6.988
  209    HD1  PHE  29           HD2      PHE  29  64.702  -8.317   5.103
  210    HD2  PHE  29           HD1      PHE  29  68.862  -9.350   5.392
  211    HE1  PHE  29           HE2      PHE  29  64.548  -9.547   2.955
  212    HE2  PHE  29           HE1      PHE  29  68.707 -10.576   3.247
  213    HZ   PHE  29           HZ       PHE  29  66.551 -10.677   2.027
  214    H    ASP  30           HN       ASP  30  64.356  -8.423   9.612
  215    HA   ASP  30           HA       ASP  30  66.233  -6.811  11.297
  216   1HB   ASP  30           HB2      ASP  30  64.391  -5.498  12.058
  217   2HB   ASP  30           HB1      ASP  30  64.200  -5.610  10.309
  218    H    ALA  31           HN       ALA  31  65.513  -9.797  11.176
  219    HA   ALA  31           HA       ALA  31  64.115 -10.311  13.683
  220   1HB   ALA  31           HB3      ALA  31  64.122 -11.904  11.745
  221   2HB   ALA  31           HB2      ALA  31  65.835 -12.197  12.044
  222   3HB   ALA  31           HB1      ALA  31  64.638 -12.649  13.258
  223    H    ASP  32           HN       ASP  32  67.166  -9.154  13.023
  224    HA   ASP  32           HA       ASP  32  68.730 -10.669  14.926
  225   1HB   ASP  32           HB2      ASP  32  69.120  -7.929  13.694
  226   2HB   ASP  32           HB1      ASP  32  70.306  -8.700  14.746
  227    H    GLY  33           HN       GLY  33  66.328  -8.256  15.251
  228   1HA   GLY  33           HA2      GLY  33  65.386  -7.472  17.286
  229   2HA   GLY  33           HA1      GLY  33  66.728  -8.215  18.158
  230    H    GLY  34           HN       GLY  34  68.336  -6.666  15.857
  231   1HA   GLY  34           HA2      GLY  34  68.893  -4.360  17.602
  232   2HA   GLY  34           HA1      GLY  34  69.798  -4.806  16.154
  233    H    GLY  35           HN       GLY  35  66.907  -5.058  14.918
  234   1HA   GLY  35           HA2      GLY  35  65.431  -3.640  13.749
  235   2HA   GLY  35           HA1      GLY  35  65.975  -2.314  14.778
  236    H    ASP  36           HN       ASP  36  68.281  -4.237  12.991
  237    HA   ASP  36           HA       ASP  36  68.423  -2.310  10.774
  238   1HB   ASP  36           HB2      ASP  36  70.961  -2.648  12.333
  239   2HB   ASP  36           HB1      ASP  36  70.457  -1.316  11.293
  240    H    ILE  37           HN       ILE  37  70.065  -3.020   9.155
  241    HA   ILE  37           HA       ILE  37  70.831  -5.887   9.486
  242    HB   ILE  37           HB       ILE  37  69.030  -6.164   8.056
  243   1HG1  ILE  37          HG12      ILE  37  71.312  -5.454   6.187
  244   2HG1  ILE  37          HG11      ILE  37  70.984  -7.042   6.882
  245   1HG2  ILE  37          HG21      ILE  37  69.696  -3.382   7.157
  246   2HG2  ILE  37          HG23      ILE  37  68.704  -4.410   6.124
  247   3HG2  ILE  37          HG22      ILE  37  68.167  -4.022   7.759
  248   1HD1  ILE  37          HD13      ILE  37  68.812  -5.688   5.327
  249   2HD1  ILE  37          HD12      ILE  37  70.139  -6.441   4.443
  250   3HD1  ILE  37          HD11      ILE  37  69.139  -7.409   5.526
  251    H    SER  38           HN       SER  38  72.503  -6.501   7.789
  252    HA   SER  38           HA       SER  38  74.541  -4.351   7.702
  253   1HB   SER  38           HB2      SER  38  75.730  -6.566   6.610
  254   2HB   SER  38           HB1      SER  38  75.748  -6.174   8.325
  255    HG   SER  38           HG       SER  38  74.752  -8.020   8.502
  256    H    THR  39           HN       THR  39  75.519  -3.671   5.740
  257    HA   THR  39           HA       THR  39  73.809  -3.512   3.457
  258    HB   THR  39           HB       THR  39  75.905  -2.698   2.287
  259    HG1  THR  39           HG1      THR  39  77.146  -2.786   4.791
  260   1HG2  THR  39          HG21      THR  39  75.078  -1.574   4.968
  261   2HG2  THR  39          HG23      THR  39  76.206  -0.739   3.900
  262   3HG2  THR  39          HG22      THR  39  74.555  -1.052   3.367
  263    H    LYS  40           HN       LYS  40  76.125  -5.912   4.465
  264    HA   LYS  40           HA       LYS  40  76.513  -7.102   1.850
  265   1HB   LYS  40           HB2      LYS  40  77.232  -9.120   3.288
  266   2HB   LYS  40           HB1      LYS  40  78.173  -7.638   3.461
  267   1HG   LYS  40           HG2      LYS  40  77.141  -7.086   5.518
  268   2HG   LYS  40           HG1      LYS  40  75.814  -8.221   5.252
  269   1HD   LYS  40           HD2      LYS  40  77.376  -9.154   6.889
  270   2HD   LYS  40           HD1      LYS  40  77.436 -10.105   5.405
  271   1HE   LYS  40           HE2      LYS  40  79.610  -9.603   5.081
  272   2HE   LYS  40           HE1      LYS  40  79.303  -7.879   5.301
  273   1HZ   LYS  40           HZ2      LYS  40  79.060  -9.145   7.785
  274   2HZ   LYS  40           HZ1      LYS  40  80.518  -9.661   7.081
  275   3HZ   LYS  40           HZ3      LYS  40  80.220  -8.005   7.294
  276    H    ALA  41           HN       ALA  41  74.225  -7.561   4.501
  277    HA   ALA  41           HA       ALA  41  72.991  -9.921   3.326
  278   1HB   ALA  41           HB3      ALA  41  72.582  -8.207   5.691
  279   2HB   ALA  41           HB2      ALA  41  71.091  -8.858   5.007
  280   3HB   ALA  41           HB1      ALA  41  72.379  -9.950   5.518
  281    H    LEU  42           HN       LEU  42  72.912  -6.616   2.596
  282    HA   LEU  42           HA       LEU  42  70.188  -6.251   1.823
  283   1HB   LEU  42           HB2      LEU  42  72.690  -4.836   1.541
  284   2HB   LEU  42           HB1      LEU  42  71.795  -4.791   0.021
  285    HG   LEU  42           HG       LEU  42  69.889  -3.810   1.054
  286   1HD1  LEU  42          HD13      LEU  42  71.170  -4.830   3.561
  287   2HD1  LEU  42          HD12      LEU  42  70.144  -3.401   3.669
  288   3HD1  LEU  42          HD11      LEU  42  69.484  -4.916   3.053
  289   1HD2  LEU  42          HD23      LEU  42  72.397  -2.638   2.283
  290   2HD2  LEU  42          HD22      LEU  42  71.719  -2.232   0.707
  291   3HD2  LEU  42          HD21      LEU  42  70.845  -1.809   2.179
  292    H    GLY  43           HN       GLY  43  73.012  -7.444  -0.016
  293   1HA   GLY  43           HA2      GLY  43  71.805  -7.701  -2.541
  294   2HA   GLY  43           HA1      GLY  43  73.040  -8.809  -1.935
  295    H    THR  44           HN       THR  44  71.345  -9.532   0.389
  296    HA   THR  44           HA       THR  44  69.907 -11.733  -0.856
  297    HB   THR  44           HB       THR  44  70.090 -10.772   2.014
  298    HG1  THR  44           HG1      THR  44  71.524 -12.441   2.196
  299   1HG2  THR  44          HG23      THR  44  68.079 -12.355   0.956
  300   2HG2  THR  44          HG22      THR  44  69.249 -13.537   1.542
  301   3HG2  THR  44          HG21      THR  44  68.583 -12.335   2.646
  302    H    VAL  45           HN       VAL  45  69.012  -8.671   0.729
  303    HA   VAL  45           HA       VAL  45  66.197  -9.131   0.812
  304    HB   VAL  45           HB       VAL  45  67.634  -6.492   0.396
  305   1HG1  VAL  45          HG11      VAL  45  64.902  -7.113   0.382
  306   2HG1  VAL  45          HG13      VAL  45  65.209  -6.499   2.007
  307   3HG1  VAL  45          HG12      VAL  45  65.611  -5.513   0.601
  308   1HG2  VAL  45          HG22      VAL  45  68.186  -8.114   2.432
  309   2HG2  VAL  45          HG21      VAL  45  67.988  -6.380   2.689
  310   3HG2  VAL  45          HG23      VAL  45  66.659  -7.482   3.052
  311    H    MET  46           HN       MET  46  68.172  -7.475  -1.675
  312    HA   MET  46           HA       MET  46  66.137  -6.842  -3.493
  313   1HB   MET  46           HB2      MET  46  68.859  -7.923  -4.272
  314   2HB   MET  46           HB1      MET  46  67.835  -6.841  -5.214
  315   1HG   MET  46           HG2      MET  46  68.351  -5.806  -2.532
  316   2HG   MET  46           HG1      MET  46  69.838  -6.058  -3.447
  317   1HE   MET  46           HE2      MET  46  70.786  -4.637  -4.876
  318   2HE   MET  46           HE1      MET  46  70.200  -3.039  -5.327
  319   3HE   MET  46           HE3      MET  46  70.446  -3.447  -3.624
  320    H    ARG  47           HN       ARG  47  67.858  -9.939  -3.114
  321    HA   ARG  47           HA       ARG  47  66.660 -11.289  -5.310
  322   1HB   ARG  47           HB2      ARG  47  67.865 -12.180  -2.703
  323   2HB   ARG  47           HB1      ARG  47  67.062 -13.357  -3.745
  324   1HG   ARG  47           HG2      ARG  47  68.512 -12.611  -5.637
  325   2HG   ARG  47           HG1      ARG  47  69.366 -11.546  -4.521
  326   1HD   ARG  47           HD2      ARG  47  70.734 -13.332  -4.196
  327   2HD   ARG  47           HD1      ARG  47  69.433 -13.927  -3.162
  328    HE   ARG  47           HE       ARG  47  69.747 -14.714  -6.033
  329   1HH1  ARG  47          HH21      ARG  47  67.117 -15.163  -4.520
  330   2HH1  ARG  47          HH22      ARG  47  67.302 -16.814  -4.029
  331   1HH2  ARG  47          HH11      ARG  47  70.712 -16.893  -4.654
  332   2HH2  ARG  47          HH12      ARG  47  69.336 -17.794  -4.108
  333    H    MET  48           HN       MET  48  65.523 -10.765  -1.997
  334    HA   MET  48           HA       MET  48  63.240 -12.523  -2.229
  335   1HB   MET  48           HB2      MET  48  64.215 -10.487  -0.294
  336   2HB   MET  48           HB1      MET  48  62.481 -10.814  -0.284
  337   1HG   MET  48           HG2      MET  48  63.034 -12.551   1.072
  338   2HG   MET  48           HG1      MET  48  63.507 -13.350  -0.427
  339   1HE   MET  48           HE3      MET  48  64.213 -12.102   2.813
  340   2HE   MET  48           HE2      MET  48  64.839 -13.749   2.786
  341   3HE   MET  48           HE1      MET  48  65.928 -12.406   3.125
  342    H    LEU  49           HN       LEU  49  63.838  -9.163  -3.075
  343    HA   LEU  49           HA       LEU  49  60.995  -8.562  -3.417
  344   1HB   LEU  49           HB2      LEU  49  63.214  -6.930  -4.628
  345   2HB   LEU  49           HB1      LEU  49  61.677  -6.388  -3.954
  346    HG   LEU  49           HG       LEU  49  64.138  -7.321  -2.475
  347   1HD1  LEU  49          HD13      LEU  49  63.619  -4.865  -3.188
  348   2HD1  LEU  49          HD12      LEU  49  62.419  -4.919  -1.897
  349   3HD1  LEU  49          HD11      LEU  49  64.124  -5.173  -1.526
  350   1HD2  LEU  49          HD23      LEU  49  61.302  -7.590  -1.728
  351   2HD2  LEU  49          HD22      LEU  49  62.725  -8.359  -1.027
  352   3HD2  LEU  49          HD21      LEU  49  62.272  -6.728  -0.533
  353    H    GLY  50           HN       GLY  50  61.943  -7.099  -6.052
  354   1HA   GLY  50           HA2      GLY  50  61.780  -9.505  -7.814
  355   2HA   GLY  50           HA1      GLY  50  60.717  -8.123  -8.082
  356    H    GLN  51           HN       GLN  51  64.059  -7.763  -7.049
  357    HA   GLN  51           HA       GLN  51  64.845  -7.004  -9.813
  358   1HB   GLN  51           HB2      GLN  51  65.794  -4.877  -9.037
  359   2HB   GLN  51           HB1      GLN  51  64.064  -4.929  -8.697
  360   1HG   GLN  51           HG2      GLN  51  65.304  -6.094  -6.454
  361   2HG   GLN  51           HG1      GLN  51  66.270  -4.671  -6.843
  362   1HE2  GLN  51          HE22      GLN  51  63.415  -2.428  -6.418
  363   2HE2  GLN  51          HE21      GLN  51  64.706  -2.677  -7.491
  364    H    ASN  52           HN       ASN  52  66.841  -7.816 -10.254
  365    HA   ASN  52           HA       ASN  52  68.667  -8.358  -7.950
  366   1HB   ASN  52           HB2      ASN  52  67.441 -10.392  -9.085
  367   2HB   ASN  52           HB1      ASN  52  68.634 -10.148 -10.362
  368   1HD2  ASN  52          HD22      ASN  52  69.793 -11.721  -6.789
  369   2HD2  ASN  52          HD21      ASN  52  68.196 -11.199  -7.032
  370    HA   PRO  53           HA       PRO  53  70.941  -5.825 -10.968
  371   1HB   PRO  53           HB2      PRO  53  72.314  -4.430  -9.037
  372   2HB   PRO  53           HB1      PRO  53  70.702  -3.972  -9.616
  373   1HG   PRO  53           HG2      PRO  53  71.477  -5.259  -7.038
  374   2HG   PRO  53           HG1      PRO  53  70.077  -4.240  -7.406
  375   1HD   PRO  53           HD2      PRO  53  70.059  -7.060  -7.178
  376   2HD   PRO  53           HD1      PRO  53  68.760  -6.060  -7.865
  377    H    THR  54           HN       THR  54  73.505  -5.364 -10.834
  378    HA   THR  54           HA       THR  54  74.741  -8.010 -10.430
  379    HB   THR  54           HB       THR  54  76.781  -6.404 -11.254
  380    HG1  THR  54           HG1      THR  54  75.717  -5.040 -12.859
  381   1HG2  THR  54          HG21      THR  54  74.719  -8.066 -12.590
  382   2HG2  THR  54          HG23      THR  54  75.662  -7.009 -13.643
  383   3HG2  THR  54          HG22      THR  54  76.477  -8.202 -12.633
  384    H    LYS  55           HN       LYS  55  76.518  -8.369  -9.012
  385    HA   LYS  55           HA       LYS  55  76.447  -7.313  -6.456
  386   1HB   LYS  55           HB2      LYS  55  79.067  -7.801  -6.545
  387   2HB   LYS  55           HB1      LYS  55  77.892  -9.115  -6.579
  388   1HG   LYS  55           HG2      LYS  55  78.239  -9.558  -8.816
  389   2HG   LYS  55           HG1      LYS  55  78.653  -7.884  -9.189
  390   1HD   LYS  55           HD2      LYS  55  80.841  -8.122  -8.223
  391   2HD   LYS  55           HD1      LYS  55  80.433  -9.699  -7.545
  392   1HE   LYS  55           HE2      LYS  55  80.399  -9.132 -10.517
  393   2HE   LYS  55           HE1      LYS  55  81.815  -9.767  -9.678
  394   1HZ   LYS  55           HZ1      LYS  55  79.584 -11.261  -8.896
  395   2HZ   LYS  55           HZ3      LYS  55  79.570 -11.166 -10.589
  396   3HZ   LYS  55           HZ2      LYS  55  80.937 -11.777  -9.785
  397    H    GLU  56           HN       GLU  56  78.316  -6.039  -9.209
  398    HA   GLU  56           HA       GLU  56  79.660  -3.963  -7.808
  399   1HB   GLU  56           HB2      GLU  56  80.311  -4.496 -10.072
  400   2HB   GLU  56           HB1      GLU  56  78.698  -4.118 -10.678
  401   1HG   GLU  56           HG2      GLU  56  79.191  -1.924 -10.829
  402   2HG   GLU  56           HG1      GLU  56  79.785  -1.888  -9.169
  403    H    GLU  57           HN       GLU  57  76.572  -3.830  -9.621
  404    HA   GLU  57           HA       GLU  57  75.915  -1.149  -9.080
  405   1HB   GLU  57           HB2      GLU  57  74.628  -3.320 -10.251
  406   2HB   GLU  57           HB1      GLU  57  73.599  -2.924  -8.873
  407   1HG   GLU  57           HG2      GLU  57  72.973  -0.916  -9.751
  408   2HG   GLU  57           HG1      GLU  57  74.575  -0.597 -10.420
  409    H    LEU  58           HN       LEU  58  75.899  -3.912  -6.953
  410    HA   LEU  58           HA       LEU  58  74.161  -2.784  -4.937
  411   1HB   LEU  58           HB2      LEU  58  74.797  -5.236  -5.168
  412   2HB   LEU  58           HB1      LEU  58  76.369  -4.807  -4.492
  413    HG   LEU  58           HG       LEU  58  74.638  -3.598  -2.726
  414   1HD1  LEU  58          HD12      LEU  58  72.711  -4.705  -3.816
  415   2HD1  LEU  58          HD11      LEU  58  73.462  -6.276  -3.534
  416   3HD1  LEU  58          HD13      LEU  58  72.939  -5.291  -2.168
  417   1HD2  LEU  58          HD22      LEU  58  76.482  -5.811  -2.798
  418   2HD2  LEU  58          HD21      LEU  58  76.061  -4.776  -1.435
  419   3HD2  LEU  58          HD23      LEU  58  75.114  -6.226  -1.765
  420    H    ASP  59           HN       ASP  59  77.731  -3.083  -5.116
  421    HA   ASP  59           HA       ASP  59  78.333  -1.645  -2.765
  422   1HB   ASP  59           HB2      ASP  59  79.789  -2.734  -4.884
  423   2HB   ASP  59           HB1      ASP  59  80.174  -1.012  -4.940
  424    H    ALA  60           HN       ALA  60  77.999  -0.371  -6.098
  425    HA   ALA  60           HA       ALA  60  78.436   2.357  -5.472
  426   1HB   ALA  60           HB3      ALA  60  77.303   0.830  -7.690
  427   2HB   ALA  60           HB2      ALA  60  76.493   2.381  -7.471
  428   3HB   ALA  60           HB1      ALA  60  78.238   2.326  -7.725
  429    H    ILE  61           HN       ILE  61  75.636   0.317  -4.988
  430    HA   ILE  61           HA       ILE  61  73.755   2.467  -4.516
  431    HB   ILE  61           HB       ILE  61  73.804  -0.498  -4.013
  432   1HG1  ILE  61          HG12      ILE  61  71.953   1.371  -5.525
  433   2HG1  ILE  61          HG11      ILE  61  73.211   0.363  -6.241
  434   1HG2  ILE  61          HG23      ILE  61  71.810   1.492  -2.904
  435   2HG2  ILE  61          HG22      ILE  61  71.432  -0.218  -3.130
  436   3HG2  ILE  61          HG21      ILE  61  72.716   0.264  -2.019
  437   1HD1  ILE  61          HD11      ILE  61  71.445  -1.189  -4.523
  438   2HD1  ILE  61          HD13      ILE  61  70.553  -0.380  -5.810
  439   3HD1  ILE  61          HD12      ILE  61  71.888  -1.463  -6.208
  440    H    ILE  62           HN       ILE  62  75.251   0.152  -2.224
  441    HA   ILE  62           HA       ILE  62  74.502   1.528   0.137
  442    HB   ILE  62           HB       ILE  62  76.866  -0.269  -0.459
  443   1HG1  ILE  62          HG12      ILE  62  74.968  -1.373   1.354
  444   2HG1  ILE  62          HG11      ILE  62  74.062  -0.692   0.000
  445   1HG2  ILE  62          HG21      ILE  62  75.946   1.040   2.093
  446   2HG2  ILE  62          HG23      ILE  62  76.776  -0.517   2.130
  447   3HG2  ILE  62          HG22      ILE  62  77.582   0.898   1.452
  448   1HD1  ILE  62          HD11      ILE  62  75.880  -1.877  -1.470
  449   2HD1  ILE  62          HD13      ILE  62  76.158  -2.847  -0.024
  450   3HD1  ILE  62          HD12      ILE  62  74.568  -2.838  -0.786
  451    H    GLU  63           HN       GLU  63  76.892   2.315  -2.225
  452    HA   GLU  63           HA       GLU  63  78.690   3.804  -0.550
  453   1HB   GLU  63           HB2      GLU  63  78.136   3.615  -3.475
  454   2HB   GLU  63           HB1      GLU  63  79.015   5.036  -2.905
  455   1HG   GLU  63           HG2      GLU  63  79.992   2.570  -1.679
  456   2HG   GLU  63           HG1      GLU  63  80.130   2.543  -3.436
  457    H    GLU  64           HN       GLU  64  75.662   4.645  -2.174
  458    HA   GLU  64           HA       GLU  64  75.958   7.437  -1.173
  459   1HB   GLU  64           HB2      GLU  64  74.508   6.170  -3.434
  460   2HB   GLU  64           HB1      GLU  64  73.691   7.517  -2.643
  461   1HG   GLU  64           HG2      GLU  64  75.919   8.780  -2.855
  462   2HG   GLU  64           HG1      GLU  64  76.401   7.506  -3.977
  463    H    VAL  65           HN       VAL  65  74.340   4.487  -0.503
  464    HA   VAL  65           HA       VAL  65  71.981   5.672   0.734
  465    HB   VAL  65           HB       VAL  65  73.183   2.904   1.064
  466   1HG1  VAL  65          HG13      VAL  65  71.007   4.267   2.383
  467   2HG1  VAL  65          HG12      VAL  65  70.380   2.923   1.429
  468   3HG1  VAL  65          HG11      VAL  65  71.613   2.633   2.655
  469   1HG2  VAL  65          HG22      VAL  65  72.459   3.647  -1.276
  470   2HG2  VAL  65          HG21      VAL  65  71.670   2.200  -0.646
  471   3HG2  VAL  65          HG23      VAL  65  70.821   3.746  -0.629
  472    H    ASP  66           HN       ASP  66  75.209   4.766   1.789
  473    HA   ASP  66           HA       ASP  66  74.530   5.131   4.628
  474   1HB   ASP  66           HB2      ASP  66  76.976   4.351   3.084
  475   2HB   ASP  66           HB1      ASP  66  77.176   4.974   4.721
  476    H    GLU  67           HN       GLU  67  73.746   7.424   3.976
  477    HA   GLU  67           HA       GLU  67  75.689   9.441   3.318
  478   1HB   GLU  67           HB2      GLU  67  73.958  11.040   3.958
  479   2HB   GLU  67           HB1      GLU  67  73.221   9.725   3.041
  480   1HG   GLU  67           HG2      GLU  67  71.772   9.582   4.783
  481   2HG   GLU  67           HG1      GLU  67  73.094   8.765   5.618
  482    H    ASP  68           HN       ASP  68  75.135   7.674   6.171
  483    HA   ASP  68           HA       ASP  68  76.364   9.802   7.858
  484   1HB   ASP  68           HB2      ASP  68  75.803   8.000   9.692
  485   2HB   ASP  68           HB1      ASP  68  74.510   9.000   9.030
  486    H    GLY  69           HN       GLY  69  77.038   6.802   6.292
  487   1HA   GLY  69           HA2      GLY  69  79.048   5.594   6.144
  488   2HA   GLY  69           HA1      GLY  69  79.834   6.943   6.964
  489    H    SER  70           HN       SER  70  77.100   5.178   8.318
  490    HA   SER  70           HA       SER  70  78.661   4.605  10.725
  491   1HB   SER  70           HB2      SER  70  76.495   3.459  11.430
  492   2HB   SER  70           HB1      SER  70  76.365   5.180  11.078
  493    HG   SER  70           HG       SER  70  75.839   3.084   9.231
  494    H    GLY  71           HN       GLY  71  77.681   2.893   7.842
  495   1HA   GLY  71           HA2      GLY  71  78.732   0.872   7.082
  496   2HA   GLY  71           HA1      GLY  71  79.300   0.579   8.726
  497    H    THR  72           HN       THR  72  75.975   1.474   8.183
  498    HA   THR  72           HA       THR  72  75.062  -1.330   8.227
  499    HB   THR  72           HB       THR  72  73.565  -0.691  10.258
  500    HG1  THR  72           HG1      THR  72  74.840   0.787  11.627
  501   1HG2  THR  72          HG23      THR  72  75.456  -2.351  10.235
  502   2HG2  THR  72          HG22      THR  72  76.535  -1.046  10.723
  503   3HG2  THR  72          HG21      THR  72  75.225  -1.552  11.789
  504    H    ILE  73           HN       ILE  73  72.883  -1.520   7.537
  505    HA   ILE  73           HA       ILE  73  71.750   1.000   6.409
  506    HB   ILE  73           HB       ILE  73  71.279  -1.911   5.709
  507   1HG1  ILE  73          HG12      ILE  73  73.420  -0.704   4.972
  508   2HG1  ILE  73          HG11      ILE  73  72.447  -1.421   3.689
  509   1HG2  ILE  73          HG21      ILE  73  69.666   0.476   5.235
  510   2HG2  ILE  73          HG23      ILE  73  70.153  -0.304   3.730
  511   3HG2  ILE  73          HG22      ILE  73  69.268  -1.217   4.952
  512   1HD1  ILE  73          HD12      ILE  73  71.535   1.268   4.246
  513   2HD1  ILE  73          HD11      ILE  73  73.262   1.269   3.895
  514   3HD1  ILE  73          HD13      ILE  73  72.127   0.591   2.728
  515    H    ASP  74           HN       ASP  74  69.589   1.560   6.856
  516    HA   ASP  74           HA       ASP  74  68.149  -0.160   8.827
  517   1HB   ASP  74           HB2      ASP  74  69.207   2.528   9.225
  518   2HB   ASP  74           HB1      ASP  74  67.463   2.470   9.480
  519    H    PHE  75           HN       PHE  75  65.788   0.315   8.862
  520    HA   PHE  75           HA       PHE  75  64.518   0.247   6.423
  521   1HB   PHE  75           HB2      PHE  75  63.474   0.026   8.742
  522   2HB   PHE  75           HB1      PHE  75  63.367   1.785   8.758
  523    HD1  PHE  75           HD2      PHE  75  62.894  -0.698   6.005
  524    HD2  PHE  75           HD1      PHE  75  61.124   2.371   8.427
  525    HE1  PHE  75           HE2      PHE  75  60.823  -0.814   4.638
  526    HE2  PHE  75           HE1      PHE  75  59.054   2.258   7.063
  527    HZ   PHE  75           HZ       PHE  75  58.905   0.666   5.169
  528    H    GLU  76           HN       GLU  76  65.267   3.218   8.259
  529    HA   GLU  76           HA       GLU  76  64.110   5.081   6.486
  530   1HB   GLU  76           HB2      GLU  76  66.109   5.132   8.620
  531   2HB   GLU  76           HB1      GLU  76  66.430   6.332   7.368
  532   1HG   GLU  76           HG2      GLU  76  63.742   6.632   7.651
  533   2HG   GLU  76           HG1      GLU  76  64.186   6.168   9.294
  534    H    GLU  77           HN       GLU  77  67.520   3.958   6.511
  535    HA   GLU  77           HA       GLU  77  68.182   5.292   4.051
  536   1HB   GLU  77           HB2      GLU  77  69.488   2.860   5.313
  537   2HB   GLU  77           HB1      GLU  77  70.206   3.897   4.079
  538   1HG   GLU  77           HG2      GLU  77  70.028   5.830   5.636
  539   2HG   GLU  77           HG1      GLU  77  69.390   4.749   6.875
  540    H    PHE  78           HN       PHE  78  66.349   2.485   4.698
  541    HA   PHE  78           HA       PHE  78  66.947   0.963   2.332
  542   1HB   PHE  78           HB2      PHE  78  65.330   0.633   4.586
  543   2HB   PHE  78           HB1      PHE  78  64.191   0.709   3.241
  544    HD1  PHE  78           HD2      PHE  78  64.461  -0.843   1.291
  545    HD2  PHE  78           HD1      PHE  78  66.788  -1.238   4.878
  546    HE1  PHE  78           HE2      PHE  78  65.068  -3.159   0.641
  547    HE2  PHE  78           HE1      PHE  78  67.395  -3.554   4.230
  548    HZ   PHE  78           HZ       PHE  78  66.535  -4.514   2.110
  549    H    LEU  79           HN       LEU  79  64.048   2.937   3.066
  550    HA   LEU  79           HA       LEU  79  62.847   2.985   0.581
  551   1HB   LEU  79           HB2      LEU  79  63.222   5.413   2.362
  552   2HB   LEU  79           HB1      LEU  79  61.963   5.199   1.147
  553    HG   LEU  79           HG       LEU  79  62.353   3.508   3.632
  554   1HD1  LEU  79          HD12      LEU  79  60.557   5.769   2.866
  555   2HD1  LEU  79          HD11      LEU  79  59.871   4.473   3.845
  556   3HD1  LEU  79          HD13      LEU  79  61.265   5.380   4.434
  557   1HD2  LEU  79          HD22      LEU  79  60.835   3.115   1.125
  558   2HD2  LEU  79          HD21      LEU  79  61.361   1.928   2.317
  559   3HD2  LEU  79          HD23      LEU  79  59.900   2.870   2.599
  560    H    VAL  80           HN       VAL  80  65.799   4.649   1.536
  561    HA   VAL  80           HA       VAL  80  65.978   6.344  -0.794
  562    HB   VAL  80           HB       VAL  80  68.075   5.303   1.130
  563   1HG1  VAL  80          HG12      VAL  80  68.325   7.391  -1.056
  564   2HG1  VAL  80          HG11      VAL  80  69.558   7.022   0.150
  565   3HG1  VAL  80          HG13      VAL  80  69.105   5.810  -1.048
  566   1HG2  VAL  80          HG22      VAL  80  66.629   7.948   0.805
  567   2HG2  VAL  80          HG21      VAL  80  66.508   6.831   2.165
  568   3HG2  VAL  80          HG23      VAL  80  68.010   7.709   1.877
  569    H    MET  81           HN       MET  81  67.445   3.200   0.037
  570    HA   MET  81           HA       MET  81  68.918   2.784  -2.324
  571   1HB   MET  81           HB2      MET  81  68.458   1.316  -0.087
  572   2HB   MET  81           HB1      MET  81  67.482   0.421  -1.253
  573   1HG   MET  81           HG2      MET  81  69.374   0.111  -2.711
  574   2HG   MET  81           HG1      MET  81  70.361   1.210  -1.748
  575   1HE   MET  81           HE3      MET  81  70.366   1.113   0.591
  576   2HE   MET  81           HE2      MET  81  69.877  -0.227   1.624
  577   3HE   MET  81           HE1      MET  81  71.544  -0.115   1.068
  578    H    MET  82           HN       MET  82  65.497   2.035  -1.662
  579    HA   MET  82           HA       MET  82  64.890   0.758  -4.113
  580   1HB   MET  82           HB2      MET  82  63.016   2.617  -2.629
  581   2HB   MET  82           HB1      MET  82  62.587   1.232  -3.634
  582   1HG   MET  82           HG2      MET  82  63.994   1.185  -0.952
  583   2HG   MET  82           HG1      MET  82  62.407   0.522  -1.340
  584   1HE   MET  82           HE1      MET  82  61.918  -1.351  -2.846
  585   2HE   MET  82           HE3      MET  82  62.885  -0.778  -4.213
  586   3HE   MET  82           HE2      MET  82  63.070  -2.430  -3.629
  587    H    VAL  83           HN       VAL  83  64.097   4.170  -3.337
  588    HA   VAL  83           HA       VAL  83  63.562   4.920  -6.022
  589    HB   VAL  83           HB       VAL  83  64.657   6.714  -3.839
  590   1HG1  VAL  83          HG11      VAL  83  63.455   7.108  -6.521
  591   2HG1  VAL  83          HG13      VAL  83  62.832   8.158  -5.247
  592   3HG1  VAL  83          HG12      VAL  83  64.556   8.146  -5.617
  593   1HG2  VAL  83          HG21      VAL  83  62.241   5.172  -3.930
  594   2HG2  VAL  83          HG23      VAL  83  62.747   6.337  -2.706
  595   3HG2  VAL  83          HG22      VAL  83  61.821   6.875  -4.107
  596    H    ARG  84           HN       ARG  84  66.554   4.248  -4.478
  597    HA   ARG  84           HA       ARG  84  68.261   5.978  -6.018
  598   1HB   ARG  84           HB2      ARG  84  68.581   3.719  -4.176
  599   2HB   ARG  84           HB1      ARG  84  69.793   3.741  -5.456
  600   1HG   ARG  84           HG2      ARG  84  69.690   6.391  -4.745
  601   2HG   ARG  84           HG1      ARG  84  69.417   5.593  -3.195
  602   1HD   ARG  84           HD2      ARG  84  71.580   4.986  -3.064
  603   2HD   ARG  84           HD1      ARG  84  71.509   4.235  -4.657
  604    HE   ARG  84           HE       ARG  84  72.224   7.086  -4.150
  605   1HH1  ARG  84          HH21      ARG  84  71.248   7.233  -6.767
  606   2HH1  ARG  84          HH22      ARG  84  72.509   6.621  -7.784
  607   1HH2  ARG  84          HH11      ARG  84  74.180   5.026  -5.198
  608   2HH2  ARG  84          HH12      ARG  84  74.171   5.372  -6.895
  609    H    GLN  85           HN       GLN  85  68.118   2.418  -6.334
  610    HA   GLN  85           HA       GLN  85  68.932   2.619  -9.134
  611   1HB   GLN  85           HB2      GLN  85  68.767   0.147  -9.097
  612   2HB   GLN  85           HB1      GLN  85  69.718   0.753  -7.740
  613   1HG   GLN  85           HG2      GLN  85  68.332  -0.624  -6.543
  614   2HG   GLN  85           HG1      GLN  85  67.263   0.778  -6.611
  615   1HE2  GLN  85          HE22      GLN  85  64.880  -0.820  -8.660
  616   2HE2  GLN  85          HE21      GLN  85  65.314   0.578  -7.802
  617    H    MET  86           HN       MET  86  66.062   3.266  -7.753
  618    HA   MET  86           HA       MET  86  64.186   1.699  -9.244
  619   1HB   MET  86           HB2      MET  86  64.132   4.175  -7.634
  620   2HB   MET  86           HB1      MET  86  62.886   4.078  -8.878
  621   1HG   MET  86           HG2      MET  86  63.332   1.622  -7.265
  622   2HG   MET  86           HG1      MET  86  62.583   2.982  -6.429
  623   1HE   MET  86           HE3      MET  86  60.413   3.958  -6.818
  624   2HE   MET  86           HE2      MET  86  59.094   2.895  -7.302
  625   3HE   MET  86           HE1      MET  86  60.201   2.390  -6.029
  626    H    LYS  87           HN       LYS  87  65.946   4.674  -9.991
  627    HA   LYS  87           HA       LYS  87  64.579   4.792 -12.635
  628   1HB   LYS  87           HB2      LYS  87  66.364   6.769 -11.185
  629   2HB   LYS  87           HB1      LYS  87  65.745   7.017 -12.818
  630   1HG   LYS  87           HG2      LYS  87  63.451   6.932 -12.018
  631   2HG   LYS  87           HG1      LYS  87  63.996   6.516 -10.392
  632   1HD   LYS  87           HD2      LYS  87  65.221   8.694 -10.293
  633   2HD   LYS  87           HD1      LYS  87  64.537   9.111 -11.865
  634   1HE   LYS  87           HE2      LYS  87  62.608   8.213  -9.790
  635   2HE   LYS  87           HE1      LYS  87  63.355   9.790  -9.534
  636   1HZ   LYS  87           HZ1      LYS  87  62.685  10.407 -11.790
  637   2HZ   LYS  87           HZ3      LYS  87  61.910   8.909 -11.973
  638   3HZ   LYS  87           HZ2      LYS  87  61.345  10.019 -10.818
  639    H    GLU  88           HN       GLU  88  67.595   3.976 -11.126
  640    HA   GLU  88           HA       GLU  88  69.592   3.145 -12.035
  641   1HB   GLU  88           HB2      GLU  88  67.696   2.719 -14.358
  642   2HB   GLU  88           HB1      GLU  88  69.376   2.182 -14.383
  643   1HG   GLU  88           HG2      GLU  88  68.448   1.266 -11.929
  644   2HG   GLU  88           HG1      GLU  88  67.079   1.008 -13.012
  645    H    ASP  89           HN       ASP  89  68.515   4.276 -15.184
  646    HA   ASP  89           HA       ASP  89  70.473   6.528 -14.960
  647   1HB   ASP  89           HB2      ASP  89  70.632   4.291 -16.651
  648   2HB   ASP  89           HB1      ASP  89  70.077   5.610 -17.683
  649    H    ALA  90           HN       ALA  90  68.536   7.808 -14.376
  650    HA   ALA  90           HA       ALA  90  67.263   8.906 -16.794
  651   1HB   ALA  90           HB3      ALA  90  65.900   6.933 -15.438
  652   2HB   ALA  90           HB2      ALA  90  65.278   8.399 -14.680
  653   3HB   ALA  90           HB1      ALA  90  65.142   8.183 -16.426
   
  No H/Q in entry =         653
  Start of MODEL   31
    1   1H    ALA   1           HT3      ALA   1  68.455  13.082  14.805
    2   2H    ALA   1           HT2      ALA   1  66.920  12.407  15.075
    3   3H    ALA   1           HT1      ALA   1  68.281  11.770  15.865
    4    HA   ALA   1           HA       ALA   1  68.943  10.566  14.106
    5   1HB   ALA   1           HB2      ALA   1  66.024  11.159  13.576
    6   2HB   ALA   1           HB1      ALA   1  66.932   9.978  12.633
    7   3HB   ALA   1           HB3      ALA   1  66.717   9.743  14.367
    8    H    SER   2           HN       SER   2  67.251  13.494  13.012
    9    HA   SER   2           HA       SER   2  67.838  14.969  11.272
   10   1HB   SER   2           HB2      SER   2  70.252  13.786  11.967
   11   2HB   SER   2           HB1      SER   2  70.128  13.463  10.241
   12    HG   SER   2           HG       SER   2  69.770  15.994  11.484
   13    H    MET   3           HN       MET   3  67.880  14.951   8.843
   14    HA   MET   3           HA       MET   3  67.219  12.330   7.623
   15   1HB   MET   3           HB2      MET   3  65.138  13.151   6.658
   16   2HB   MET   3           HB1      MET   3  65.066  13.338   8.410
   17   1HG   MET   3           HG2      MET   3  66.131  15.722   7.799
   18   2HG   MET   3           HG1      MET   3  65.273  15.422   6.288
   19   1HE   MET   3           HE3      MET   3  65.391  16.085   9.831
   20   2HE   MET   3           HE2      MET   3  63.753  16.359  10.421
   21   3HE   MET   3           HE1      MET   3  64.361  14.712  10.259
   22    H    THR   4           HN       THR   4  68.715  12.295   6.006
   23    HA   THR   4           HA       THR   4  69.800  14.661   4.777
   24    HB   THR   4           HB       THR   4  70.284  12.658   2.955
   25    HG1  THR   4           HG1      THR   4  70.469  11.343   5.406
   26   1HG2  THR   4          HG22      THR   4  71.790  14.205   4.465
   27   2HG2  THR   4          HG21      THR   4  71.886  12.771   5.488
   28   3HG2  THR   4          HG23      THR   4  72.444  12.701   3.814
   29    H    ASP   5           HN       ASP   5  69.506  15.299   2.505
   30    HA   ASP   5           HA       ASP   5  66.721  15.455   1.775
   31   1HB   ASP   5           HB2      ASP   5  67.634  16.489  -0.342
   32   2HB   ASP   5           HB1      ASP   5  68.188  17.262   1.144
   33    H    GLN   6           HN       GLN   6  69.322  13.270   0.939
   34    HA   GLN   6           HA       GLN   6  68.319  12.218  -1.491
   35   1HB   GLN   6           HB2      GLN   6  70.501  11.544  -0.834
   36   2HB   GLN   6           HB1      GLN   6  69.945  11.012   0.754
   37   1HG   GLN   6           HG2      GLN   6  68.764   9.149  -0.201
   38   2HG   GLN   6           HG1      GLN   6  69.041   9.743  -1.838
   39   1HE2  GLN   6          HE21      GLN   6  70.465   8.200  -2.724
   40   2HE2  GLN   6          HE22      GLN   6  71.932   7.735  -2.009
   41    H    GLN   7           HN       GLN   7  67.672  11.205   1.878
   42    HA   GLN   7           HA       GLN   7  65.711   9.220   1.036
   43   1HB   GLN   7           HB2      GLN   7  65.236   9.014   3.452
   44   2HB   GLN   7           HB1      GLN   7  66.972   8.952   3.139
   45   1HG   GLN   7           HG2      GLN   7  67.106  11.396   3.652
   46   2HG   GLN   7           HG1      GLN   7  65.399  11.360   4.093
   47   1HE2  GLN   7          HE22      GLN   7  68.065   9.369   6.523
   48   2HE2  GLN   7          HE21      GLN   7  68.436   9.561   4.877
   49    H    ALA   8           HN       ALA   8  65.682  12.613   1.574
   50    HA   ALA   8           HA       ALA   8  62.935  12.915   2.383
   51   1HB   ALA   8           HB3      ALA   8  64.761  14.686   2.507
   52   2HB   ALA   8           HB2      ALA   8  64.557  14.900   0.769
   53   3HB   ALA   8           HB1      ALA   8  63.216  15.242   1.865
   54    H    GLU   9           HN       GLU   9  64.524  13.111  -0.817
   55    HA   GLU   9           HA       GLU   9  62.036  13.484  -2.242
   56   1HB   GLU   9           HB2      GLU   9  64.753  13.596  -2.884
   57   2HB   GLU   9           HB1      GLU   9  64.145  12.223  -3.811
   58   1HG   GLU   9           HG2      GLU   9  63.541  13.851  -5.300
   59   2HG   GLU   9           HG1      GLU   9  62.142  14.001  -4.236
   60    H    ALA  10           HN       ALA  10  63.918  10.673  -1.251
   61    HA   ALA  10           HA       ALA  10  62.594   8.738  -2.897
   62   1HB   ALA  10           HB2      ALA  10  64.373   8.721  -0.557
   63   2HB   ALA  10           HB1      ALA  10  63.243   7.369  -0.589
   64   3HB   ALA  10           HB3      ALA  10  64.335   7.636  -1.947
   65    H    ARG  11           HN       ARG  11  61.904   9.933   0.391
   66    HA   ARG  11           HA       ARG  11  59.633   8.209   0.807
   67   1HB   ARG  11           HB2      ARG  11  61.070  10.050   2.340
   68   2HB   ARG  11           HB1      ARG  11  59.462  10.762   2.203
   69   1HG   ARG  11           HG2      ARG  11  58.766   9.335   3.799
   70   2HG   ARG  11           HG1      ARG  11  59.030   8.017   2.657
   71   1HD   ARG  11           HD2      ARG  11  60.300   7.528   4.658
   72   2HD   ARG  11           HD1      ARG  11  61.440   7.965   3.385
   73    HE   ARG  11           HE       ARG  11  61.415  10.296   4.466
   74   1HH1  ARG  11          HH21      ARG  11  60.242  10.895   6.644
   75   2HH1  ARG  11          HH22      ARG  11  60.864   9.982   7.978
   76   1HH2  ARG  11          HH11      ARG  11  62.402   7.603   5.980
   77   2HH2  ARG  11          HH12      ARG  11  62.088   8.121   7.603
   78    H    ALA  12           HN       ALA  12  60.088  11.227  -0.878
   79    HA   ALA  12           HA       ALA  12  57.261  11.936  -0.923
   80   1HB   ALA  12           HB3      ALA  12  59.450  13.403  -1.339
   81   2HB   ALA  12           HB2      ALA  12  59.155  12.930  -3.012
   82   3HB   ALA  12           HB1      ALA  12  57.918  13.807  -2.113
   83    H    PHE  13           HN       PHE  13  59.420  10.001  -2.894
   84    HA   PHE  13           HA       PHE  13  57.451   9.798  -5.079
   85   1HB   PHE  13           HB2      PHE  13  59.892   9.828  -5.564
   86   2HB   PHE  13           HB1      PHE  13  60.070   8.320  -4.665
   87    HD1  PHE  13           HD2      PHE  13  58.686   6.294  -5.428
   88    HD2  PHE  13           HD1      PHE  13  59.248   9.806  -7.833
   89    HE1  PHE  13           HE2      PHE  13  58.044   5.011  -7.451
   90    HE2  PHE  13           HE1      PHE  13  58.606   8.524  -9.856
   91    HZ   PHE  13           HZ       PHE  13  58.003   6.127  -9.666
   92    H    LEU  14           HN       LEU  14  58.431   8.039  -2.231
   93    HA   LEU  14           HA       LEU  14  56.909   5.640  -3.075
   94   1HB   LEU  14           HB2      LEU  14  58.458   6.182  -0.521
   95   2HB   LEU  14           HB1      LEU  14  57.778   4.629  -1.011
   96    HG   LEU  14           HG       LEU  14  59.823   6.167  -2.636
   97   1HD1  LEU  14          HD13      LEU  14  60.099   4.387  -0.319
   98   2HD1  LEU  14          HD12      LEU  14  61.013   3.841  -1.725
   99   3HD1  LEU  14          HD11      LEU  14  61.290   5.453  -1.064
  100   1HD2  LEU  14          HD22      LEU  14  58.064   4.117  -3.338
  101   2HD2  LEU  14          HD21      LEU  14  59.529   4.571  -4.210
  102   3HD2  LEU  14          HD23      LEU  14  59.582   3.280  -3.008
  103    H    SER  15           HN       SER  15  54.757   5.622  -2.664
  104    HA   SER  15           HA       SER  15  53.554   7.502  -0.789
  105   1HB   SER  15           HB2      SER  15  52.482   6.653  -2.940
  106   2HB   SER  15           HB1      SER  15  52.220   5.125  -2.107
  107    HG   SER  15           HG       SER  15  50.532   6.916  -2.057
  108    H    GLU  16           HN       GLU  16  52.032   6.662   0.953
  109    HA   GLU  16           HA       GLU  16  53.441   5.068   2.835
  110   1HB   GLU  16           HB2      GLU  16  50.433   5.419   2.737
  111   2HB   GLU  16           HB1      GLU  16  51.432   5.124   4.160
  112   1HG   GLU  16           HG2      GLU  16  52.532   7.407   2.933
  113   2HG   GLU  16           HG1      GLU  16  50.784   7.642   2.888
  114    H    GLU  17           HN       GLU  17  51.238   4.193   0.257
  115    HA   GLU  17           HA       GLU  17  50.663   1.524   1.184
  116   1HB   GLU  17           HB2      GLU  17  50.164   3.130  -1.201
  117   2HB   GLU  17           HB1      GLU  17  50.531   1.452  -1.600
  118   1HG   GLU  17           HG2      GLU  17  48.722   0.626  -0.345
  119   2HG   GLU  17           HG1      GLU  17  48.582   2.108   0.600
  120    H    MET  18           HN       MET  18  53.104   2.853  -1.054
  121    HA   MET  18           HA       MET  18  54.291   0.291  -1.649
  122   1HB   MET  18           HB2      MET  18  54.892   3.128  -2.179
  123   2HB   MET  18           HB1      MET  18  56.316   2.096  -2.051
  124   1HG   MET  18           HG2      MET  18  54.658   0.538  -3.576
  125   2HG   MET  18           HG1      MET  18  54.217   2.156  -4.124
  126   1HE   MET  18           HE2      MET  18  55.438   3.573  -5.576
  127   2HE   MET  18           HE1      MET  18  56.645   2.899  -6.668
  128   3HE   MET  18           HE3      MET  18  55.069   2.115  -6.491
  129    H    ILE  19           HN       ILE  19  54.769   2.679   0.889
  130    HA   ILE  19           HA       ILE  19  57.241   1.499   1.868
  131    HB   ILE  19           HB       ILE  19  55.273   3.489   3.015
  132   1HG1  ILE  19          HG12      ILE  19  58.057   4.278   2.763
  133   2HG1  ILE  19          HG11      ILE  19  57.436   3.672   1.227
  134   1HG2  ILE  19          HG23      ILE  19  57.843   2.463   4.261
  135   2HG2  ILE  19          HG22      ILE  19  56.871   3.802   4.873
  136   3HG2  ILE  19          HG21      ILE  19  56.217   2.164   4.873
  137   1HD1  ILE  19          HD11      ILE  19  55.375   5.268   2.287
  138   2HD1  ILE  19          HD13      ILE  19  56.861   6.178   2.561
  139   3HD1  ILE  19          HD12      ILE  19  56.429   5.664   0.930
  140    H    ALA  20           HN       ALA  20  53.879   0.800   2.212
  141    HA   ALA  20           HA       ALA  20  53.948  -0.493   4.775
  142   1HB   ALA  20           HB3      ALA  20  52.066  -0.179   2.590
  143   2HB   ALA  20           HB2      ALA  20  52.035  -1.830   3.208
  144   3HB   ALA  20           HB1      ALA  20  51.744  -0.476   4.299
  145    H    GLU  21           HN       GLU  21  54.546  -1.636   1.469
  146    HA   GLU  21           HA       GLU  21  54.929  -4.403   2.304
  147   1HB   GLU  21           HB2      GLU  21  55.274  -2.850  -0.237
  148   2HB   GLU  21           HB1      GLU  21  56.069  -4.418  -0.090
  149   1HG   GLU  21           HG2      GLU  21  54.064  -5.577   0.041
  150   2HG   GLU  21           HG1      GLU  21  53.188  -4.196   0.702
  151    H    PHE  22           HN       PHE  22  57.049  -1.661   1.502
  152    HA   PHE  22           HA       PHE  22  59.527  -3.045   1.678
  153   1HB   PHE  22           HB2      PHE  22  59.028  -0.178   2.523
  154   2HB   PHE  22           HB1      PHE  22  60.546  -0.872   1.952
  155    HD1  PHE  22           HD1      PHE  22  59.131  -2.653  -0.199
  156    HD2  PHE  22           HD2      PHE  22  58.942   1.528   0.766
  157    HE1  PHE  22           HE1      PHE  22  58.486  -2.142  -2.538
  158    HE2  PHE  22           HE2      PHE  22  58.297   2.038  -1.573
  159    HZ   PHE  22           HZ       PHE  22  58.068   0.204  -3.225
  160    H    LYS  23           HN       LYS  23  57.357  -1.841   4.156
  161    HA   LYS  23           HA       LYS  23  59.210  -1.924   6.348
  162   1HB   LYS  23           HB2      LYS  23  56.576  -1.158   6.029
  163   2HB   LYS  23           HB1      LYS  23  56.433  -2.620   7.006
  164   1HG   LYS  23           HG2      LYS  23  58.561  -0.694   7.794
  165   2HG   LYS  23           HG1      LYS  23  56.894  -0.198   8.092
  166   1HD   LYS  23           HD2      LYS  23  56.552  -1.815   9.680
  167   2HD   LYS  23           HD1      LYS  23  57.585  -2.985   8.857
  168   1HE   LYS  23           HE2      LYS  23  59.551  -2.080   9.769
  169   2HE   LYS  23           HE1      LYS  23  58.782  -0.536  10.137
  170   1HZ   LYS  23           HZ2      LYS  23  57.326  -2.384  11.529
  171   2HZ   LYS  23           HZ1      LYS  23  58.933  -2.905  11.719
  172   3HZ   LYS  23           HZ3      LYS  23  58.494  -1.332  12.175
  173    H    ALA  24           HN       ALA  24  56.837  -4.308   5.158
  174    HA   ALA  24           HA       ALA  24  57.381  -6.341   7.052
  175   1HB   ALA  24           HB2      ALA  24  56.052  -6.124   4.468
  176   2HB   ALA  24           HB1      ALA  24  56.863  -7.679   4.655
  177   3HB   ALA  24           HB3      ALA  24  55.661  -7.162   5.839
  178    H    ALA  25           HN       ALA  25  58.817  -5.870   3.806
  179    HA   ALA  25           HA       ALA  25  60.643  -8.040   3.943
  180   1HB   ALA  25           HB2      ALA  25  60.248  -5.679   2.274
  181   2HB   ALA  25           HB1      ALA  25  61.958  -6.059   2.484
  182   3HB   ALA  25           HB3      ALA  25  60.860  -7.273   1.829
  183    H    PHE  26           HN       PHE  26  60.895  -4.720   5.154
  184    HA   PHE  26           HA       PHE  26  63.630  -4.618   5.774
  185   1HB   PHE  26           HB2      PHE  26  61.893  -2.782   6.088
  186   2HB   PHE  26           HB1      PHE  26  61.451  -3.578   7.597
  187    HD1  PHE  26           HD1      PHE  26  64.646  -2.703   5.825
  188    HD2  PHE  26           HD2      PHE  26  62.407  -2.633   9.490
  189    HE1  PHE  26           HE1      PHE  26  66.547  -1.588   6.964
  190    HE2  PHE  26           HE2      PHE  26  64.308  -1.518  10.630
  191    HZ   PHE  26           HZ       PHE  26  66.378  -0.995   9.368
  192    H    ASP  27           HN       ASP  27  61.195  -5.283   8.304
  193    HA   ASP  27           HA       ASP  27  62.907  -6.414  10.185
  194   1HB   ASP  27           HB2      ASP  27  60.037  -7.134   9.536
  195   2HB   ASP  27           HB1      ASP  27  60.888  -7.728  10.962
  196    H    MET  28           HN       MET  28  61.825  -7.798   7.182
  197    HA   MET  28           HA       MET  28  62.227 -10.559   7.735
  198   1HB   MET  28           HB2      MET  28  61.635  -8.995   5.473
  199   2HB   MET  28           HB1      MET  28  63.122  -9.853   5.068
  200   1HG   MET  28           HG2      MET  28  60.529 -11.082   6.039
  201   2HG   MET  28           HG1      MET  28  61.245 -11.252   4.435
  202   1HE   MET  28           HE3      MET  28  64.064 -11.531   4.652
  203   2HE   MET  28           HE2      MET  28  64.472 -13.205   5.015
  204   3HE   MET  28           HE1      MET  28  63.218 -12.849   3.830
  205    H    PHE  29           HN       PHE  29  64.523  -8.212   6.291
  206    HA   PHE  29           HA       PHE  29  66.738 -10.102   6.597
  207   1HB   PHE  29           HB2      PHE  29  67.223  -7.201   6.071
  208   2HB   PHE  29           HB1      PHE  29  67.980  -8.615   5.340
  209    HD1  PHE  29           HD1      PHE  29  66.509 -10.087   3.796
  210    HD2  PHE  29           HD2      PHE  29  65.481  -6.081   4.957
  211    HE1  PHE  29           HE1      PHE  29  64.943  -9.933   1.879
  212    HE2  PHE  29           HE2      PHE  29  63.914  -5.927   3.042
  213    HZ   PHE  29           HZ       PHE  29  63.646  -7.853   1.502
  214    H    ASP  30           HN       ASP  30  65.112  -8.127   8.727
  215    HA   ASP  30           HA       ASP  30  67.483  -7.275  10.259
  216   1HB   ASP  30           HB2      ASP  30  64.954  -6.230   9.994
  217   2HB   ASP  30           HB1      ASP  30  64.840  -7.064  11.545
  218    H    ALA  31           HN       ALA  31  68.101  -9.674  10.439
  219    HA   ALA  31           HA       ALA  31  66.554 -11.476  12.033
  220   1HB   ALA  31           HB1      ALA  31  69.485 -11.285  11.353
  221   2HB   ALA  31           HB3      ALA  31  68.895 -12.515  12.471
  222   3HB   ALA  31           HB2      ALA  31  68.304 -12.478  10.811
  223    H    ASP  32           HN       ASP  32  69.229  -9.276  12.913
  224    HA   ASP  32           HA       ASP  32  69.086  -9.896  15.731
  225   1HB   ASP  32           HB2      ASP  32  70.621  -8.073  16.032
  226   2HB   ASP  32           HB1      ASP  32  71.065  -8.858  14.515
  227    H    GLY  33           HN       GLY  33  66.979  -8.227  13.716
  228   1HA   GLY  33           HA2      GLY  33  65.235  -6.705  14.121
  229   2HA   GLY  33           HA1      GLY  33  65.149  -7.492  15.699
  230    H    GLY  34           HN       GLY  34  67.813  -5.551  14.353
  231   1HA   GLY  34           HA2      GLY  34  67.694  -3.867  16.792
  232   2HA   GLY  34           HA1      GLY  34  69.045  -3.940  15.661
  233    H    GLY  35           HN       GLY  35  66.303  -3.791  13.812
  234   1HA   GLY  35           HA2      GLY  35  65.006  -1.938  12.997
  235   2HA   GLY  35           HA1      GLY  35  66.021  -0.844  13.939
  236    H    ASP  36           HN       ASP  36  67.873  -3.143  12.289
  237    HA   ASP  36           HA       ASP  36  68.042  -1.778   9.726
  238   1HB   ASP  36           HB2      ASP  36  70.492  -1.122  10.125
  239   2HB   ASP  36           HB1      ASP  36  69.275  -0.105  10.897
  240    H    ILE  37           HN       ILE  37  69.368  -2.966   8.250
  241    HA   ILE  37           HA       ILE  37  70.459  -5.508   9.375
  242    HB   ILE  37           HB       ILE  37  69.082  -6.689   8.049
  243   1HG1  ILE  37          HG12      ILE  37  70.937  -6.342   6.326
  244   2HG1  ILE  37          HG11      ILE  37  69.350  -6.755   5.675
  245   1HG2  ILE  37          HG22      ILE  37  68.163  -3.939   7.232
  246   2HG2  ILE  37          HG21      ILE  37  67.467  -5.378   6.490
  247   3HG2  ILE  37          HG23      ILE  37  67.334  -5.133   8.232
  248   1HD1  ILE  37          HD12      ILE  37  69.489  -3.909   5.965
  249   2HD1  ILE  37          HD11      ILE  37  70.930  -4.452   5.105
  250   3HD1  ILE  37          HD13      ILE  37  69.327  -4.851   4.482
  251    H    SER  38           HN       SER  38  72.445  -6.199   8.538
  252    HA   SER  38           HA       SER  38  74.252  -4.196   7.636
  253   1HB   SER  38           HB2      SER  38  74.353  -7.016   8.236
  254   2HB   SER  38           HB1      SER  38  75.235  -6.700   6.746
  255    HG   SER  38           HG       SER  38  75.588  -5.525   9.299
  256    H    THR  39           HN       THR  39  74.994  -3.658   5.552
  257    HA   THR  39           HA       THR  39  73.148  -4.020   3.393
  258    HB   THR  39           HB       THR  39  74.644  -2.760   2.078
  259    HG1  THR  39           HG1      THR  39  76.597  -3.887   3.774
  260   1HG2  THR  39          HG23      THR  39  74.251  -2.056   4.825
  261   2HG2  THR  39          HG22      THR  39  75.847  -1.498   4.329
  262   3HG2  THR  39          HG21      THR  39  74.415  -0.984   3.434
  263    H    LYS  40           HN       LYS  40  75.669  -6.006   4.614
  264    HA   LYS  40           HA       LYS  40  76.472  -7.382   2.259
  265   1HB   LYS  40           HB2      LYS  40  76.266  -8.198   5.158
  266   2HB   LYS  40           HB1      LYS  40  76.788  -9.346   3.926
  267   1HG   LYS  40           HG2      LYS  40  78.564  -7.741   3.227
  268   2HG   LYS  40           HG1      LYS  40  78.077  -6.671   4.542
  269   1HD   LYS  40           HD2      LYS  40  79.129  -7.928   6.104
  270   2HD   LYS  40           HD1      LYS  40  78.532  -9.437   5.412
  271   1HE   LYS  40           HE2      LYS  40  81.051  -9.130   5.306
  272   2HE   LYS  40           HE1      LYS  40  80.271  -9.469   3.760
  273   1HZ   LYS  40           HZ2      LYS  40  80.378  -6.670   4.407
  274   2HZ   LYS  40           HZ1      LYS  40  81.915  -7.381   4.258
  275   3HZ   LYS  40           HZ3      LYS  40  80.812  -7.470   2.972
  276    H    ALA  41           HN       ALA  41  73.553  -7.536   4.170
  277    HA   ALA  41           HA       ALA  41  72.613  -9.972   2.791
  278   1HB   ALA  41           HB3      ALA  41  72.143  -9.183   5.283
  279   2HB   ALA  41           HB2      ALA  41  70.837  -8.282   4.514
  280   3HB   ALA  41           HB1      ALA  41  70.905 -10.038   4.363
  281    H    LEU  42           HN       LEU  42  72.336  -6.508   2.558
  282    HA   LEU  42           HA       LEU  42  69.924  -6.089   1.261
  283   1HB   LEU  42           HB2      LEU  42  72.569  -4.824   1.202
  284   2HB   LEU  42           HB1      LEU  42  71.701  -4.637  -0.318
  285    HG   LEU  42           HG       LEU  42  71.052  -2.761   0.980
  286   1HD1  LEU  42          HD12      LEU  42  69.171  -4.679   0.253
  287   2HD1  LEU  42          HD11      LEU  42  68.729  -4.258   1.909
  288   3HD1  LEU  42          HD13      LEU  42  68.835  -3.000   0.676
  289   1HD2  LEU  42          HD21      LEU  42  71.245  -4.705   3.201
  290   2HD2  LEU  42          HD23      LEU  42  71.627  -2.983   3.170
  291   3HD2  LEU  42          HD22      LEU  42  69.955  -3.511   3.353
  292    H    GLY  43           HN       GLY  43  72.832  -7.611  -0.041
  293   1HA   GLY  43           HA2      GLY  43  72.170  -7.708  -2.776
  294   2HA   GLY  43           HA1      GLY  43  73.114  -8.948  -1.949
  295    H    THR  44           HN       THR  44  71.455 -10.228  -0.321
  296    HA   THR  44           HA       THR  44  69.798 -11.793  -2.047
  297    HB   THR  44           HB       THR  44  69.913 -11.529   0.968
  298    HG1  THR  44           HG1      THR  44  70.900 -13.573   0.726
  299   1HG2  THR  44          HG22      THR  44  68.067 -13.076  -0.800
  300   2HG2  THR  44          HG21      THR  44  68.665 -13.862   0.662
  301   3HG2  THR  44          HG23      THR  44  67.763 -12.350   0.778
  302    H    VAL  45           HN       VAL  45  69.202  -8.941  -0.120
  303    HA   VAL  45           HA       VAL  45  66.334  -9.069  -0.103
  304    HB   VAL  45           HB       VAL  45  68.258  -6.733   0.072
  305   1HG1  VAL  45          HG13      VAL  45  65.258  -6.868   0.454
  306   2HG1  VAL  45          HG12      VAL  45  66.255  -5.536   1.036
  307   3HG1  VAL  45          HG11      VAL  45  66.142  -5.862  -0.694
  308   1HG2  VAL  45          HG22      VAL  45  67.446  -8.784   1.890
  309   2HG2  VAL  45          HG21      VAL  45  68.491  -7.398   2.210
  310   3HG2  VAL  45          HG23      VAL  45  66.748  -7.260   2.440
  311    H    MET  46           HN       MET  46  68.682  -8.030  -2.489
  312    HA   MET  46           HA       MET  46  66.898  -6.483  -4.125
  313   1HB   MET  46           HB2      MET  46  69.195  -8.079  -5.241
  314   2HB   MET  46           HB1      MET  46  68.618  -6.484  -5.727
  315   1HG   MET  46           HG2      MET  46  69.250  -5.991  -3.134
  316   2HG   MET  46           HG1      MET  46  70.435  -7.242  -3.510
  317   1HE   MET  46           HE1      MET  46  68.827  -4.041  -4.193
  318   2HE   MET  46           HE3      MET  46  70.268  -3.456  -3.353
  319   3HE   MET  46           HE2      MET  46  69.988  -3.020  -5.036
  320    H    ARG  47           HN       ARG  47  67.916  -9.907  -4.318
  321    HA   ARG  47           HA       ARG  47  66.163 -10.471  -6.554
  322   1HB   ARG  47           HB2      ARG  47  68.295 -11.754  -5.654
  323   2HB   ARG  47           HB1      ARG  47  67.099 -12.622  -4.689
  324   1HG   ARG  47           HG2      ARG  47  65.921 -12.563  -7.186
  325   2HG   ARG  47           HG1      ARG  47  67.629 -12.766  -7.573
  326   1HD   ARG  47           HD2      ARG  47  67.112 -14.467  -5.373
  327   2HD   ARG  47           HD1      ARG  47  65.781 -14.706  -6.507
  328    HE   ARG  47           HE       ARG  47  67.330 -15.604  -8.077
  329   1HH1  ARG  47          HH11      ARG  47  69.502 -13.622  -7.958
  330   2HH1  ARG  47          HH12      ARG  47  70.786 -14.491  -7.185
  331   1HH2  ARG  47          HH21      ARG  47  68.710 -16.980  -5.947
  332   2HH2  ARG  47          HH22      ARG  47  70.337 -16.394  -6.048
  333    H    MET  48           HN       MET  48  65.766 -10.420  -3.089
  334    HA   MET  48           HA       MET  48  63.425 -12.124  -3.010
  335   1HB   MET  48           HB2      MET  48  64.995 -10.559  -1.136
  336   2HB   MET  48           HB1      MET  48  63.267 -10.333  -0.852
  337   1HG   MET  48           HG2      MET  48  62.992 -12.822  -0.880
  338   2HG   MET  48           HG1      MET  48  64.744 -12.976  -0.999
  339   1HE   MET  48           HE2      MET  48  61.693 -12.077   0.913
  340   2HE   MET  48           HE1      MET  48  62.202 -11.529   2.507
  341   3HE   MET  48           HE3      MET  48  62.396 -10.473   1.100
  342    H    LEU  49           HN       LEU  49  63.901  -8.587  -3.122
  343    HA   LEU  49           HA       LEU  49  61.018  -8.099  -3.232
  344   1HB   LEU  49           HB2      LEU  49  63.241  -6.158  -3.910
  345   2HB   LEU  49           HB1      LEU  49  61.596  -5.774  -3.400
  346    HG   LEU  49           HG       LEU  49  63.727  -7.130  -1.725
  347   1HD1  LEU  49          HD13      LEU  49  62.514  -4.377  -1.805
  348   2HD1  LEU  49          HD12      LEU  49  63.168  -5.017  -0.298
  349   3HD1  LEU  49          HD11      LEU  49  64.214  -4.834  -1.705
  350   1HD2  LEU  49          HD22      LEU  49  60.864  -7.243  -1.571
  351   2HD2  LEU  49          HD21      LEU  49  62.047  -7.945  -0.467
  352   3HD2  LEU  49          HD23      LEU  49  61.464  -6.302  -0.205
  353    H    GLY  50           HN       GLY  50  63.666  -7.379  -5.544
  354   1HA   GLY  50           HA2      GLY  50  62.507  -8.638  -7.787
  355   2HA   GLY  50           HA1      GLY  50  61.887  -6.987  -7.761
  356    H    GLN  51           HN       GLN  51  63.981  -5.476  -6.969
  357    HA   GLN  51           HA       GLN  51  65.558  -5.092  -9.232
  358   1HB   GLN  51           HB2      GLN  51  66.482  -4.620  -6.381
  359   2HB   GLN  51           HB1      GLN  51  67.074  -3.804  -7.828
  360   1HG   GLN  51           HG2      GLN  51  64.402  -3.343  -8.062
  361   2HG   GLN  51           HG1      GLN  51  64.572  -3.369  -6.307
  362   1HE2  GLN  51          HE22      GLN  51  65.729  -0.049  -6.375
  363   2HE2  GLN  51          HE21      GLN  51  64.713  -1.207  -5.660
  364    H    ASN  52           HN       ASN  52  67.462  -5.973 -10.021
  365    HA   ASN  52           HA       ASN  52  68.991  -7.865  -8.348
  366   1HB   ASN  52           HB2      ASN  52  67.062  -9.077  -9.606
  367   2HB   ASN  52           HB1      ASN  52  68.042  -8.809 -11.049
  368   1HD2  ASN  52          HD22      ASN  52  70.193 -11.485 -10.308
  369   2HD2  ASN  52          HD21      ASN  52  69.571 -10.407 -11.464
  370    HA   PRO  53           HA       PRO  53  71.360  -5.362 -11.497
  371   1HB   PRO  53           HB2      PRO  53  72.681  -3.770  -9.686
  372   2HB   PRO  53           HB1      PRO  53  71.131  -3.331 -10.426
  373   1HG   PRO  53           HG2      PRO  53  71.687  -4.284  -7.653
  374   2HG   PRO  53           HG1      PRO  53  70.364  -3.266  -8.246
  375   1HD   PRO  53           HD2      PRO  53  70.185  -6.023  -7.640
  376   2HD   PRO  53           HD1      PRO  53  68.988  -5.075  -8.550
  377    H    THR  54           HN       THR  54  73.855  -5.179 -11.515
  378    HA   THR  54           HA       THR  54  74.975  -7.709 -10.596
  379    HB   THR  54           HB       THR  54  77.099  -6.762 -11.606
  380    HG1  THR  54           HG1      THR  54  76.772  -4.600 -11.398
  381   1HG2  THR  54          HG23      THR  54  74.536  -6.854 -13.207
  382   2HG2  THR  54          HG22      THR  54  76.126  -6.717 -13.956
  383   3HG2  THR  54          HG21      THR  54  75.723  -8.141 -12.995
  384    H    LYS  55           HN       LYS  55  76.686  -7.939  -9.057
  385    HA   LYS  55           HA       LYS  55  76.484  -6.423  -6.691
  386   1HB   LYS  55           HB2      LYS  55  77.569  -8.650  -6.822
  387   2HB   LYS  55           HB1      LYS  55  78.918  -7.929  -7.700
  388   1HG   LYS  55           HG2      LYS  55  79.857  -7.173  -5.795
  389   2HG   LYS  55           HG1      LYS  55  78.338  -6.447  -5.267
  390   1HD   LYS  55           HD2      LYS  55  77.973  -8.128  -3.817
  391   2HD   LYS  55           HD1      LYS  55  78.170  -9.328  -5.097
  392   1HE   LYS  55           HE2      LYS  55  80.672  -9.044  -4.849
  393   2HE   LYS  55           HE1      LYS  55  80.351  -8.066  -3.416
  394   1HZ   LYS  55           HZ2      LYS  55  78.824 -10.290  -3.054
  395   2HZ   LYS  55           HZ1      LYS  55  80.252 -10.907  -3.737
  396   3HZ   LYS  55           HZ3      LYS  55  80.324  -9.982  -2.317
  397    H    GLU  56           HN       GLU  56  78.113  -5.676  -9.643
  398    HA   GLU  56           HA       GLU  56  80.135  -3.915  -8.664
  399   1HB   GLU  56           HB2      GLU  56  78.676  -4.234 -11.263
  400   2HB   GLU  56           HB1      GLU  56  79.651  -2.786 -11.012
  401   1HG   GLU  56           HG2      GLU  56  81.043  -5.199 -10.144
  402   2HG   GLU  56           HG1      GLU  56  80.598  -5.270 -11.850
  403    H    GLU  57           HN       GLU  57  76.780  -3.237  -9.715
  404    HA   GLU  57           HA       GLU  57  76.989  -0.436  -8.918
  405   1HB   GLU  57           HB2      GLU  57  74.997  -2.170 -10.212
  406   2HB   GLU  57           HB1      GLU  57  74.292  -0.962  -9.136
  407   1HG   GLU  57           HG2      GLU  57  74.777   0.718 -10.562
  408   2HG   GLU  57           HG1      GLU  57  76.438   0.158 -10.757
  409    H    LEU  58           HN       LEU  58  76.302  -3.396  -7.322
  410    HA   LEU  58           HA       LEU  58  74.571  -2.362  -5.251
  411   1HB   LEU  58           HB2      LEU  58  75.729  -4.878  -5.956
  412   2HB   LEU  58           HB1      LEU  58  76.134  -4.549  -4.271
  413    HG   LEU  58           HG       LEU  58  73.352  -3.899  -5.007
  414   1HD1  LEU  58          HD11      LEU  58  74.525  -6.535  -5.598
  415   2HD1  LEU  58          HD13      LEU  58  73.106  -6.602  -4.554
  416   3HD1  LEU  58          HD12      LEU  58  72.998  -5.836  -6.139
  417   1HD2  LEU  58          HD21      LEU  58  74.933  -4.598  -2.716
  418   2HD2  LEU  58          HD23      LEU  58  73.262  -4.036  -2.760
  419   3HD2  LEU  58          HD22      LEU  58  73.616  -5.761  -2.862
  420    H    ASP  59           HN       ASP  59  78.091  -2.965  -5.417
  421    HA   ASP  59           HA       ASP  59  78.698  -2.100  -2.774
  422   1HB   ASP  59           HB2      ASP  59  80.265  -3.280  -4.383
  423   2HB   ASP  59           HB1      ASP  59  80.475  -1.731  -5.200
  424    H    ALA  60           HN       ALA  60  78.521  -0.269  -5.830
  425    HA   ALA  60           HA       ALA  60  79.306   2.244  -4.658
  426   1HB   ALA  60           HB1      ALA  60  77.993   1.399  -7.219
  427   2HB   ALA  60           HB3      ALA  60  77.979   3.106  -6.776
  428   3HB   ALA  60           HB2      ALA  60  79.514   2.258  -6.975
  429    H    ILE  61           HN       ILE  61  76.271   0.520  -4.857
  430    HA   ILE  61           HA       ILE  61  74.621   2.835  -4.214
  431    HB   ILE  61           HB       ILE  61  74.152  -0.144  -4.340
  432   1HG1  ILE  61          HG12      ILE  61  72.482   1.887  -5.737
  433   2HG1  ILE  61          HG11      ILE  61  74.155   1.737  -6.278
  434   1HG2  ILE  61          HG22      ILE  61  72.265   1.997  -3.316
  435   2HG2  ILE  61          HG21      ILE  61  71.735   0.400  -3.845
  436   3HG2  ILE  61          HG23      ILE  61  72.810   0.555  -2.456
  437   1HD1  ILE  61          HD11      ILE  61  73.444  -0.891  -6.067
  438   2HD1  ILE  61          HD13      ILE  61  71.910  -0.167  -6.551
  439   3HD1  ILE  61          HD12      ILE  61  73.343   0.040  -7.560
  440    H    ILE  62           HN       ILE  62  76.282   0.315  -2.403
  441    HA   ILE  62           HA       ILE  62  74.959   0.690   0.103
  442    HB   ILE  62           HB       ILE  62  77.809  -0.170  -0.485
  443   1HG1  ILE  62          HG12      ILE  62  75.456  -1.917   0.253
  444   2HG1  ILE  62          HG11      ILE  62  75.789  -1.493  -1.427
  445   1HG2  ILE  62          HG22      ILE  62  76.895   0.639   1.936
  446   2HG2  ILE  62          HG21      ILE  62  76.381  -1.048   1.967
  447   3HG2  ILE  62          HG23      ILE  62  78.084  -0.650   1.738
  448   1HD1  ILE  62          HD13      ILE  62  78.243  -2.305  -0.174
  449   2HD1  ILE  62          HD12      ILE  62  77.015  -3.536   0.123
  450   3HD1  ILE  62          HD11      ILE  62  77.402  -3.057  -1.530
  451    H    GLU  63           HN       GLU  63  78.044   2.069  -1.092
  452    HA   GLU  63           HA       GLU  63  78.390   3.807   1.171
  453   1HB   GLU  63           HB2      GLU  63  80.046   4.975  -0.288
  454   2HB   GLU  63           HB1      GLU  63  80.282   3.227  -0.257
  455   1HG   GLU  63           HG2      GLU  63  80.015   3.133  -2.487
  456   2HG   GLU  63           HG1      GLU  63  78.410   3.852  -2.335
  457    H    GLU  64           HN       GLU  64  76.181   3.924  -1.390
  458    HA   GLU  64           HA       GLU  64  75.968   6.886  -1.277
  459   1HB   GLU  64           HB2      GLU  64  75.139   4.779  -3.189
  460   2HB   GLU  64           HB1      GLU  64  74.009   6.122  -3.001
  461   1HG   GLU  64           HG2      GLU  64  76.857   6.895  -3.227
  462   2HG   GLU  64           HG1      GLU  64  76.153   6.183  -4.679
  463    H    VAL  65           HN       VAL  65  74.474   4.013  -0.063
  464    HA   VAL  65           HA       VAL  65  71.935   5.376   0.561
  465    HB   VAL  65           HB       VAL  65  72.971   2.610   1.251
  466   1HG1  VAL  65          HG13      VAL  65  70.912   4.094   2.482
  467   2HG1  VAL  65          HG12      VAL  65  70.101   2.967   1.393
  468   3HG1  VAL  65          HG11      VAL  65  71.204   2.362   2.629
  469   1HG2  VAL  65          HG21      VAL  65  72.036   3.643  -1.160
  470   2HG2  VAL  65          HG23      VAL  65  72.082   1.936  -0.719
  471   3HG2  VAL  65          HG22      VAL  65  70.612   2.875  -0.460
  472    H    ASP  66           HN       ASP  66  74.841   4.241   2.252
  473    HA   ASP  66           HA       ASP  66  73.810   5.061   4.866
  474   1HB   ASP  66           HB2      ASP  66  76.376   3.920   3.823
  475   2HB   ASP  66           HB1      ASP  66  76.394   4.736   5.387
  476    H    GLU  67           HN       GLU  67  73.309   7.315   4.247
  477    HA   GLU  67           HA       GLU  67  75.302   9.158   3.353
  478   1HB   GLU  67           HB2      GLU  67  73.722  10.865   4.503
  479   2HB   GLU  67           HB1      GLU  67  73.075   9.913   3.167
  480   1HG   GLU  67           HG2      GLU  67  72.791   8.507   5.697
  481   2HG   GLU  67           HG1      GLU  67  72.008  10.086   5.749
  482    H    ASP  68           HN       ASP  68  74.509   7.890   6.528
  483    HA   ASP  68           HA       ASP  68  76.284   9.846   7.855
  484   1HB   ASP  68           HB2      ASP  68  75.645   8.458   9.915
  485   2HB   ASP  68           HB1      ASP  68  74.333   9.332   9.124
  486    H    GLY  69           HN       GLY  69  76.557   6.843   6.317
  487   1HA   GLY  69           HA2      GLY  69  78.303   5.278   6.220
  488   2HA   GLY  69           HA1      GLY  69  79.334   6.575   6.823
  489    H    SER  70           HN       SER  70  76.547   5.101   8.460
  490    HA   SER  70           HA       SER  70  78.154   4.733  10.874
  491   1HB   SER  70           HB2      SER  70  75.896   3.509  11.545
  492   2HB   SER  70           HB1      SER  70  75.973   5.266  11.449
  493    HG   SER  70           HG       SER  70  74.252   4.723  10.225
  494    H    GLY  71           HN       GLY  71  77.207   2.805   8.150
  495   1HA   GLY  71           HA2      GLY  71  78.342   0.734   7.614
  496   2HA   GLY  71           HA1      GLY  71  78.675   0.507   9.332
  497    H    THR  72           HN       THR  72  75.489   1.543   8.548
  498    HA   THR  72           HA       THR  72  74.414  -1.193   8.370
  499    HB   THR  72           HB       THR  72  72.843  -0.195  10.409
  500    HG1  THR  72           HG1      THR  72  74.636   0.299  11.960
  501   1HG2  THR  72          HG23      THR  72  74.422  -2.409   9.905
  502   2HG2  THR  72          HG22      THR  72  75.145  -1.735  11.365
  503   3HG2  THR  72          HG21      THR  72  73.435  -2.166  11.347
  504    H    ILE  73           HN       ILE  73  72.220  -1.199   7.646
  505    HA   ILE  73           HA       ILE  73  71.345   1.425   6.536
  506    HB   ILE  73           HB       ILE  73  70.397  -1.371   5.851
  507   1HG1  ILE  73          HG12      ILE  73  72.848  -0.778   5.339
  508   2HG1  ILE  73          HG11      ILE  73  71.867  -1.315   3.978
  509   1HG2  ILE  73          HG21      ILE  73  69.750   1.385   4.881
  510   2HG2  ILE  73          HG23      ILE  73  69.755   0.064   3.712
  511   3HG2  ILE  73          HG22      ILE  73  68.683  -0.001   5.110
  512   1HD1  ILE  73          HD13      ILE  73  71.737   1.585   4.450
  513   2HD1  ILE  73          HD12      ILE  73  73.349   1.006   4.027
  514   3HD1  ILE  73          HD11      ILE  73  71.991   0.700   2.945
  515    H    ASP  74           HN       ASP  74  69.416   2.328   7.176
  516    HA   ASP  74           HA       ASP  74  67.833   0.794   9.198
  517   1HB   ASP  74           HB2      ASP  74  68.275   3.773   8.853
  518   2HB   ASP  74           HB1      ASP  74  67.056   3.096   9.935
  519    H    PHE  75           HN       PHE  75  65.440   1.464   9.188
  520    HA   PHE  75           HA       PHE  75  64.247   0.881   6.717
  521   1HB   PHE  75           HB2      PHE  75  63.190   1.008   9.091
  522   2HB   PHE  75           HB1      PHE  75  62.889   2.701   8.697
  523    HD1  PHE  75           HD2      PHE  75  62.776  -0.470   6.697
  524    HD2  PHE  75           HD1      PHE  75  60.664   3.010   8.068
  525    HE1  PHE  75           HE2      PHE  75  60.806  -1.132   5.341
  526    HE2  PHE  75           HE1      PHE  75  58.696   2.350   6.710
  527    HZ   PHE  75           HZ       PHE  75  58.766   0.278   5.348
  528    H    GLU  76           HN       GLU  76  64.887   4.090   8.149
  529    HA   GLU  76           HA       GLU  76  63.726   5.627   6.054
  530   1HB   GLU  76           HB2      GLU  76  65.523   7.358   6.832
  531   2HB   GLU  76           HB1      GLU  76  64.275   6.861   7.976
  532   1HG   GLU  76           HG2      GLU  76  65.739   5.592   9.237
  533   2HG   GLU  76           HG1      GLU  76  66.791   5.251   7.864
  534    H    GLU  77           HN       GLU  77  66.914   4.128   6.370
  535    HA   GLU  77           HA       GLU  77  67.936   5.383   3.934
  536   1HB   GLU  77           HB2      GLU  77  69.000   2.995   5.477
  537   2HB   GLU  77           HB1      GLU  77  69.876   3.921   4.258
  538   1HG   GLU  77           HG2      GLU  77  69.479   5.973   5.726
  539   2HG   GLU  77           HG1      GLU  77  68.955   4.852   6.983
  540    H    PHE  78           HN       PHE  78  65.974   2.673   4.688
  541    HA   PHE  78           HA       PHE  78  66.650   0.962   2.479
  542   1HB   PHE  78           HB2      PHE  78  64.900   0.848   4.646
  543   2HB   PHE  78           HB1      PHE  78  63.830   0.900   3.246
  544    HD1  PHE  78           HD2      PHE  78  63.953  -0.837   1.497
  545    HD2  PHE  78           HD1      PHE  78  66.383  -1.030   5.033
  546    HE1  PHE  78           HE2      PHE  78  64.450  -3.221   1.025
  547    HE2  PHE  78           HE1      PHE  78  66.880  -3.413   4.561
  548    HZ   PHE  78           HZ       PHE  78  65.913  -4.508   2.558
  549    H    LEU  79           HN       LEU  79  63.805   3.092   2.894
  550    HA   LEU  79           HA       LEU  79  62.766   3.006   0.327
  551   1HB   LEU  79           HB2      LEU  79  63.087   5.571   1.914
  552   2HB   LEU  79           HB1      LEU  79  61.839   5.209   0.719
  553    HG   LEU  79           HG       LEU  79  62.223   3.876   3.415
  554   1HD1  LEU  79          HD13      LEU  79  60.081   5.643   2.209
  555   2HD1  LEU  79          HD12      LEU  79  59.843   4.714   3.690
  556   3HD1  LEU  79          HD11      LEU  79  61.077   5.973   3.628
  557   1HD2  LEU  79          HD22      LEU  79  60.868   2.994   0.945
  558   2HD2  LEU  79          HD21      LEU  79  61.381   2.050   2.343
  559   3HD2  LEU  79          HD23      LEU  79  59.856   2.935   2.389
  560    H    VAL  80           HN       VAL  80  65.742   4.502   1.372
  561    HA   VAL  80           HA       VAL  80  66.143   6.151  -0.966
  562    HB   VAL  80           HB       VAL  80  68.086   5.004   1.057
  563   1HG1  VAL  80          HG12      VAL  80  68.476   6.645  -1.403
  564   2HG1  VAL  80          HG11      VAL  80  69.404   7.100   0.026
  565   3HG1  VAL  80          HG13      VAL  80  69.561   5.478  -0.647
  566   1HG2  VAL  80          HG22      VAL  80  66.359   7.395   0.887
  567   2HG2  VAL  80          HG21      VAL  80  67.047   6.601   2.304
  568   3HG2  VAL  80          HG23      VAL  80  68.025   7.726   1.361
  569    H    MET  81           HN       MET  81  67.485   2.977  -0.006
  570    HA   MET  81           HA       MET  81  68.924   2.495  -2.405
  571   1HB   MET  81           HB2      MET  81  68.851   1.181  -0.128
  572   2HB   MET  81           HB1      MET  81  67.584   0.251  -0.926
  573   1HG   MET  81           HG2      MET  81  69.081  -0.314  -2.757
  574   2HG   MET  81           HG1      MET  81  70.341   0.726  -2.091
  575   1HE   MET  81           HE3      MET  81  71.326   0.493   0.208
  576   2HE   MET  81           HE2      MET  81  69.838   0.145   1.084
  577   3HE   MET  81           HE1      MET  81  71.227  -0.923   1.264
  578    H    MET  82           HN       MET  82  65.522   1.959  -1.596
  579    HA   MET  82           HA       MET  82  64.901   0.411  -3.947
  580   1HB   MET  82           HB2      MET  82  62.997   2.191  -2.406
  581   2HB   MET  82           HB1      MET  82  62.597   0.762  -3.359
  582   1HG   MET  82           HG2      MET  82  64.177   0.845  -0.776
  583   2HG   MET  82           HG1      MET  82  62.591   0.117  -1.028
  584   1HE   MET  82           HE2      MET  82  62.170  -1.321  -3.001
  585   2HE   MET  82           HE1      MET  82  63.451  -1.236  -4.207
  586   3HE   MET  82           HE3      MET  82  63.124  -2.756  -3.365
  587    H    VAL  83           HN       VAL  83  64.105   3.829  -3.194
  588    HA   VAL  83           HA       VAL  83  63.369   4.444  -5.902
  589    HB   VAL  83           HB       VAL  83  64.308   6.344  -3.733
  590   1HG1  VAL  83          HG11      VAL  83  62.598   6.741  -6.208
  591   2HG1  VAL  83          HG13      VAL  83  62.916   7.973  -4.988
  592   3HG1  VAL  83          HG12      VAL  83  64.237   7.348  -5.975
  593   1HG2  VAL  83          HG22      VAL  83  61.621   5.100  -4.352
  594   2HG2  VAL  83          HG21      VAL  83  62.484   5.116  -2.814
  595   3HG2  VAL  83          HG23      VAL  83  61.767   6.602  -3.437
  596    H    ARG  84           HN       ARG  84  66.399   3.899  -4.489
  597    HA   ARG  84           HA       ARG  84  68.068   5.780  -5.794
  598   1HB   ARG  84           HB2      ARG  84  68.393   3.158  -4.517
  599   2HB   ARG  84           HB1      ARG  84  69.543   3.436  -5.824
  600   1HG   ARG  84           HG2      ARG  84  69.869   5.776  -4.717
  601   2HG   ARG  84           HG1      ARG  84  69.150   5.019  -3.296
  602   1HD   ARG  84           HD2      ARG  84  71.206   4.231  -2.811
  603   2HD   ARG  84           HD1      ARG  84  71.015   3.145  -4.188
  604    HE   ARG  84           HE       ARG  84  72.993   5.039  -4.144
  605   1HH1  ARG  84          HH21      ARG  84  71.505   7.190  -5.252
  606   2HH1  ARG  84          HH22      ARG  84  71.480   6.890  -6.958
  607   1HH2  ARG  84          HH11      ARG  84  72.354   3.549  -6.653
  608   2HH2  ARG  84          HH12      ARG  84  71.961   4.829  -7.752
  609    H    GLN  85           HN       GLN  85  66.499   2.868  -6.995
  610    HA   GLN  85           HA       GLN  85  67.009   3.718  -9.748
  611   1HB   GLN  85           HB2      GLN  85  68.224   1.746 -10.444
  612   2HB   GLN  85           HB1      GLN  85  69.094   2.464  -9.088
  613   1HG   GLN  85           HG2      GLN  85  67.080   0.619  -8.129
  614   2HG   GLN  85           HG1      GLN  85  68.149  -0.183  -9.280
  615   1HE2  GLN  85          HE22      GLN  85  69.800   1.351  -5.830
  616   2HE2  GLN  85          HE21      GLN  85  68.377   2.047  -6.442
  617    H    MET  86           HN       MET  86  64.634   3.341  -8.218
  618    HA   MET  86           HA       MET  86  63.479   0.743  -8.852
  619   1HB   MET  86           HB2      MET  86  61.442   1.626  -7.913
  620   2HB   MET  86           HB1      MET  86  62.772   2.214  -6.914
  621   1HG   MET  86           HG2      MET  86  62.774   4.330  -8.255
  622   2HG   MET  86           HG1      MET  86  61.342   3.745  -9.104
  623   1HE   MET  86           HE3      MET  86  59.297   2.966  -8.065
  624   2HE   MET  86           HE2      MET  86  59.824   2.158  -6.592
  625   3HE   MET  86           HE1      MET  86  58.634   3.455  -6.501
  626    H    LYS  87           HN       LYS  87  63.999   3.637 -10.592
  627    HA   LYS  87           HA       LYS  87  61.758   3.104 -12.461
  628   1HB   LYS  87           HB2      LYS  87  63.765   5.352 -12.202
  629   2HB   LYS  87           HB1      LYS  87  62.683   5.209 -13.589
  630   1HG   LYS  87           HG2      LYS  87  60.819   5.750 -12.369
  631   2HG   LYS  87           HG1      LYS  87  61.426   4.972 -10.905
  632   1HD   LYS  87           HD2      LYS  87  62.382   6.883 -10.149
  633   2HD   LYS  87           HD1      LYS  87  63.021   7.292 -11.742
  634   1HE   LYS  87           HE2      LYS  87  60.855   8.154 -12.443
  635   2HE   LYS  87           HE1      LYS  87  60.121   7.634 -10.925
  636   1HZ   LYS  87           HZ2      LYS  87  61.765   9.108  -9.788
  637   2HZ   LYS  87           HZ1      LYS  87  62.185   9.728 -11.313
  638   3HZ   LYS  87           HZ3      LYS  87  60.607   9.926 -10.723
  639    H    GLU  88           HN       GLU  88  65.250   2.839 -12.228
  640    HA   GLU  88           HA       GLU  88  66.840   2.059 -13.786
  641   1HB   GLU  88           HB2      GLU  88  64.525   0.289 -14.619
  642   2HB   GLU  88           HB1      GLU  88  66.246  -0.071 -14.765
  643   1HG   GLU  88           HG2      GLU  88  66.428  -0.678 -12.581
  644   2HG   GLU  88           HG1      GLU  88  65.376   0.628 -12.034
  645    H    ASP  89           HN       ASP  89  65.247   4.342 -14.679
  646    HA   ASP  89           HA       ASP  89  65.644   3.971 -17.593
  647   1HB   ASP  89           HB2      ASP  89  63.056   4.864 -16.299
  648   2HB   ASP  89           HB1      ASP  89  63.436   5.167 -17.995
  649    H    ALA  90           HN       ALA  90  66.748   5.536 -15.162
  650    HA   ALA  90           HA       ALA  90  66.818   8.157 -16.580
  651   1HB   ALA  90           HB2      ALA  90  66.358   7.704 -13.620
  652   2HB   ALA  90           HB1      ALA  90  66.798   9.265 -14.309
  653   3HB   ALA  90           HB3      ALA  90  65.273   8.504 -14.757
   
  No H/Q in entry =         653
  Start of MODEL   32
    1   1H    ALA   1           HT1      ALA   1  66.831  13.617  15.763
    2   2H    ALA   1           HT3      ALA   1  65.347  13.614  16.583
    3   3H    ALA   1           HT2      ALA   1  66.359  12.250  16.657
    4    HA   ALA   1           HA       ALA   1  65.161  11.418  14.997
    5   1HB   ALA   1           HB3      ALA   1  64.104  14.204  15.004
    6   2HB   ALA   1           HB2      ALA   1  63.842  13.254  13.541
    7   3HB   ALA   1           HB1      ALA   1  63.235  12.673  15.093
    8    H    SER   2           HN       SER   2  65.884  14.591  13.530
    9    HA   SER   2           HA       SER   2  67.386  15.147  11.802
   10   1HB   SER   2           HB2      SER   2  68.646  12.472  11.682
   11   2HB   SER   2           HB1      SER   2  69.392  14.064  11.776
   12    HG   SER   2           HG       SER   2  68.771  14.098  13.998
   13    H    MET   3           HN       MET   3  67.848  14.444   9.490
   14    HA   MET   3           HA       MET   3  66.627  12.194   8.275
   15   1HB   MET   3           HB2      MET   3  64.603  13.288   7.285
   16   2HB   MET   3           HB1      MET   3  64.495  13.102   9.036
   17   1HG   MET   3           HG2      MET   3  65.788  15.583   8.553
   18   2HG   MET   3           HG1      MET   3  64.385  15.520   7.484
   19   1HE   MET   3           HE1      MET   3  62.503  15.878   7.784
   20   2HE   MET   3           HE3      MET   3  61.453  15.319   9.092
   21   3HE   MET   3           HE2      MET   3  62.036  16.982   9.076
   22    H    THR   4           HN       THR   4  68.425  12.318   6.903
   23    HA   THR   4           HA       THR   4  69.370  14.672   5.618
   24    HB   THR   4           HB       THR   4  70.418  13.068   3.983
   25    HG1  THR   4           HG1      THR   4  70.042  10.888   4.317
   26   1HG2  THR   4          HG22      THR   4  70.749  13.184   6.867
   27   2HG2  THR   4          HG21      THR   4  71.253  11.620   6.230
   28   3HG2  THR   4          HG23      THR   4  71.978  13.102   5.606
   29    H    ASP   5           HN       ASP   5  68.848  15.620   3.633
   30    HA   ASP   5           HA       ASP   5  66.193  15.520   2.703
   31   1HB   ASP   5           HB2      ASP   5  68.759  16.343   1.328
   32   2HB   ASP   5           HB1      ASP   5  67.181  16.517   0.560
   33    H    GLN   6           HN       GLN   6  68.865  13.398   2.021
   34    HA   GLN   6           HA       GLN   6  67.987  12.280  -0.445
   35   1HB   GLN   6           HB2      GLN   6  69.606  11.187   1.855
   36   2HB   GLN   6           HB1      GLN   6  69.224  10.191   0.450
   37   1HG   GLN   6           HG2      GLN   6  70.095  12.357  -0.850
   38   2HG   GLN   6           HG1      GLN   6  70.992  12.588   0.651
   39   1HE2  GLN   6          HE22      GLN   6  72.585   9.244   0.197
   40   2HE2  GLN   6          HE21      GLN   6  71.617   9.968   1.390
   41    H    GLN   7           HN       GLN   7  67.222  11.374   2.919
   42    HA   GLN   7           HA       GLN   7  65.440   9.224   2.098
   43   1HB   GLN   7           HB2      GLN   7  65.524  10.633   4.779
   44   2HB   GLN   7           HB1      GLN   7  64.920   9.010   4.440
   45   1HG   GLN   7           HG2      GLN   7  67.088   8.157   4.046
   46   2HG   GLN   7           HG1      GLN   7  67.776   9.768   3.840
   47   1HE2  GLN   7          HE22      GLN   7  68.092   8.181   7.418
   48   2HE2  GLN   7          HE21      GLN   7  68.006   7.338   5.947
   49    H    ALA   8           HN       ALA   8  65.168  12.640   2.415
   50    HA   ALA   8           HA       ALA   8  62.330  12.765   2.962
   51   1HB   ALA   8           HB1      ALA   8  64.397  14.607   2.821
   52   2HB   ALA   8           HB3      ALA   8  63.420  14.994   1.404
   53   3HB   ALA   8           HB2      ALA   8  62.687  15.000   3.008
   54    H    GLU   9           HN       GLU   9  64.229  13.155  -0.049
   55    HA   GLU   9           HA       GLU   9  61.938  13.345  -1.762
   56   1HB   GLU   9           HB2      GLU   9  64.772  13.358  -2.053
   57   2HB   GLU   9           HB1      GLU   9  64.134  12.132  -3.149
   58   1HG   GLU   9           HG2      GLU   9  62.713  13.699  -4.242
   59   2HG   GLU   9           HG1      GLU   9  62.941  14.903  -2.974
   60    H    ALA  10           HN       ALA  10  63.765  10.608  -0.493
   61    HA   ALA  10           HA       ALA  10  62.701   8.596  -2.219
   62   1HB   ALA  10           HB1      ALA  10  64.631   8.283  -0.641
   63   2HB   ALA  10           HB3      ALA  10  63.478   8.278   0.694
   64   3HB   ALA  10           HB2      ALA  10  63.420   7.007  -0.529
   65    H    ARG  11           HN       ARG  11  61.609   9.693   1.008
   66    HA   ARG  11           HA       ARG  11  59.267   8.007   1.019
   67   1HB   ARG  11           HB2      ARG  11  60.046  10.478   2.584
   68   2HB   ARG  11           HB1      ARG  11  58.515   9.641   2.841
   69   1HG   ARG  11           HG2      ARG  11  59.933   7.506   3.112
   70   2HG   ARG  11           HG1      ARG  11  61.312   8.593   3.273
   71   1HD   ARG  11           HD2      ARG  11  58.961   8.232   5.096
   72   2HD   ARG  11           HD1      ARG  11  60.671   8.380   5.497
   73    HE   ARG  11           HE       ARG  11  60.136  10.857   4.497
   74   1HH1  ARG  11          HH11      ARG  11  59.937   9.564   7.463
   75   2HH1  ARG  11          HH12      ARG  11  58.623  10.529   8.051
   76   1HH2  ARG  11          HH21      ARG  11  57.807  11.794   4.927
   77   2HH2  ARG  11          HH22      ARG  11  57.418  11.791   6.614
   78    H    ALA  12           HN       ALA  12  59.974  11.186  -0.271
   79    HA   ALA  12           HA       ALA  12  57.226  12.022  -0.604
   80   1HB   ALA  12           HB2      ALA  12  59.830  12.884  -1.881
   81   2HB   ALA  12           HB1      ALA  12  58.283  13.613  -2.310
   82   3HB   ALA  12           HB3      ALA  12  58.888  13.737  -0.658
   83    H    PHE  13           HN       PHE  13  59.468  10.099  -2.510
   84    HA   PHE  13           HA       PHE  13  57.664  10.089  -4.839
   85   1HB   PHE  13           HB2      PHE  13  60.170  10.065  -5.067
   86   2HB   PHE  13           HB1      PHE  13  60.169   8.451  -4.355
   87    HD1  PHE  13           HD2      PHE  13  58.637   6.675  -5.477
   88    HD2  PHE  13           HD1      PHE  13  59.857  10.327  -7.376
   89    HE1  PHE  13           HE2      PHE  13  58.116   5.695  -7.696
   90    HE2  PHE  13           HE1      PHE  13  59.337   9.348  -9.595
   91    HZ   PHE  13           HZ       PHE  13  58.467   7.031  -9.755
   92    H    LEU  14           HN       LEU  14  58.436   8.088  -2.073
   93    HA   LEU  14           HA       LEU  14  56.863   5.829  -3.175
   94   1HB   LEU  14           HB2      LEU  14  58.309   6.088  -0.519
   95   2HB   LEU  14           HB1      LEU  14  57.607   4.611  -1.181
   96    HG   LEU  14           HG       LEU  14  59.787   6.214  -2.545
   97   1HD1  LEU  14          HD12      LEU  14  60.217   4.905  -0.263
   98   2HD1  LEU  14          HD11      LEU  14  60.240   3.513  -1.343
   99   3HD1  LEU  14          HD13      LEU  14  61.379   4.835  -1.588
  100   1HD2  LEU  14          HD23      LEU  14  58.005   4.196  -3.454
  101   2HD2  LEU  14          HD22      LEU  14  59.398   4.861  -4.305
  102   3HD2  LEU  14          HD21      LEU  14  59.587   3.436  -3.282
  103    H    SER  15           HN       SER  15  54.833   5.287  -2.402
  104    HA   SER  15           HA       SER  15  53.590   7.245  -0.529
  105   1HB   SER  15           HB2      SER  15  51.441   6.109  -1.374
  106   2HB   SER  15           HB1      SER  15  52.324   7.094  -2.537
  107    HG   SER  15           HG       SER  15  52.737   4.307  -2.224
  108    H    GLU  16           HN       GLU  16  51.843   6.166   0.926
  109    HA   GLU  16           HA       GLU  16  53.117   4.308   2.669
  110   1HB   GLU  16           HB2      GLU  16  50.314   5.328   2.353
  111   2HB   GLU  16           HB1      GLU  16  50.607   3.957   3.425
  112   1HG   GLU  16           HG2      GLU  16  52.329   5.281   4.623
  113   2HG   GLU  16           HG1      GLU  16  51.979   6.659   3.577
  114    H    GLU  17           HN       GLU  17  51.449   3.825  -0.295
  115    HA   GLU  17           HA       GLU  17  50.483   1.151   0.173
  116   1HB   GLU  17           HB2      GLU  17  51.240   2.518  -2.426
  117   2HB   GLU  17           HB1      GLU  17  50.309   1.027  -2.289
  118   1HG   GLU  17           HG2      GLU  17  48.688   2.357  -0.813
  119   2HG   GLU  17           HG1      GLU  17  49.520   3.800  -1.389
  120    H    MET  18           HN       MET  18  53.124   2.033  -2.075
  121    HA   MET  18           HA       MET  18  54.288  -0.585  -1.989
  122   1HB   MET  18           HB2      MET  18  54.686   1.775  -3.457
  123   2HB   MET  18           HB1      MET  18  56.219   1.486  -2.633
  124   1HG   MET  18           HG2      MET  18  56.464   0.220  -4.588
  125   2HG   MET  18           HG1      MET  18  55.890  -0.983  -3.432
  126   1HE   MET  18           HE3      MET  18  54.364   1.974  -5.290
  127   2HE   MET  18           HE2      MET  18  55.092   1.112  -6.641
  128   3HE   MET  18           HE1      MET  18  53.339   1.248  -6.535
  129    H    ILE  19           HN       ILE  19  54.948   2.387  -0.197
  130    HA   ILE  19           HA       ILE  19  57.360   1.607   1.068
  131    HB   ILE  19           HB       ILE  19  55.093   3.377   2.013
  132   1HG1  ILE  19          HG12      ILE  19  57.834   3.904   0.820
  133   2HG1  ILE  19          HG11      ILE  19  56.275   4.210   0.055
  134   1HG2  ILE  19          HG21      ILE  19  57.482   2.385   3.409
  135   2HG2  ILE  19          HG23      ILE  19  57.348   4.143   3.400
  136   3HG2  ILE  19          HG22      ILE  19  56.040   3.162   4.062
  137   1HD1  ILE  19          HD11      ILE  19  57.279   5.540   2.588
  138   2HD1  ILE  19          HD13      ILE  19  57.221   6.289   0.993
  139   3HD1  ILE  19          HD12      ILE  19  55.724   5.847   1.815
  140    H    ALA  20           HN       ALA  20  53.997   0.836   1.830
  141    HA   ALA  20           HA       ALA  20  54.502  -0.317   4.412
  142   1HB   ALA  20           HB1      ALA  20  52.269  -0.103   2.556
  143   2HB   ALA  20           HB3      ALA  20  52.317  -1.686   3.334
  144   3HB   ALA  20           HB2      ALA  20  52.250  -0.222   4.316
  145    H    GLU  21           HN       GLU  21  54.851  -1.521   1.144
  146    HA   GLU  21           HA       GLU  21  55.000  -4.324   1.898
  147   1HB   GLU  21           HB2      GLU  21  55.816  -2.808  -0.592
  148   2HB   GLU  21           HB1      GLU  21  56.007  -4.555  -0.427
  149   1HG   GLU  21           HG2      GLU  21  53.506  -4.582   0.216
  150   2HG   GLU  21           HG1      GLU  21  53.454  -2.948  -0.448
  151    H    PHE  22           HN       PHE  22  57.478  -1.935   0.890
  152    HA   PHE  22           HA       PHE  22  59.739  -3.572   1.311
  153   1HB   PHE  22           HB2      PHE  22  59.416  -0.579   1.680
  154   2HB   PHE  22           HB1      PHE  22  60.972  -1.410   1.670
  155    HD1  PHE  22           HD1      PHE  22  60.905  -3.334  -0.399
  156    HD2  PHE  22           HD2      PHE  22  59.029   0.530  -0.330
  157    HE1  PHE  22           HE1      PHE  22  60.920  -3.282  -2.878
  158    HE2  PHE  22           HE2      PHE  22  59.044   0.582  -2.810
  159    HZ   PHE  22           HZ       PHE  22  59.989  -1.325  -4.083
  160    H    LYS  23           HN       LYS  23  57.701  -1.904   3.623
  161    HA   LYS  23           HA       LYS  23  59.472  -1.945   5.860
  162   1HB   LYS  23           HB2      LYS  23  57.378  -0.662   5.876
  163   2HB   LYS  23           HB1      LYS  23  56.448  -2.159   5.794
  164   1HG   LYS  23           HG2      LYS  23  56.490  -1.500   8.105
  165   2HG   LYS  23           HG1      LYS  23  57.600  -2.864   7.945
  166   1HD   LYS  23           HD2      LYS  23  59.388  -0.979   7.508
  167   2HD   LYS  23           HD1      LYS  23  58.222   0.045   8.345
  168   1HE   LYS  23           HE2      LYS  23  58.521  -2.445   9.768
  169   2HE   LYS  23           HE1      LYS  23  60.105  -1.710   9.515
  170   1HZ   LYS  23           HZ3      LYS  23  58.925   0.428  10.273
  171   2HZ   LYS  23           HZ2      LYS  23  57.757  -0.621  10.925
  172   3HZ   LYS  23           HZ1      LYS  23  59.372  -0.713  11.446
  173    H    ALA  24           HN       ALA  24  57.151  -4.356   4.659
  174    HA   ALA  24           HA       ALA  24  57.502  -6.215   6.807
  175   1HB   ALA  24           HB2      ALA  24  56.030  -6.093   4.396
  176   2HB   ALA  24           HB1      ALA  24  57.006  -7.560   4.302
  177   3HB   ALA  24           HB3      ALA  24  55.909  -7.317   5.662
  178    H    ALA  25           HN       ALA  25  59.299  -5.656   3.818
  179    HA   ALA  25           HA       ALA  25  60.920  -8.060   4.102
  180   1HB   ALA  25           HB1      ALA  25  60.749  -5.771   2.246
  181   2HB   ALA  25           HB3      ALA  25  62.374  -6.418   2.464
  182   3HB   ALA  25           HB2      ALA  25  61.074  -7.472   1.910
  183    H    PHE  26           HN       PHE  26  61.106  -4.748   5.223
  184    HA   PHE  26           HA       PHE  26  63.872  -4.566   5.798
  185   1HB   PHE  26           HB2      PHE  26  62.086  -2.746   6.024
  186   2HB   PHE  26           HB1      PHE  26  61.696  -3.467   7.586
  187    HD1  PHE  26           HD1      PHE  26  64.927  -2.860   5.777
  188    HD2  PHE  26           HD2      PHE  26  62.586  -2.174   9.311
  189    HE1  PHE  26           HE1      PHE  26  66.837  -1.659   6.810
  190    HE2  PHE  26           HE2      PHE  26  64.494  -0.973  10.344
  191    HZ   PHE  26           HZ       PHE  26  66.621  -0.715   9.093
  192    H    ASP  27           HN       ASP  27  61.349  -5.271   8.240
  193    HA   ASP  27           HA       ASP  27  63.102  -6.262  10.211
  194   1HB   ASP  27           HB2      ASP  27  60.195  -6.747   9.608
  195   2HB   ASP  27           HB1      ASP  27  60.987  -7.631  10.913
  196    H    MET  28           HN       MET  28  62.137  -7.703   7.236
  197    HA   MET  28           HA       MET  28  62.394 -10.467   7.906
  198   1HB   MET  28           HB2      MET  28  61.894  -8.982   5.585
  199   2HB   MET  28           HB1      MET  28  63.393  -9.849   5.243
  200   1HG   MET  28           HG2      MET  28  62.371 -11.970   5.777
  201   2HG   MET  28           HG1      MET  28  60.913 -11.174   6.369
  202   1HE   MET  28           HE3      MET  28  63.407 -11.068   3.723
  203   2HE   MET  28           HE2      MET  28  62.700 -12.409   2.825
  204   3HE   MET  28           HE1      MET  28  62.579 -10.770   2.189
  205    H    PHE  29           HN       PHE  29  64.808  -8.163   6.610
  206    HA   PHE  29           HA       PHE  29  66.949 -10.148   7.004
  207   1HB   PHE  29           HB2      PHE  29  67.196  -7.237   6.194
  208   2HB   PHE  29           HB1      PHE  29  68.405  -8.503   5.986
  209    HD1  PHE  29           HD2      PHE  29  65.143  -7.215   4.831
  210    HD2  PHE  29           HD1      PHE  29  68.204 -10.169   4.232
  211    HE1  PHE  29           HE2      PHE  29  64.138  -7.812   2.643
  212    HE2  PHE  29           HE1      PHE  29  67.200 -10.764   2.043
  213    HZ   PHE  29           HZ       PHE  29  65.168  -9.585   1.248
  214    H    ASP  30           HN       ASP  30  65.308  -8.612   9.211
  215    HA   ASP  30           HA       ASP  30  67.635  -7.480  10.690
  216   1HB   ASP  30           HB2      ASP  30  64.875  -6.758  10.487
  217   2HB   ASP  30           HB1      ASP  30  65.199  -7.217  12.159
  218    H    ALA  31           HN       ALA  31  68.673  -9.123  11.757
  219    HA   ALA  31           HA       ALA  31  67.342 -11.497  12.712
  220   1HB   ALA  31           HB1      ALA  31  69.806 -11.301  12.172
  221   2HB   ALA  31           HB3      ALA  31  69.994 -10.380  13.663
  222   3HB   ALA  31           HB2      ALA  31  69.460 -12.059  13.725
  223    H    ASP  32           HN       ASP  32  68.999  -8.990  14.667
  224    HA   ASP  32           HA       ASP  32  67.454  -9.710  17.024
  225   1HB   ASP  32           HB2      ASP  32  69.338  -7.413  16.425
  226   2HB   ASP  32           HB1      ASP  32  68.575  -7.656  17.998
  227    H    GLY  33           HN       GLY  33  67.222  -7.269  14.504
  228   1HA   GLY  33           HA2      GLY  33  65.231  -6.085  13.926
  229   2HA   GLY  33           HA1      GLY  33  64.511  -6.602  15.451
  230    H    GLY  34           HN       GLY  34  67.687  -5.089  15.172
  231   1HA   GLY  34           HA2      GLY  34  67.046  -3.138  17.196
  232   2HA   GLY  34           HA1      GLY  34  68.505  -3.142  16.203
  233    H    GLY  35           HN       GLY  35  66.427  -3.277  13.842
  234   1HA   GLY  35           HA2      GLY  35  64.882  -1.585  12.916
  235   2HA   GLY  35           HA1      GLY  35  65.730  -0.371  13.873
  236    H    ASP  36           HN       ASP  36  67.877  -2.624  12.540
  237    HA   ASP  36           HA       ASP  36  68.214  -1.197   9.983
  238   1HB   ASP  36           HB2      ASP  36  70.486  -1.250  11.987
  239   2HB   ASP  36           HB1      ASP  36  70.455  -0.434  10.425
  240    H    ILE  37           HN       ILE  37  69.175  -2.529   8.463
  241    HA   ILE  37           HA       ILE  37  70.126  -5.173   9.475
  242    HB   ILE  37           HB       ILE  37  68.423  -5.864   8.143
  243   1HG1  ILE  37          HG12      ILE  37  70.690  -6.355   6.909
  244   2HG1  ILE  37          HG11      ILE  37  69.166  -6.675   6.093
  245   1HG2  ILE  37          HG22      ILE  37  67.586  -3.582   7.772
  246   2HG2  ILE  37          HG21      ILE  37  68.747  -3.365   6.461
  247   3HG2  ILE  37          HG23      ILE  37  67.448  -4.549   6.304
  248   1HD1  ILE  37          HD11      ILE  37  69.309  -4.460   4.981
  249   2HD1  ILE  37          HD13      ILE  37  70.869  -4.184   5.757
  250   3HD1  ILE  37          HD12      ILE  37  70.686  -5.486   4.586
  251    H    SER  38           HN       SER  38  71.925  -6.134   8.325
  252    HA   SER  38           HA       SER  38  74.050  -4.240   7.827
  253   1HB   SER  38           HB2      SER  38  74.171  -7.115   6.951
  254   2HB   SER  38           HB1      SER  38  75.451  -6.106   7.621
  255    HG   SER  38           HG       SER  38  73.955  -6.074   9.551
  256    H    THR  39           HN       THR  39  74.862  -3.494   5.875
  257    HA   THR  39           HA       THR  39  73.166  -3.525   3.568
  258    HB   THR  39           HB       THR  39  75.233  -2.584   2.407
  259    HG1  THR  39           HG1      THR  39  76.730  -3.648   3.785
  260   1HG2  THR  39          HG23      THR  39  74.067  -1.435   4.934
  261   2HG2  THR  39          HG22      THR  39  75.277  -0.543   4.009
  262   3HG2  THR  39          HG21      THR  39  73.739  -0.979   3.262
  263    H    LYS  40           HN       LYS  40  75.756  -5.625   4.629
  264    HA   LYS  40           HA       LYS  40  76.387  -6.833   2.120
  265   1HB   LYS  40           HB2      LYS  40  77.279  -8.688   3.442
  266   2HB   LYS  40           HB1      LYS  40  77.715  -7.157   4.203
  267   1HG   LYS  40           HG2      LYS  40  76.522  -7.630   6.063
  268   2HG   LYS  40           HG1      LYS  40  75.126  -8.159   5.123
  269   1HD   LYS  40           HD2      LYS  40  77.304 -10.051   4.856
  270   2HD   LYS  40           HD1      LYS  40  76.910  -9.797   6.556
  271   1HE   LYS  40           HE2      LYS  40  74.417  -9.999   5.647
  272   2HE   LYS  40           HE1      LYS  40  75.210 -10.915   4.364
  273   1HZ   LYS  40           HZ3      LYS  40  76.347 -12.161   6.238
  274   2HZ   LYS  40           HZ2      LYS  40  75.188 -11.467   7.270
  275   3HZ   LYS  40           HZ1      LYS  40  74.698 -12.481   5.997
  276    H    ALA  41           HN       ALA  41  73.631  -7.126   4.205
  277    HA   ALA  41           HA       ALA  41  72.729  -9.666   3.055
  278   1HB   ALA  41           HB2      ALA  41  72.170  -8.934   5.399
  279   2HB   ALA  41           HB1      ALA  41  71.157  -7.667   4.708
  280   3HB   ALA  41           HB3      ALA  41  70.757  -9.362   4.436
  281    H    LEU  42           HN       LEU  42  72.405  -6.278   2.366
  282    HA   LEU  42           HA       LEU  42  69.977  -6.162   0.958
  283   1HB   LEU  42           HB2      LEU  42  72.555  -4.700   0.857
  284   2HB   LEU  42           HB1      LEU  42  71.551  -4.570  -0.584
  285    HG   LEU  42           HG       LEU  42  69.905  -3.380   0.503
  286   1HD1  LEU  42          HD11      LEU  42  70.552  -5.195   2.767
  287   2HD1  LEU  42          HD13      LEU  42  69.919  -3.607   3.204
  288   3HD1  LEU  42          HD12      LEU  42  68.981  -4.676   2.158
  289   1HD2  LEU  42          HD23      LEU  42  72.554  -2.907   1.723
  290   2HD2  LEU  42          HD22      LEU  42  71.468  -1.777   0.918
  291   3HD2  LEU  42          HD21      LEU  42  71.188  -2.221   2.601
  292    H    GLY  43           HN       GLY  43  73.121  -7.409  -0.129
  293   1HA   GLY  43           HA2      GLY  43  72.640  -7.728  -2.861
  294   2HA   GLY  43           HA1      GLY  43  73.556  -8.900  -1.907
  295    H    THR  44           HN       THR  44  71.720  -9.967  -0.237
  296    HA   THR  44           HA       THR  44  70.143 -11.643  -2.016
  297    HB   THR  44           HB       THR  44  70.394 -11.474   0.995
  298    HG1  THR  44           HG1      THR  44  72.130 -12.458   0.163
  299   1HG2  THR  44          HG22      THR  44  68.481 -12.973  -0.728
  300   2HG2  THR  44          HG21      THR  44  69.194 -13.840   0.631
  301   3HG2  THR  44          HG23      THR  44  68.275 -12.362   0.914
  302    H    VAL  45           HN       VAL  45  69.572  -8.748  -0.161
  303    HA   VAL  45           HA       VAL  45  66.722  -9.019   0.129
  304    HB   VAL  45           HB       VAL  45  68.425  -6.515  -0.073
  305   1HG1  VAL  45          HG13      VAL  45  65.565  -6.931   0.116
  306   2HG1  VAL  45          HG12      VAL  45  66.164  -6.121   1.565
  307   3HG1  VAL  45          HG11      VAL  45  66.457  -5.417  -0.026
  308   1HG2  VAL  45          HG23      VAL  45  68.823  -8.339   1.774
  309   2HG2  VAL  45          HG22      VAL  45  68.708  -6.644   2.248
  310   3HG2  VAL  45          HG21      VAL  45  67.322  -7.713   2.455
  311    H    MET  46           HN       MET  46  68.781  -8.123  -2.536
  312    HA   MET  46           HA       MET  46  66.810  -6.729  -4.101
  313   1HB   MET  46           HB2      MET  46  69.389  -8.150  -4.743
  314   2HB   MET  46           HB1      MET  46  68.362  -7.526  -6.034
  315   1HG   MET  46           HG2      MET  46  69.396  -5.875  -3.711
  316   2HG   MET  46           HG1      MET  46  70.102  -5.885  -5.328
  317   1HE   MET  46           HE1      MET  46  69.993  -3.500  -5.355
  318   2HE   MET  46           HE3      MET  46  68.563  -2.477  -5.547
  319   3HE   MET  46           HE2      MET  46  69.003  -3.092  -3.956
  320    H    ARG  47           HN       ARG  47  68.003 -10.107  -4.331
  321    HA   ARG  47           HA       ARG  47  66.141 -10.977  -6.278
  322   1HB   ARG  47           HB2      ARG  47  67.514 -12.464  -4.026
  323   2HB   ARG  47           HB1      ARG  47  66.522 -13.271  -5.241
  324   1HG   ARG  47           HG2      ARG  47  68.069 -12.975  -6.897
  325   2HG   ARG  47           HG1      ARG  47  68.570 -11.398  -6.288
  326   1HD   ARG  47           HD2      ARG  47  70.449 -12.631  -5.746
  327   2HD   ARG  47           HD1      ARG  47  69.506 -12.874  -4.275
  328    HE   ARG  47           HE       ARG  47  68.744 -14.945  -5.995
  329   1HH1  ARG  47          HH21      ARG  47  70.700 -14.523  -3.410
  330   2HH1  ARG  47          HH22      ARG  47  71.886 -15.712  -3.837
  331   1HH2  ARG  47          HH11      ARG  47  70.677 -16.149  -7.057
  332   2HH2  ARG  47          HH12      ARG  47  71.873 -16.634  -5.900
  333    H    MET  48           HN       MET  48  65.767 -10.459  -2.832
  334    HA   MET  48           HA       MET  48  63.349 -11.961  -2.477
  335   1HB   MET  48           HB2      MET  48  64.881  -9.948  -0.971
  336   2HB   MET  48           HB1      MET  48  63.143  -9.890  -0.677
  337   1HG   MET  48           HG2      MET  48  63.476 -11.597   0.766
  338   2HG   MET  48           HG1      MET  48  63.693 -12.609  -0.662
  339   1HE   MET  48           HE3      MET  48  64.851 -13.413   2.031
  340   2HE   MET  48           HE2      MET  48  66.437 -12.806   2.497
  341   3HE   MET  48           HE1      MET  48  65.036 -11.743   2.584
  342    H    LEU  49           HN       LEU  49  63.610  -8.390  -2.528
  343    HA   LEU  49           HA       LEU  49  60.933  -7.794  -2.957
  344   1HB   LEU  49           HB2      LEU  49  63.074  -6.321  -4.490
  345   2HB   LEU  49           HB1      LEU  49  61.611  -5.673  -3.750
  346    HG   LEU  49           HG       LEU  49  64.135  -6.613  -2.381
  347   1HD1  LEU  49          HD12      LEU  49  62.908  -4.076  -3.044
  348   2HD1  LEU  49          HD11      LEU  49  63.111  -4.225  -1.298
  349   3HD1  LEU  49          HD13      LEU  49  64.506  -4.393  -2.365
  350   1HD2  LEU  49          HD23      LEU  49  62.123  -7.589  -1.248
  351   2HD2  LEU  49          HD22      LEU  49  62.970  -6.412  -0.245
  352   3HD2  LEU  49          HD21      LEU  49  61.478  -5.957  -1.068
  353    H    GLY  50           HN       GLY  50  63.359  -8.379  -5.530
  354   1HA   GLY  50           HA2      GLY  50  62.111 -10.039  -7.232
  355   2HA   GLY  50           HA1      GLY  50  61.174  -8.571  -7.514
  356    H    GLN  51           HN       GLN  51  63.215  -6.649  -7.310
  357    HA   GLN  51           HA       GLN  51  64.243  -6.481  -9.887
  358   1HB   GLN  51           HB2      GLN  51  64.786  -5.198  -7.331
  359   2HB   GLN  51           HB1      GLN  51  66.250  -5.339  -8.306
  360   1HG   GLN  51           HG2      GLN  51  64.004  -4.545  -9.955
  361   2HG   GLN  51           HG1      GLN  51  64.208  -3.428  -8.605
  362   1HE2  GLN  51          HE22      GLN  51  67.735  -2.821  -9.659
  363   2HE2  GLN  51          HE21      GLN  51  66.975  -3.397  -8.253
  364    H    ASN  52           HN       ASN  52  66.587  -6.694 -10.579
  365    HA   ASN  52           HA       ASN  52  68.111  -8.788  -9.156
  366   1HB   ASN  52           HB2      ASN  52  66.502  -9.303 -11.517
  367   2HB   ASN  52           HB1      ASN  52  68.210  -9.611 -11.840
  368   1HD2  ASN  52          HD22      ASN  52  66.149 -12.096  -9.372
  369   2HD2  ASN  52          HD21      ASN  52  65.405 -10.740 -10.071
  370    HA   PRO  53           HA       PRO  53  70.589  -5.504 -11.309
  371   1HB   PRO  53           HB2      PRO  53  71.707  -4.463  -9.023
  372   2HB   PRO  53           HB1      PRO  53  70.189  -3.877  -9.727
  373   1HG   PRO  53           HG2      PRO  53  70.606  -5.563  -7.302
  374   2HG   PRO  53           HG1      PRO  53  69.272  -4.464  -7.688
  375   1HD   PRO  53           HD2      PRO  53  69.211  -7.286  -7.906
  376   2HD   PRO  53           HD1      PRO  53  68.019  -6.159  -8.589
  377    H    THR  54           HN       THR  54  73.109  -5.147 -10.830
  378    HA   THR  54           HA       THR  54  74.264  -7.859 -10.570
  379    HB   THR  54           HB       THR  54  76.335  -6.776 -11.428
  380    HG1  THR  54           HG1      THR  54  76.453  -4.670 -11.601
  381   1HG2  THR  54          HG22      THR  54  73.749  -6.871 -12.797
  382   2HG2  THR  54          HG21      THR  54  74.874  -5.732 -13.535
  383   3HG2  THR  54          HG23      THR  54  75.331  -7.424 -13.346
  384    H    LYS  55           HN       LYS  55  75.856  -8.372  -9.019
  385    HA   LYS  55           HA       LYS  55  75.619  -7.254  -6.446
  386   1HB   LYS  55           HB2      LYS  55  77.246  -9.246  -7.728
  387   2HB   LYS  55           HB1      LYS  55  78.270  -8.250  -6.693
  388   1HG   LYS  55           HG2      LYS  55  76.838  -8.652  -4.782
  389   2HG   LYS  55           HG1      LYS  55  75.658  -9.491  -5.790
  390   1HD   LYS  55           HD2      LYS  55  76.846 -11.423  -5.772
  391   2HD   LYS  55           HD1      LYS  55  78.379 -10.583  -6.008
  392   1HE   LYS  55           HE2      LYS  55  78.144 -11.773  -3.777
  393   2HE   LYS  55           HE1      LYS  55  78.547 -10.060  -3.668
  394   1HZ   LYS  55           HZ3      LYS  55  75.734 -10.467  -3.781
  395   2HZ   LYS  55           HZ2      LYS  55  76.419 -11.322  -2.483
  396   3HZ   LYS  55           HZ1      LYS  55  76.654  -9.645  -2.618
  397    H    GLU  56           HN       GLU  56  77.983  -6.509  -9.004
  398    HA   GLU  56           HA       GLU  56  79.619  -4.722  -7.546
  399   1HB   GLU  56           HB2      GLU  56  80.039  -5.548  -9.891
  400   2HB   GLU  56           HB1      GLU  56  78.814  -4.407 -10.451
  401   1HG   GLU  56           HG2      GLU  56  80.342  -2.758 -10.449
  402   2HG   GLU  56           HG1      GLU  56  80.604  -3.001  -8.721
  403    H    GLU  57           HN       GLU  57  76.734  -3.953  -9.530
  404    HA   GLU  57           HA       GLU  57  76.687  -1.173  -8.908
  405   1HB   GLU  57           HB2      GLU  57  74.699  -3.163  -9.918
  406   2HB   GLU  57           HB1      GLU  57  74.088  -1.617  -9.329
  407   1HG   GLU  57           HG2      GLU  57  76.281  -0.892 -10.872
  408   2HG   GLU  57           HG1      GLU  57  75.556  -2.214 -11.787
  409    H    LEU  58           HN       LEU  58  75.624  -3.975  -7.095
  410    HA   LEU  58           HA       LEU  58  73.927  -2.533  -5.249
  411   1HB   LEU  58           HB2      LEU  58  74.007  -5.077  -5.694
  412   2HB   LEU  58           HB1      LEU  58  75.395  -5.091  -4.604
  413    HG   LEU  58           HG       LEU  58  73.288  -3.526  -3.427
  414   1HD1  LEU  58          HD11      LEU  58  72.535  -6.276  -4.441
  415   2HD1  LEU  58          HD13      LEU  58  71.708  -5.500  -3.090
  416   3HD1  LEU  58          HD12      LEU  58  71.671  -4.758  -4.690
  417   1HD2  LEU  58          HD21      LEU  58  75.168  -5.644  -2.783
  418   2HD2  LEU  58          HD23      LEU  58  74.441  -4.441  -1.717
  419   3HD2  LEU  58          HD22      LEU  58  73.598  -5.956  -2.043
  420    H    ASP  59           HN       ASP  59  77.354  -3.486  -5.220
  421    HA   ASP  59           HA       ASP  59  77.950  -2.682  -2.560
  422   1HB   ASP  59           HB2      ASP  59  79.447  -3.320  -4.989
  423   2HB   ASP  59           HB1      ASP  59  80.235  -2.072  -4.023
  424    H    ALA  60           HN       ALA  60  78.143  -0.817  -5.604
  425    HA   ALA  60           HA       ALA  60  79.002   1.619  -4.354
  426   1HB   ALA  60           HB2      ALA  60  78.656   0.775  -6.950
  427   2HB   ALA  60           HB1      ALA  60  77.329   1.920  -6.757
  428   3HB   ALA  60           HB3      ALA  60  78.988   2.440  -6.472
  429    H    ILE  61           HN       ILE  61  75.788   0.324  -5.137
  430    HA   ILE  61           HA       ILE  61  74.263   2.626  -4.485
  431    HB   ILE  61           HB       ILE  61  73.665  -0.333  -4.330
  432   1HG1  ILE  61          HG12      ILE  61  72.724   1.919  -6.135
  433   2HG1  ILE  61          HG11      ILE  61  73.892   0.669  -6.566
  434   1HG2  ILE  61          HG21      ILE  61  72.134   1.955  -3.248
  435   2HG2  ILE  61          HG23      ILE  61  71.211   0.866  -4.284
  436   3HG2  ILE  61          HG22      ILE  61  72.027   0.239  -2.852
  437   1HD1  ILE  61          HD12      ILE  61  71.027   0.127  -5.734
  438   2HD1  ILE  61          HD11      ILE  61  71.594   0.164  -7.404
  439   3HD1  ILE  61          HD13      ILE  61  72.198  -1.066  -6.295
  440    H    ILE  62           HN       ILE  62  75.595   0.071  -2.419
  441    HA   ILE  62           HA       ILE  62  74.266   0.834  -0.007
  442    HB   ILE  62           HB       ILE  62  76.927  -0.525  -0.499
  443   1HG1  ILE  62          HG12      ILE  62  74.405  -1.722   0.645
  444   2HG1  ILE  62          HG11      ILE  62  74.615  -1.571  -1.101
  445   1HG2  ILE  62          HG23      ILE  62  75.495   0.197   2.051
  446   2HG2  ILE  62          HG22      ILE  62  76.506  -1.246   1.974
  447   3HG2  ILE  62          HG21      ILE  62  77.211   0.340   1.666
  448   1HD1  ILE  62          HD11      ILE  62  76.881  -2.738   0.447
  449   2HD1  ILE  62          HD13      ILE  62  75.444  -3.740   0.240
  450   3HD1  ILE  62          HD12      ILE  62  76.306  -3.132  -1.173
  451    H    GLU  63           HN       GLU  63  77.457   1.788  -1.308
  452    HA   GLU  63           HA       GLU  63  78.112   3.533   0.871
  453   1HB   GLU  63           HB2      GLU  63  79.544   2.597  -1.178
  454   2HB   GLU  63           HB1      GLU  63  79.092   4.149  -1.884
  455   1HG   GLU  63           HG2      GLU  63  80.509   5.276  -0.537
  456   2HG   GLU  63           HG1      GLU  63  79.933   4.424   0.895
  457    H    GLU  64           HN       GLU  64  75.875   3.852  -1.713
  458    HA   GLU  64           HA       GLU  64  75.893   6.810  -1.571
  459   1HB   GLU  64           HB2      GLU  64  74.974   4.809  -3.476
  460   2HB   GLU  64           HB1      GLU  64  73.719   6.001  -3.137
  461   1HG   GLU  64           HG2      GLU  64  75.167   7.822  -3.738
  462   2HG   GLU  64           HG1      GLU  64  76.572   6.757  -3.814
  463    H    VAL  65           HN       VAL  65  74.346   4.169  -0.062
  464    HA   VAL  65           HA       VAL  65  71.932   5.755   0.615
  465    HB   VAL  65           HB       VAL  65  72.699   2.912   1.347
  466   1HG1  VAL  65          HG13      VAL  65  70.721   4.666   2.410
  467   2HG1  VAL  65          HG12      VAL  65  69.888   3.467   1.422
  468   3HG1  VAL  65          HG11      VAL  65  70.935   2.946   2.741
  469   1HG2  VAL  65          HG23      VAL  65  71.764   4.048  -1.092
  470   2HG2  VAL  65          HG22      VAL  65  71.947   2.339  -0.698
  471   3HG2  VAL  65          HG21      VAL  65  70.418   3.158  -0.379
  472    H    ASP  66           HN       ASP  66  74.725   4.216   2.201
  473    HA   ASP  66           HA       ASP  66  73.971   5.175   4.843
  474   1HB   ASP  66           HB2      ASP  66  76.442   3.902   3.672
  475   2HB   ASP  66           HB1      ASP  66  76.449   4.544   5.315
  476    H    GLU  67           HN       GLU  67  73.699   7.461   4.525
  477    HA   GLU  67           HA       GLU  67  75.740   9.138   3.387
  478   1HB   GLU  67           HB2      GLU  67  74.488  10.994   4.360
  479   2HB   GLU  67           HB1      GLU  67  73.356   9.828   3.677
  480   1HG   GLU  67           HG2      GLU  67  74.129   9.446   6.530
  481   2HG   GLU  67           HG1      GLU  67  73.066  10.803   6.162
  482    H    ASP  68           HN       ASP  68  75.327   7.677   6.512
  483    HA   ASP  68           HA       ASP  68  77.475   9.403   7.647
  484   1HB   ASP  68           HB2      ASP  68  76.830   8.254   9.811
  485   2HB   ASP  68           HB1      ASP  68  75.554   9.239   9.093
  486    H    GLY  69           HN       GLY  69  77.260   6.622   5.917
  487   1HA   GLY  69           HA2      GLY  69  78.589   4.687   5.746
  488   2HA   GLY  69           HA1      GLY  69  79.887   5.766   6.256
  489    H    SER  70           HN       SER  70  77.051   4.872   8.180
  490    HA   SER  70           HA       SER  70  78.737   4.177  10.440
  491   1HB   SER  70           HB2      SER  70  76.555   3.501  11.488
  492   2HB   SER  70           HB1      SER  70  76.550   5.144  10.853
  493    HG   SER  70           HG       SER  70  75.420   4.433   9.081
  494    H    GLY  71           HN       GLY  71  77.131   2.396   7.875
  495   1HA   GLY  71           HA2      GLY  71  78.017   0.199   7.237
  496   2HA   GLY  71           HA1      GLY  71  78.403  -0.087   8.934
  497    H    THR  72           HN       THR  72  75.406   1.431   8.637
  498    HA   THR  72           HA       THR  72  73.924  -1.138   8.434
  499    HB   THR  72           HB       THR  72  72.593   0.093  10.494
  500    HG1  THR  72           HG1      THR  72  73.983   1.072  11.774
  501   1HG2  THR  72          HG23      THR  72  74.294  -2.207  10.085
  502   2HG2  THR  72          HG22      THR  72  74.514  -1.567  11.714
  503   3HG2  THR  72          HG21      THR  72  72.906  -2.031  11.157
  504    H    ILE  73           HN       ILE  73  71.838  -0.873   7.587
  505    HA   ILE  73           HA       ILE  73  71.218   1.883   6.638
  506    HB   ILE  73           HB       ILE  73  70.059  -0.763   5.719
  507   1HG1  ILE  73          HG12      ILE  73  72.564  -0.380   5.321
  508   2HG1  ILE  73          HG11      ILE  73  71.588  -0.683   3.883
  509   1HG2  ILE  73          HG23      ILE  73  68.661   1.290   5.363
  510   2HG2  ILE  73          HG22      ILE  73  69.990   1.982   4.434
  511   3HG2  ILE  73          HG21      ILE  73  69.176   0.527   3.860
  512   1HD1  ILE  73          HD13      ILE  73  71.708   2.155   4.617
  513   2HD1  ILE  73          HD12      ILE  73  73.286   1.470   4.229
  514   3HD1  ILE  73          HD11      ILE  73  71.976   1.387   3.052
  515    H    ASP  74           HN       ASP  74  69.348   2.894   7.284
  516    HA   ASP  74           HA       ASP  74  67.687   1.458   9.299
  517   1HB   ASP  74           HB2      ASP  74  68.833   3.946   9.418
  518   2HB   ASP  74           HB1      ASP  74  67.211   4.338   8.849
  519    H    PHE  75           HN       PHE  75  65.313   1.792   9.167
  520    HA   PHE  75           HA       PHE  75  64.131   1.047   6.793
  521   1HB   PHE  75           HB2      PHE  75  63.025   1.352   9.085
  522   2HB   PHE  75           HB1      PHE  75  62.804   3.045   8.635
  523    HD1  PHE  75           HD2      PHE  75  62.644  -0.015   6.505
  524    HD2  PHE  75           HD1      PHE  75  60.493   3.275   8.230
  525    HE1  PHE  75           HE2      PHE  75  60.642  -0.629   5.174
  526    HE2  PHE  75           HE1      PHE  75  58.488   2.663   6.901
  527    HZ   PHE  75           HZ       PHE  75  58.563   0.711   5.372
  528    H    GLU  76           HN       GLU  76  64.919   4.362   7.792
  529    HA   GLU  76           HA       GLU  76  63.662   5.630   5.531
  530   1HB   GLU  76           HB2      GLU  76  66.026   6.664   7.120
  531   2HB   GLU  76           HB1      GLU  76  64.852   7.615   6.211
  532   1HG   GLU  76           HG2      GLU  76  63.264   6.110   7.918
  533   2HG   GLU  76           HG1      GLU  76  64.656   6.524   8.918
  534    H    GLU  77           HN       GLU  77  67.058   4.711   6.185
  535    HA   GLU  77           HA       GLU  77  68.129   5.601   3.710
  536   1HB   GLU  77           HB2      GLU  77  68.959   3.305   5.507
  537   2HB   GLU  77           HB1      GLU  77  69.915   3.873   4.138
  538   1HG   GLU  77           HG2      GLU  77  69.992   6.138   5.149
  539   2HG   GLU  77           HG1      GLU  77  69.090   5.533   6.538
  540    H    PHE  78           HN       PHE  78  66.181   2.816   4.485
  541    HA   PHE  78           HA       PHE  78  66.867   1.192   2.219
  542   1HB   PHE  78           HB2      PHE  78  65.224   0.915   4.426
  543   2HB   PHE  78           HB1      PHE  78  64.071   1.021   3.098
  544    HD1  PHE  78           HD1      PHE  78  67.115  -0.781   4.278
  545    HD2  PHE  78           HD2      PHE  78  63.766  -0.783   1.588
  546    HE1  PHE  78           HE1      PHE  78  67.624  -3.123   3.643
  547    HE2  PHE  78           HE2      PHE  78  64.277  -3.124   0.953
  548    HZ   PHE  78           HZ       PHE  78  66.206  -4.296   1.982
  549    H    LEU  79           HN       LEU  79  63.962   3.231   2.738
  550    HA   LEU  79           HA       LEU  79  62.895   3.113   0.165
  551   1HB   LEU  79           HB2      LEU  79  63.047   5.622   1.863
  552   2HB   LEU  79           HB1      LEU  79  61.849   5.264   0.618
  553    HG   LEU  79           HG       LEU  79  62.244   3.771   3.227
  554   1HD1  LEU  79          HD13      LEU  79  61.031   5.995   3.259
  555   2HD1  LEU  79          HD12      LEU  79  59.832   5.277   2.182
  556   3HD1  LEU  79          HD11      LEU  79  60.066   4.622   3.803
  557   1HD2  LEU  79          HD23      LEU  79  61.684   2.240   1.366
  558   2HD2  LEU  79          HD22      LEU  79  60.329   2.398   2.484
  559   3HD2  LEU  79          HD21      LEU  79  60.307   3.258   0.944
  560    H    VAL  80           HN       VAL  80  65.731   4.857   1.270
  561    HA   VAL  80           HA       VAL  80  66.013   6.565  -1.033
  562    HB   VAL  80           HB       VAL  80  68.108   5.501   0.886
  563   1HG1  VAL  80          HG12      VAL  80  68.163   7.566  -1.307
  564   2HG1  VAL  80          HG11      VAL  80  69.245   7.701   0.080
  565   3HG1  VAL  80          HG13      VAL  80  69.325   6.284  -0.966
  566   1HG2  VAL  80          HG23      VAL  80  66.528   8.091   0.818
  567   2HG2  VAL  80          HG22      VAL  80  66.353   6.800   2.006
  568   3HG2  VAL  80          HG21      VAL  80  67.843   7.741   1.939
  569    H    MET  81           HN       MET  81  67.372   3.371  -0.204
  570    HA   MET  81           HA       MET  81  69.004   3.039  -2.485
  571   1HB   MET  81           HB2      MET  81  68.494   1.499  -0.343
  572   2HB   MET  81           HB1      MET  81  67.483   0.665  -1.524
  573   1HG   MET  81           HG2      MET  81  69.325   0.228  -2.957
  574   2HG   MET  81           HG1      MET  81  70.351   1.395  -2.120
  575   1HE   MET  81           HE2      MET  81  70.233   1.412   0.330
  576   2HE   MET  81           HE1      MET  81  69.550   0.112   1.301
  577   3HE   MET  81           HE3      MET  81  71.296   0.201   1.039
  578    H    MET  82           HN       MET  82  65.541   2.304  -2.051
  579    HA   MET  82           HA       MET  82  65.124   1.154  -4.628
  580   1HB   MET  82           HB2      MET  82  63.176   2.745  -2.929
  581   2HB   MET  82           HB1      MET  82  62.744   1.673  -4.260
  582   1HG   MET  82           HG2      MET  82  64.443   0.573  -2.058
  583   2HG   MET  82           HG1      MET  82  62.722   0.804  -1.747
  584   1HE   MET  82           HE2      MET  82  65.478  -0.669  -3.249
  585   2HE   MET  82           HE1      MET  82  64.954  -2.350  -3.207
  586   3HE   MET  82           HE3      MET  82  65.008  -1.475  -4.743
  587    H    VAL  83           HN       VAL  83  64.320   4.482  -3.551
  588    HA   VAL  83           HA       VAL  83  63.805   5.460  -6.184
  589    HB   VAL  83           HB       VAL  83  64.854   7.121  -3.882
  590   1HG1  VAL  83          HG13      VAL  83  63.988   7.724  -6.495
  591   2HG1  VAL  83          HG12      VAL  83  62.657   8.193  -5.436
  592   3HG1  VAL  83          HG11      VAL  83  64.268   8.866  -5.181
  593   1HG2  VAL  83          HG22      VAL  83  62.661   5.388  -3.772
  594   2HG2  VAL  83          HG21      VAL  83  62.957   6.759  -2.703
  595   3HG2  VAL  83          HG23      VAL  83  61.952   6.959  -4.138
  596    H    ARG  84           HN       ARG  84  66.731   4.587  -4.683
  597    HA   ARG  84           HA       ARG  84  68.530   6.474  -5.855
  598   1HB   ARG  84           HB2      ARG  84  68.760   4.294  -4.162
  599   2HB   ARG  84           HB1      ARG  84  69.586   3.751  -5.623
  600   1HG   ARG  84           HG2      ARG  84  71.345   4.866  -4.664
  601   2HG   ARG  84           HG1      ARG  84  70.587   6.243  -5.465
  602   1HD   ARG  84           HD2      ARG  84  69.320   5.767  -2.914
  603   2HD   ARG  84           HD1      ARG  84  71.063   5.934  -2.700
  604    HE   ARG  84           HE       ARG  84  69.232   8.055  -3.477
  605   1HH1  ARG  84          HH11      ARG  84  72.277   7.464  -2.361
  606   2HH1  ARG  84          HH12      ARG  84  73.073   8.705  -3.270
  607   1HH2  ARG  84          HH21      ARG  84  70.317   9.382  -5.262
  608   2HH2  ARG  84          HH22      ARG  84  71.964   9.790  -4.914
  609    H    GLN  85           HN       GLN  85  67.496   3.231  -6.963
  610    HA   GLN  85           HA       GLN  85  68.894   3.579  -9.513
  611   1HB   GLN  85           HB2      GLN  85  67.377   1.429  -8.151
  612   2HB   GLN  85           HB1      GLN  85  67.272   1.431  -9.911
  613   1HG   GLN  85           HG2      GLN  85  69.829   1.442  -8.281
  614   2HG   GLN  85           HG1      GLN  85  69.185   0.075  -9.190
  615   1HE2  GLN  85          HE21      GLN  85  69.021   0.382 -11.615
  616   2HE2  GLN  85          HE22      GLN  85  70.114   1.430 -12.380
  617    H    MET  86           HN       MET  86  65.590   3.871  -8.303
  618    HA   MET  86           HA       MET  86  64.071   3.893 -10.621
  619   1HB   MET  86           HB2      MET  86  63.931   5.295  -8.031
  620   2HB   MET  86           HB1      MET  86  63.072   6.108  -9.339
  621   1HG   MET  86           HG2      MET  86  62.353   3.485  -9.737
  622   2HG   MET  86           HG1      MET  86  62.448   3.572  -7.979
  623   1HE   MET  86           HE1      MET  86  60.698   3.334  -7.142
  624   2HE   MET  86           HE3      MET  86  59.911   4.825  -6.606
  625   3HE   MET  86           HE2      MET  86  59.076   3.730  -7.706
  626    H    LYS  87           HN       LYS  87  64.879   7.099  -9.351
  627    HA   LYS  87           HA       LYS  87  66.080   7.818 -11.975
  628   1HB   LYS  87           HB2      LYS  87  64.675   9.958 -11.882
  629   2HB   LYS  87           HB1      LYS  87  63.815   8.481 -12.314
  630   1HG   LYS  87           HG2      LYS  87  62.741   8.339 -10.255
  631   2HG   LYS  87           HG1      LYS  87  63.993   9.266  -9.425
  632   1HD   LYS  87           HD2      LYS  87  62.326  10.571 -11.561
  633   2HD   LYS  87           HD1      LYS  87  61.692  10.411  -9.923
  634   1HE   LYS  87           HE2      LYS  87  63.584  11.624  -9.010
  635   2HE   LYS  87           HE1      LYS  87  64.370  11.663 -10.590
  636   1HZ   LYS  87           HZ2      LYS  87  61.674  12.719 -10.511
  637   2HZ   LYS  87           HZ1      LYS  87  62.827  13.621  -9.651
  638   3HZ   LYS  87           HZ3      LYS  87  63.054  13.314 -11.302
  639    H    GLU  88           HN       GLU  88  68.104   8.172 -11.026
  640    HA   GLU  88           HA       GLU  88  68.454  10.695  -9.642
  641   1HB   GLU  88           HB2      GLU  88  67.956   8.422  -8.017
  642   2HB   GLU  88           HB1      GLU  88  69.674   8.784  -7.868
  643   1HG   GLU  88           HG2      GLU  88  69.166  10.487  -6.490
  644   2HG   GLU  88           HG1      GLU  88  68.311  11.272  -7.817
  645    H    ASP  89           HN       ASP  89  69.570  10.069 -11.968
  646    HA   ASP  89           HA       ASP  89  72.431   9.727 -11.276
  647   1HB   ASP  89           HB2      ASP  89  72.585   8.230 -13.406
  648   2HB   ASP  89           HB1      ASP  89  72.027   7.496 -11.902
  649    H    ALA  90           HN       ALA  90  70.301  11.717 -12.470
  650    HA   ALA  90           HA       ALA  90  72.075  12.608 -14.705
  651   1HB   ALA  90           HB2      ALA  90  69.595  11.658 -15.158
  652   2HB   ALA  90           HB1      ALA  90  69.190  13.336 -14.796
  653   3HB   ALA  90           HB3      ALA  90  70.299  12.961 -16.116
   
  No H/Q in entry =         653
  Start of MODEL   33
    1   1H    ALA   1           HT1      ALA   1  67.347  10.733  11.951
    2   2H    ALA   1           HT3      ALA   1  66.681   9.731  13.146
    3   3H    ALA   1           HT2      ALA   1  66.127   9.625  11.544
    4    HA   ALA   1           HA       ALA   1  64.462  10.859  12.499
    5   1HB   ALA   1           HB3      ALA   1  66.464  11.318  14.460
    6   2HB   ALA   1           HB2      ALA   1  65.893  12.902  13.931
    7   3HB   ALA   1           HB1      ALA   1  64.747  11.717  14.559
    8    H    SER   2           HN       SER   2  67.409  12.877  12.152
    9    HA   SER   2           HA       SER   2  66.290  15.088  10.902
   10   1HB   SER   2           HB2      SER   2  68.438  15.675  10.367
   11   2HB   SER   2           HB1      SER   2  68.835  14.314  11.413
   12    HG   SER   2           HG       SER   2  69.831  13.697   9.637
   13    H    MET   3           HN       MET   3  66.218  15.678   8.564
   14    HA   MET   3           HA       MET   3  65.606  13.296   6.857
   15   1HB   MET   3           HB2      MET   3  64.005  14.965   5.682
   16   2HB   MET   3           HB1      MET   3  63.502  14.301   7.237
   17   1HG   MET   3           HG2      MET   3  65.137  16.761   7.397
   18   2HG   MET   3           HG1      MET   3  63.544  16.969   6.670
   19   1HE   MET   3           HE1      MET   3  65.250  17.784   9.085
   20   2HE   MET   3           HE3      MET   3  63.839  18.425   9.937
   21   3HE   MET   3           HE2      MET   3  64.817  17.159  10.674
   22    H    THR   4           HN       THR   4  67.267  13.162   5.416
   23    HA   THR   4           HA       THR   4  68.581  15.639   4.466
   24    HB   THR   4           HB       THR   4  70.327  14.263   3.708
   25    HG1  THR   4           HG1      THR   4  68.411  12.176   3.706
   26   1HG2  THR   4          HG22      THR   4  70.098  14.149   6.162
   27   2HG2  THR   4          HG21      THR   4  69.060  12.734   5.997
   28   3HG2  THR   4          HG23      THR   4  70.754  12.647   5.515
   29    H    ASP   5           HN       ASP   5  69.065  15.672   2.013
   30    HA   ASP   5           HA       ASP   5  66.575  15.726   0.591
   31   1HB   ASP   5           HB2      ASP   5  69.321  15.633  -0.676
   32   2HB   ASP   5           HB1      ASP   5  67.860  16.387  -1.315
   33    H    GLN   6           HN       GLN   6  69.171  13.339   0.803
   34    HA   GLN   6           HA       GLN   6  68.445  11.672  -1.362
   35   1HB   GLN   6           HB2      GLN   6  70.171  11.515   0.898
   36   2HB   GLN   6           HB1      GLN   6  69.195  10.045   0.880
   37   1HG   GLN   6           HG2      GLN   6  69.782  10.154  -1.732
   38   2HG   GLN   6           HG1      GLN   6  71.187  11.023  -1.114
   39   1HE2  GLN   6          HE22      GLN   6  71.936   8.020   1.044
   40   2HE2  GLN   6          HE21      GLN   6  71.477   9.617   1.390
   41    H    GLN   7           HN       GLN   7  67.348  11.494   2.043
   42    HA   GLN   7           HA       GLN   7  65.361   9.457   1.401
   43   1HB   GLN   7           HB2      GLN   7  66.118  11.029   3.843
   44   2HB   GLN   7           HB1      GLN   7  64.563  10.197   3.807
   45   1HG   GLN   7           HG2      GLN   7  65.549   8.080   3.627
   46   2HG   GLN   7           HG1      GLN   7  67.065   8.733   3.007
   47   1HE2  GLN   7          HE22      GLN   7  68.114   8.085   6.382
   48   2HE2  GLN   7          HE21      GLN   7  68.065   7.407   4.828
   49    H    ALA   8           HN       ALA   8  65.509  12.848   1.112
   50    HA   ALA   8           HA       ALA   8  62.732  13.469   1.614
   51   1HB   ALA   8           HB2      ALA   8  64.951  14.982   1.218
   52   2HB   ALA   8           HB1      ALA   8  64.212  15.094  -0.380
   53   3HB   ALA   8           HB3      ALA   8  63.312  15.609   1.046
   54    H    GLU   9           HN       GLU   9  64.562  13.000  -1.432
   55    HA   GLU   9           HA       GLU   9  62.175  13.054  -3.067
   56   1HB   GLU   9           HB2      GLU   9  65.052  12.306  -3.508
   57   2HB   GLU   9           HB1      GLU   9  63.850  11.892  -4.730
   58   1HG   GLU   9           HG2      GLU   9  63.122  14.432  -4.337
   59   2HG   GLU   9           HG1      GLU   9  64.811  14.579  -3.853
   60    H    ALA  10           HN       ALA  10  63.792  10.602  -1.216
   61    HA   ALA  10           HA       ALA  10  62.768   8.310  -2.636
   62   1HB   ALA  10           HB1      ALA  10  64.100   8.827  -0.034
   63   2HB   ALA  10           HB3      ALA  10  63.106   7.373  -0.115
   64   3HB   ALA  10           HB2      ALA  10  64.440   7.594  -1.248
   65    H    ARG  11           HN       ARG  11  61.728   9.806   0.452
   66    HA   ARG  11           HA       ARG  11  59.318   8.250   0.632
   67   1HB   ARG  11           HB2      ARG  11  60.638  10.309   2.153
   68   2HB   ARG  11           HB1      ARG  11  58.929  10.709   1.985
   69   1HG   ARG  11           HG2      ARG  11  58.248   8.624   2.935
   70   2HG   ARG  11           HG1      ARG  11  59.881   7.962   2.819
   71   1HD   ARG  11           HD2      ARG  11  60.519   9.998   4.346
   72   2HD   ARG  11           HD1      ARG  11  58.801  10.007   4.740
   73    HE   ARG  11           HE       ARG  11  59.668   7.345   5.039
   74   1HH1  ARG  11          HH11      ARG  11  60.747  10.398   6.188
   75   2HH1  ARG  11          HH12      ARG  11  61.013   9.849   7.810
   76   1HH2  ARG  11          HH21      ARG  11  59.829   6.646   7.205
   77   2HH2  ARG  11          HH22      ARG  11  60.494   7.727   8.384
   78    H    ALA  12           HN       ALA  12  60.129  11.225  -1.024
   79    HA   ALA  12           HA       ALA  12  57.413  12.140  -1.405
   80   1HB   ALA  12           HB1      ALA  12  60.013  12.732  -2.832
   81   2HB   ALA  12           HB3      ALA  12  58.486  13.479  -3.300
   82   3HB   ALA  12           HB2      ALA  12  59.147  13.757  -1.688
   83    H    PHE  13           HN       PHE  13  59.552   9.973  -3.203
   84    HA   PHE  13           HA       PHE  13  57.613   9.757  -5.413
   85   1HB   PHE  13           HB2      PHE  13  60.010   9.688  -5.937
   86   2HB   PHE  13           HB1      PHE  13  60.215   8.289  -4.884
   87    HD1  PHE  13           HD2      PHE  13  59.258   6.098  -5.489
   88    HD2  PHE  13           HD1      PHE  13  58.945   9.489  -8.108
   89    HE1  PHE  13           HE2      PHE  13  58.620   4.596  -7.357
   90    HE2  PHE  13           HE1      PHE  13  58.307   7.987  -9.975
   91    HZ   PHE  13           HZ       PHE  13  58.146   5.540  -9.601
   92    H    LEU  14           HN       LEU  14  58.446   8.073  -2.480
   93    HA   LEU  14           HA       LEU  14  56.974   5.647  -3.298
   94   1HB   LEU  14           HB2      LEU  14  58.168   6.323  -0.596
   95   2HB   LEU  14           HB1      LEU  14  57.678   4.730  -1.171
   96    HG   LEU  14           HG       LEU  14  59.732   6.342  -2.672
   97   1HD1  LEU  14          HD11      LEU  14  60.181   5.829  -0.084
   98   2HD1  LEU  14          HD13      LEU  14  60.598   4.242  -0.733
   99   3HD1  LEU  14          HD12      LEU  14  61.457   5.677  -1.292
  100   1HD2  LEU  14          HD23      LEU  14  58.816   3.480  -2.520
  101   2HD2  LEU  14          HD22      LEU  14  59.066   4.493  -3.943
  102   3HD2  LEU  14          HD21      LEU  14  60.453   3.845  -3.068
  103    H    SER  15           HN       SER  15  54.993   5.011  -2.367
  104    HA   SER  15           HA       SER  15  53.450   7.239  -1.146
  105   1HB   SER  15           HB2      SER  15  52.797   4.879  -2.808
  106   2HB   SER  15           HB1      SER  15  51.632   5.245  -1.540
  107    HG   SER  15           HG       SER  15  51.007   6.882  -2.685
  108    H    GLU  16           HN       GLU  16  51.794   6.448   0.566
  109    HA   GLU  16           HA       GLU  16  53.205   5.410   2.809
  110   1HB   GLU  16           HB2      GLU  16  50.218   5.525   2.295
  111   2HB   GLU  16           HB1      GLU  16  50.961   5.219   3.865
  112   1HG   GLU  16           HG2      GLU  16  51.995   7.397   3.883
  113   2HG   GLU  16           HG1      GLU  16  51.515   7.695   2.213
  114    H    GLU  17           HN       GLU  17  50.825   3.823   0.662
  115    HA   GLU  17           HA       GLU  17  51.032   1.260   1.965
  116   1HB   GLU  17           HB2      GLU  17  49.899   0.404  -0.079
  117   2HB   GLU  17           HB1      GLU  17  49.095   1.829   0.578
  118   1HG   GLU  17           HG2      GLU  17  49.970   3.244  -1.103
  119   2HG   GLU  17           HG1      GLU  17  51.207   2.072  -1.562
  120    H    MET  18           HN       MET  18  52.816   2.805  -0.657
  121    HA   MET  18           HA       MET  18  54.139   0.401  -1.561
  122   1HB   MET  18           HB2      MET  18  54.066   3.122  -2.326
  123   2HB   MET  18           HB1      MET  18  55.754   2.757  -1.967
  124   1HG   MET  18           HG2      MET  18  55.301   0.583  -3.363
  125   2HG   MET  18           HG1      MET  18  53.946   1.505  -4.014
  126   1HE   MET  18           HE2      MET  18  56.681   0.153  -4.671
  127   2HE   MET  18           HE1      MET  18  57.200   0.981  -6.138
  128   3HE   MET  18           HE3      MET  18  58.089   1.210  -4.626
  129    H    ILE  19           HN       ILE  19  54.774   2.727   0.998
  130    HA   ILE  19           HA       ILE  19  57.468   1.655   1.488
  131    HB   ILE  19           HB       ILE  19  55.753   3.706   2.907
  132   1HG1  ILE  19          HG12      ILE  19  58.436   4.426   1.987
  133   2HG1  ILE  19          HG11      ILE  19  57.410   3.849   0.672
  134   1HG2  ILE  19          HG22      ILE  19  57.998   2.151   3.912
  135   2HG2  ILE  19          HG21      ILE  19  58.376   3.872   3.878
  136   3HG2  ILE  19          HG23      ILE  19  56.965   3.296   4.766
  137   1HD1  ILE  19          HD13      ILE  19  55.967   5.634   2.472
  138   2HD1  ILE  19          HD12      ILE  19  57.384   6.415   1.769
  139   3HD1  ILE  19          HD11      ILE  19  56.148   5.720   0.720
  140    H    ALA  20           HN       ALA  20  54.208   1.146   2.626
  141    HA   ALA  20           HA       ALA  20  54.891  -0.144   5.116
  142   1HB   ALA  20           HB2      ALA  20  52.452  -0.159   3.341
  143   2HB   ALA  20           HB1      ALA  20  52.550  -1.211   4.752
  144   3HB   ALA  20           HB3      ALA  20  52.635   0.539   4.948
  145    H    GLU  21           HN       GLU  21  54.269  -1.325   1.825
  146    HA   GLU  21           HA       GLU  21  54.512  -4.106   2.399
  147   1HB   GLU  21           HB2      GLU  21  53.687  -3.800   0.268
  148   2HB   GLU  21           HB1      GLU  21  54.679  -2.374  -0.024
  149   1HG   GLU  21           HG2      GLU  21  56.629  -3.725  -0.444
  150   2HG   GLU  21           HG1      GLU  21  55.797  -5.186   0.087
  151    H    PHE  22           HN       PHE  22  56.943  -1.657   1.508
  152    HA   PHE  22           HA       PHE  22  59.173  -3.443   1.374
  153   1HB   PHE  22           HB2      PHE  22  59.014  -0.496   2.070
  154   2HB   PHE  22           HB1      PHE  22  60.531  -1.362   1.819
  155    HD1  PHE  22           HD1      PHE  22  59.844  -3.188  -0.390
  156    HD2  PHE  22           HD2      PHE  22  58.807   0.936   0.209
  157    HE1  PHE  22           HE1      PHE  22  59.610  -2.892  -2.840
  158    HE2  PHE  22           HE2      PHE  22  58.571   1.234  -2.241
  159    HZ   PHE  22           HZ       PHE  22  58.973  -0.680  -3.767
  160    H    LYS  23           HN       LYS  23  57.760  -1.618   4.084
  161    HA   LYS  23           HA       LYS  23  59.724  -2.182   6.039
  162   1HB   LYS  23           HB2      LYS  23  57.335  -0.866   6.049
  163   2HB   LYS  23           HB1      LYS  23  56.915  -2.317   6.962
  164   1HG   LYS  23           HG2      LYS  23  59.466  -0.883   7.619
  165   2HG   LYS  23           HG1      LYS  23  57.940  -0.219   8.201
  166   1HD   LYS  23           HD2      LYS  23  57.395  -2.449   9.190
  167   2HD   LYS  23           HD1      LYS  23  58.994  -3.016   8.706
  168   1HE   LYS  23           HE2      LYS  23  59.878  -0.946  10.007
  169   2HE   LYS  23           HE1      LYS  23  58.279  -0.924  10.754
  170   1HZ   LYS  23           HZ2      LYS  23  59.936  -3.373  10.652
  171   2HZ   LYS  23           HZ1      LYS  23  60.064  -2.252  11.922
  172   3HZ   LYS  23           HZ3      LYS  23  58.594  -3.050  11.642
  173    H    ALA  24           HN       ALA  24  57.147  -4.200   4.743
  174    HA   ALA  24           HA       ALA  24  57.175  -6.241   6.731
  175   1HB   ALA  24           HB3      ALA  24  55.662  -5.848   4.572
  176   2HB   ALA  24           HB2      ALA  24  56.813  -6.976   3.855
  177   3HB   ALA  24           HB1      ALA  24  55.866  -7.459   5.262
  178    H    ALA  25           HN       ALA  25  59.044  -5.938   3.697
  179    HA   ALA  25           HA       ALA  25  60.568  -8.357   4.223
  180   1HB   ALA  25           HB1      ALA  25  60.540  -6.219   2.163
  181   2HB   ALA  25           HB3      ALA  25  62.084  -7.035   2.408
  182   3HB   ALA  25           HB2      ALA  25  60.653  -7.968   1.968
  183    H    PHE  26           HN       PHE  26  60.750  -5.114   5.321
  184    HA   PHE  26           HA       PHE  26  63.544  -4.787   5.690
  185   1HB   PHE  26           HB2      PHE  26  61.730  -3.049   6.073
  186   2HB   PHE  26           HB1      PHE  26  61.401  -3.846   7.612
  187    HD1  PHE  26           HD1      PHE  26  64.425  -2.768   5.667
  188    HD2  PHE  26           HD2      PHE  26  62.422  -2.885   9.461
  189    HE1  PHE  26           HE1      PHE  26  66.320  -1.547   6.703
  190    HE2  PHE  26           HE2      PHE  26  64.315  -1.664  10.500
  191    HZ   PHE  26           HZ       PHE  26  66.265  -0.994   9.121
  192    H    ASP  27           HN       ASP  27  61.268  -5.600   8.325
  193    HA   ASP  27           HA       ASP  27  63.228  -6.599  10.095
  194   1HB   ASP  27           HB2      ASP  27  61.335  -7.778  11.214
  195   2HB   ASP  27           HB1      ASP  27  60.955  -6.097  10.840
  196    H    MET  28           HN       MET  28  61.976  -8.006   7.216
  197    HA   MET  28           HA       MET  28  62.263 -10.777   7.839
  198   1HB   MET  28           HB2      MET  28  61.933  -9.143   5.435
  199   2HB   MET  28           HB1      MET  28  62.941 -10.564   5.155
  200   1HG   MET  28           HG2      MET  28  60.903 -11.591   6.699
  201   2HG   MET  28           HG1      MET  28  60.060 -10.393   5.716
  202   1HE   MET  28           HE3      MET  28  61.217  -9.930   3.452
  203   2HE   MET  28           HE2      MET  28  62.609 -10.933   3.051
  204   3HE   MET  28           HE1      MET  28  61.094 -11.154   2.181
  205    H    PHE  29           HN       PHE  29  64.583  -8.493   6.345
  206    HA   PHE  29           HA       PHE  29  66.715 -10.496   6.417
  207   1HB   PHE  29           HB2      PHE  29  67.291  -7.580   6.070
  208   2HB   PHE  29           HB1      PHE  29  67.991  -8.966   5.235
  209    HD1  PHE  29           HD1      PHE  29  66.035 -10.441   3.982
  210    HD2  PHE  29           HD2      PHE  29  65.960  -6.215   4.745
  211    HE1  PHE  29           HE1      PHE  29  64.425 -10.135   2.120
  212    HE2  PHE  29           HE2      PHE  29  64.350  -5.908   2.880
  213    HZ   PHE  29           HZ       PHE  29  63.583  -7.868   1.568
  214    H    ASP  30           HN       ASP  30  65.296  -8.579   8.753
  215    HA   ASP  30           HA       ASP  30  67.786  -8.001  10.231
  216   1HB   ASP  30           HB2      ASP  30  64.932  -7.239  10.448
  217   2HB   ASP  30           HB1      ASP  30  65.787  -7.414  11.980
  218    H    ALA  31           HN       ALA  31  68.458 -10.240  10.531
  219    HA   ALA  31           HA       ALA  31  66.739 -12.099  11.968
  220   1HB   ALA  31           HB3      ALA  31  69.690 -12.117  11.288
  221   2HB   ALA  31           HB2      ALA  31  68.899 -13.425  12.166
  222   3HB   ALA  31           HB1      ALA  31  68.405 -13.044  10.516
  223    H    ASP  32           HN       ASP  32  69.240  -9.773  12.827
  224    HA   ASP  32           HA       ASP  32  69.459 -10.715  15.582
  225   1HB   ASP  32           HB2      ASP  32  70.382  -8.163  14.227
  226   2HB   ASP  32           HB1      ASP  32  70.756  -8.590  15.898
  227    H    GLY  33           HN       GLY  33  67.491  -8.413  13.829
  228   1HA   GLY  33           HA2      GLY  33  65.478  -7.410  14.581
  229   2HA   GLY  33           HA1      GLY  33  65.780  -8.080  16.184
  230    H    GLY  34           HN       GLY  34  67.973  -6.054  14.258
  231   1HA   GLY  34           HA2      GLY  34  68.069  -4.163  16.549
  232   2HA   GLY  34           HA1      GLY  34  69.274  -4.273  15.266
  233    H    GLY  35           HN       GLY  35  66.269  -4.462  13.842
  234   1HA   GLY  35           HA2      GLY  35  64.876  -2.886  12.775
  235   2HA   GLY  35           HA1      GLY  35  65.585  -1.637  13.800
  236    H    ASP  36           HN       ASP  36  67.785  -3.645  12.059
  237    HA   ASP  36           HA       ASP  36  67.918  -1.991   9.670
  238   1HB   ASP  36           HB2      ASP  36  70.395  -1.351  10.330
  239   2HB   ASP  36           HB1      ASP  36  69.051  -0.348  10.872
  240    H    ILE  37           HN       ILE  37  68.973  -3.141   8.069
  241    HA   ILE  37           HA       ILE  37  70.318  -5.657   8.947
  242    HB   ILE  37           HB       ILE  37  69.615  -6.681   6.952
  243   1HG1  ILE  37          HG12      ILE  37  68.977  -3.953   5.791
  244   2HG1  ILE  37          HG11      ILE  37  70.470  -4.836   5.468
  245   1HG2  ILE  37          HG23      ILE  37  67.662  -5.035   8.330
  246   2HG2  ILE  37          HG22      ILE  37  67.214  -5.265   6.639
  247   3HG2  ILE  37          HG21      ILE  37  67.487  -6.664   7.680
  248   1HD1  ILE  37          HD12      ILE  37  67.792  -6.132   5.013
  249   2HD1  ILE  37          HD11      ILE  37  68.509  -5.092   3.785
  250   3HD1  ILE  37          HD13      ILE  37  69.352  -6.549   4.308
  251    H    SER  38           HN       SER  38  72.485  -5.892   8.516
  252    HA   SER  38           HA       SER  38  74.130  -3.762   7.730
  253   1HB   SER  38           HB2      SER  38  74.748  -6.655   7.086
  254   2HB   SER  38           HB1      SER  38  75.891  -5.363   7.433
  255    HG   SER  38           HG       SER  38  75.537  -6.705   9.251
  256    H    THR  39           HN       THR  39  75.249  -3.382   5.638
  257    HA   THR  39           HA       THR  39  73.383  -3.577   3.426
  258    HB   THR  39           HB       THR  39  74.899  -2.279   2.189
  259    HG1  THR  39           HG1      THR  39  76.703  -3.635   2.476
  260   1HG2  THR  39          HG21      THR  39  74.687  -1.694   5.063
  261   2HG2  THR  39          HG23      THR  39  76.031  -0.881   4.266
  262   3HG2  THR  39          HG22      THR  39  74.386  -0.652   3.675
  263    H    LYS  40           HN       LYS  40  75.409  -5.837   4.754
  264    HA   LYS  40           HA       LYS  40  76.449  -7.044   2.321
  265   1HB   LYS  40           HB2      LYS  40  76.745  -9.065   3.886
  266   2HB   LYS  40           HB1      LYS  40  77.626  -7.599   4.317
  267   1HG   LYS  40           HG2      LYS  40  76.519  -7.432   6.270
  268   2HG   LYS  40           HG1      LYS  40  74.961  -7.553   5.454
  269   1HD   LYS  40           HD2      LYS  40  75.898 -10.135   5.278
  270   2HD   LYS  40           HD1      LYS  40  76.508  -9.628   6.854
  271   1HE   LYS  40           HE2      LYS  40  73.821  -8.681   6.588
  272   2HE   LYS  40           HE1      LYS  40  73.848 -10.393   6.168
  273   1HZ   LYS  40           HZ2      LYS  40  75.059  -9.239   8.620
  274   2HZ   LYS  40           HZ1      LYS  40  73.538  -9.993   8.559
  275   3HZ   LYS  40           HZ3      LYS  40  74.941 -10.887   8.227
  276    H    ALA  41           HN       ALA  41  73.532  -7.370   4.271
  277    HA   ALA  41           HA       ALA  41  72.581  -9.638   2.635
  278   1HB   ALA  41           HB3      ALA  41  72.167  -9.135   5.223
  279   2HB   ALA  41           HB2      ALA  41  70.810  -8.211   4.577
  280   3HB   ALA  41           HB1      ALA  41  70.942  -9.937   4.240
  281    H    LEU  42           HN       LEU  42  72.518  -6.234   2.565
  282    HA   LEU  42           HA       LEU  42  69.977  -5.630   1.510
  283   1HB   LEU  42           HB2      LEU  42  72.663  -4.415   1.426
  284   2HB   LEU  42           HB1      LEU  42  71.653  -4.005   0.043
  285    HG   LEU  42           HG       LEU  42  71.240  -2.340   1.728
  286   1HD1  LEU  42          HD11      LEU  42  69.226  -4.078   0.778
  287   2HD1  LEU  42          HD13      LEU  42  68.842  -3.755   2.469
  288   3HD1  LEU  42          HD12      LEU  42  69.034  -2.417   1.334
  289   1HD2  LEU  42          HD22      LEU  42  71.537  -4.631   3.506
  290   2HD2  LEU  42          HD21      LEU  42  71.707  -2.911   3.858
  291   3HD2  LEU  42          HD23      LEU  42  70.115  -3.666   3.903
  292    H    GLY  43           HN       GLY  43  72.628  -7.372   0.088
  293   1HA   GLY  43           HA2      GLY  43  71.800  -7.055  -2.673
  294   2HA   GLY  43           HA1      GLY  43  72.924  -8.274  -2.068
  295    H    THR  44           HN       THR  44  71.153  -9.449  -0.134
  296    HA   THR  44           HA       THR  44  69.738 -11.293  -1.837
  297    HB   THR  44           HB       THR  44  69.544 -10.830   1.156
  298    HG1  THR  44           HG1      THR  44  71.592 -11.479   0.412
  299   1HG2  THR  44          HG21      THR  44  67.746 -12.201  -0.381
  300   2HG2  THR  44          HG23      THR  44  68.908 -13.471   0.007
  301   3HG2  THR  44          HG22      THR  44  68.108 -12.584   1.304
  302    H    VAL  45           HN       VAL  45  68.747  -8.523   0.138
  303    HA   VAL  45           HA       VAL  45  65.948  -8.808  -0.027
  304    HB   VAL  45           HB       VAL  45  67.562  -6.243  -0.155
  305   1HG1  VAL  45          HG12      VAL  45  64.661  -6.881   0.238
  306   2HG1  VAL  45          HG11      VAL  45  65.354  -5.517   1.117
  307   3HG1  VAL  45          HG13      VAL  45  65.403  -5.547  -0.647
  308   1HG2  VAL  45          HG22      VAL  45  66.618  -8.003   2.108
  309   2HG2  VAL  45          HG21      VAL  45  68.235  -7.365   1.819
  310   3HG2  VAL  45          HG23      VAL  45  66.946  -6.289   2.359
  311    H    MET  46           HN       MET  46  68.131  -7.097  -2.292
  312    HA   MET  46           HA       MET  46  66.217  -6.239  -4.156
  313   1HB   MET  46           HB2      MET  46  68.988  -7.321  -4.760
  314   2HB   MET  46           HB1      MET  46  68.028  -6.291  -5.822
  315   1HG   MET  46           HG2      MET  46  68.512  -5.339  -3.031
  316   2HG   MET  46           HG1      MET  46  69.854  -5.259  -4.171
  317   1HE   MET  46           HE1      MET  46  70.218  -3.702  -5.856
  318   2HE   MET  46           HE3      MET  46  69.404  -2.131  -5.876
  319   3HE   MET  46           HE2      MET  46  70.149  -2.722  -4.394
  320    H    ARG  47           HN       ARG  47  67.536  -9.462  -3.649
  321    HA   ARG  47           HA       ARG  47  66.537 -10.600  -6.105
  322   1HB   ARG  47           HB2      ARG  47  68.289 -11.736  -4.848
  323   2HB   ARG  47           HB1      ARG  47  67.228 -11.884  -3.445
  324   1HG   ARG  47           HG2      ARG  47  65.638 -13.206  -4.909
  325   2HG   ARG  47           HG1      ARG  47  66.899 -13.218  -6.143
  326   1HD   ARG  47           HD2      ARG  47  67.550 -14.107  -3.347
  327   2HD   ARG  47           HD1      ARG  47  66.743 -15.220  -4.452
  328    HE   ARG  47           HE       ARG  47  68.752 -14.626  -6.024
  329   1HH1  ARG  47          HH11      ARG  47  70.394 -13.013  -4.299
  330   2HH1  ARG  47          HH12      ARG  47  71.372 -14.157  -3.442
  331   1HH2  ARG  47          HH21      ARG  47  69.329 -16.860  -4.179
  332   2HH2  ARG  47          HH22      ARG  47  70.770 -16.333  -3.374
  333    H    MET  48           HN       MET  48  65.296 -10.687  -2.746
  334    HA   MET  48           HA       MET  48  62.905 -12.097  -3.295
  335   1HB   MET  48           HB2      MET  48  63.912 -10.354  -1.143
  336   2HB   MET  48           HB1      MET  48  62.155 -10.362  -1.301
  337   1HG   MET  48           HG2      MET  48  62.017 -12.696  -0.955
  338   2HG   MET  48           HG1      MET  48  63.731 -12.934  -1.289
  339   1HE   MET  48           HE3      MET  48  65.143 -13.604   0.352
  340   2HE   MET  48           HE2      MET  48  65.686 -11.928   0.315
  341   3HE   MET  48           HE1      MET  48  65.481 -12.745   1.862
  342    H    LEU  49           HN       LEU  49  63.284  -8.539  -2.999
  343    HA   LEU  49           HA       LEU  49  60.682  -7.878  -3.893
  344   1HB   LEU  49           HB2      LEU  49  63.056  -6.176  -4.621
  345   2HB   LEU  49           HB1      LEU  49  61.449  -5.670  -4.103
  346    HG   LEU  49           HG       LEU  49  63.685  -6.806  -2.423
  347   1HD1  LEU  49          HD12      LEU  49  62.070  -4.275  -2.541
  348   2HD1  LEU  49          HD11      LEU  49  62.796  -4.775  -1.013
  349   3HD1  LEU  49          HD13      LEU  49  63.818  -4.474  -2.419
  350   1HD2  LEU  49          HD23      LEU  49  60.721  -6.887  -1.973
  351   2HD2  LEU  49          HD22      LEU  49  61.952  -8.065  -1.518
  352   3HD2  LEU  49          HD21      LEU  49  61.774  -6.574  -0.593
  353    H    GLY  50           HN       GLY  50  63.445  -9.018  -5.665
  354   1HA   GLY  50           HA2      GLY  50  62.898 -10.029  -7.890
  355   2HA   GLY  50           HA1      GLY  50  61.909  -8.601  -8.201
  356    H    GLN  51           HN       GLN  51  63.763  -6.673  -7.134
  357    HA   GLN  51           HA       GLN  51  65.226  -5.889  -9.341
  358   1HB   GLN  51           HB2      GLN  51  65.635  -5.504  -6.399
  359   2HB   GLN  51           HB1      GLN  51  66.911  -4.978  -7.498
  360   1HG   GLN  51           HG2      GLN  51  65.694  -3.069  -7.673
  361   2HG   GLN  51           HG1      GLN  51  64.668  -4.014  -8.754
  362   1HE2  GLN  51          HE22      GLN  51  61.981  -3.274  -6.581
  363   2HE2  GLN  51          HE21      GLN  51  62.622  -3.136  -8.147
  364    H    ASN  52           HN       ASN  52  67.260  -6.361 -10.215
  365    HA   ASN  52           HA       ASN  52  68.988  -8.328  -8.846
  366   1HB   ASN  52           HB2      ASN  52  67.111  -9.230 -10.681
  367   2HB   ASN  52           HB1      ASN  52  68.577  -9.067 -11.650
  368   1HD2  ASN  52          HD22      ASN  52  70.371 -11.348  -9.315
  369   2HD2  ASN  52          HD21      ASN  52  70.590  -9.755  -9.860
  370    HA   PRO  53           HA       PRO  53  71.136  -5.096 -11.396
  371   1HB   PRO  53           HB2      PRO  53  72.414  -3.882  -9.286
  372   2HB   PRO  53           HB1      PRO  53  70.818  -3.389  -9.878
  373   1HG   PRO  53           HG2      PRO  53  71.516  -4.910  -7.410
  374   2HG   PRO  53           HG1      PRO  53  70.112  -3.882  -7.733
  375   1HD   PRO  53           HD2      PRO  53  70.141  -6.713  -7.783
  376   2HD   PRO  53           HD1      PRO  53  68.849  -5.670  -8.412
  377    H    THR  54           HN       THR  54  73.711  -4.560 -10.950
  378    HA   THR  54           HA       THR  54  74.972  -7.235 -10.845
  379    HB   THR  54           HB       THR  54  77.034  -5.604 -11.402
  380    HG1  THR  54           HG1      THR  54  75.766  -4.040 -12.903
  381   1HG2  THR  54          HG22      THR  54  74.829  -6.558 -13.235
  382   2HG2  THR  54          HG21      THR  54  76.316  -5.832 -13.843
  383   3HG2  THR  54          HG23      THR  54  76.382  -7.329 -12.913
  384    H    LYS  55           HN       LYS  55  76.652  -7.748  -9.369
  385    HA   LYS  55           HA       LYS  55  76.412  -6.840  -6.725
  386   1HB   LYS  55           HB2      LYS  55  78.052  -8.663  -8.111
  387   2HB   LYS  55           HB1      LYS  55  79.161  -7.567  -7.286
  388   1HG   LYS  55           HG2      LYS  55  78.450  -8.203  -5.188
  389   2HG   LYS  55           HG1      LYS  55  76.812  -8.563  -5.738
  390   1HD   LYS  55           HD2      LYS  55  78.526 -10.360  -7.101
  391   2HD   LYS  55           HD1      LYS  55  79.034 -10.367  -5.413
  392   1HE   LYS  55           HE2      LYS  55  76.284 -10.382  -5.197
  393   2HE   LYS  55           HE1      LYS  55  76.557 -11.385  -6.621
  394   1HZ   LYS  55           HZ3      LYS  55  78.437 -12.329  -5.016
  395   2HZ   LYS  55           HZ2      LYS  55  77.296 -11.856  -3.849
  396   3HZ   LYS  55           HZ1      LYS  55  76.864 -12.963  -5.062
  397    H    GLU  56           HN       GLU  56  78.758  -5.767  -9.201
  398    HA   GLU  56           HA       GLU  56  80.207  -3.916  -7.676
  399   1HB   GLU  56           HB2      GLU  56  79.694  -4.383 -10.494
  400   2HB   GLU  56           HB1      GLU  56  79.805  -2.656 -10.154
  401   1HG   GLU  56           HG2      GLU  56  81.837  -4.611  -9.078
  402   2HG   GLU  56           HG1      GLU  56  82.009  -3.883 -10.675
  403    H    GLU  57           HN       GLU  57  77.357  -3.108  -9.700
  404    HA   GLU  57           HA       GLU  57  76.973  -0.477  -8.881
  405   1HB   GLU  57           HB2      GLU  57  75.230  -2.629  -9.897
  406   2HB   GLU  57           HB1      GLU  57  74.383  -1.386  -8.977
  407   1HG   GLU  57           HG2      GLU  57  76.294  -0.814 -11.259
  408   2HG   GLU  57           HG1      GLU  57  74.538  -0.855 -11.418
  409    H    LEU  58           HN       LEU  58  75.808  -3.419  -7.226
  410    HA   LEU  58           HA       LEU  58  74.395  -2.190  -5.125
  411   1HB   LEU  58           HB2      LEU  58  75.155  -4.781  -5.745
  412   2HB   LEU  58           HB1      LEU  58  76.016  -4.468  -4.237
  413    HG   LEU  58           HG       LEU  58  73.357  -3.403  -4.025
  414   1HD1  LEU  58          HD11      LEU  58  73.269  -5.441  -5.812
  415   2HD1  LEU  58          HD13      LEU  58  73.148  -6.350  -4.306
  416   3HD1  LEU  58          HD12      LEU  58  71.964  -5.098  -4.675
  417   1HD2  LEU  58          HD23      LEU  58  75.185  -5.271  -2.636
  418   2HD2  LEU  58          HD22      LEU  58  74.182  -3.980  -1.976
  419   3HD2  LEU  58          HD21      LEU  58  73.469  -5.550  -2.341
  420    H    ASP  59           HN       ASP  59  77.891  -2.930  -5.311
  421    HA   ASP  59           HA       ASP  59  78.578  -2.014  -2.712
  422   1HB   ASP  59           HB2      ASP  59  79.998  -3.124  -4.704
  423   2HB   ASP  59           HB1      ASP  59  80.465  -1.440  -4.950
  424    H    ALA  60           HN       ALA  60  78.281  -0.220  -5.777
  425    HA   ALA  60           HA       ALA  60  79.137   2.302  -4.660
  426   1HB   ALA  60           HB2      ALA  60  78.505   1.343  -7.208
  427   2HB   ALA  60           HB1      ALA  60  77.258   2.546  -6.877
  428   3HB   ALA  60           HB3      ALA  60  78.962   2.998  -6.802
  429    H    ILE  61           HN       ILE  61  76.177   0.517  -4.564
  430    HA   ILE  61           HA       ILE  61  74.452   2.799  -4.010
  431    HB   ILE  61           HB       ILE  61  74.126  -0.197  -3.750
  432   1HG1  ILE  61          HG12      ILE  61  72.523   1.718  -5.439
  433   2HG1  ILE  61          HG11      ILE  61  74.094   1.137  -5.990
  434   1HG2  ILE  61          HG22      ILE  61  72.217   2.022  -2.981
  435   2HG2  ILE  61          HG21      ILE  61  71.687   0.372  -3.314
  436   3HG2  ILE  61          HG23      ILE  61  72.786   0.692  -1.972
  437   1HD1  ILE  61          HD12      ILE  61  72.656  -1.117  -5.013
  438   2HD1  ILE  61          HD11      ILE  61  71.570  -0.220  -6.075
  439   3HD1  ILE  61          HD13      ILE  61  73.132  -0.775  -6.677
  440    H    ILE  62           HN       ILE  62  75.747   0.135  -2.008
  441    HA   ILE  62           HA       ILE  62  74.824   0.804   0.498
  442    HB   ILE  62           HB       ILE  62  77.550  -0.158  -0.386
  443   1HG1  ILE  62          HG12      ILE  62  76.409  -2.130   1.088
  444   2HG1  ILE  62          HG11      ILE  62  74.963  -1.341   0.458
  445   1HG2  ILE  62          HG23      ILE  62  76.786   0.905   2.202
  446   2HG2  ILE  62          HG22      ILE  62  77.194  -0.806   2.326
  447   3HG2  ILE  62          HG21      ILE  62  78.362   0.333   1.656
  448   1HD1  ILE  62          HD13      ILE  62  77.016  -1.641  -1.591
  449   2HD1  ILE  62          HD12      ILE  62  76.544  -3.193  -0.901
  450   3HD1  ILE  62          HD11      ILE  62  75.325  -2.141  -1.621
  451    H    GLU  63           HN       GLU  63  77.584   2.330  -1.178
  452    HA   GLU  63           HA       GLU  63  78.249   4.107   0.980
  453   1HB   GLU  63           HB2      GLU  63  78.987   3.792  -1.863
  454   2HB   GLU  63           HB1      GLU  63  79.126   5.434  -1.235
  455   1HG   GLU  63           HG2      GLU  63  81.237   4.372  -0.822
  456   2HG   GLU  63           HG1      GLU  63  80.403   4.451   0.732
  457    H    GLU  64           HN       GLU  64  76.264   4.569  -1.956
  458    HA   GLU  64           HA       GLU  64  75.629   7.319  -1.326
  459   1HB   GLU  64           HB2      GLU  64  74.773   5.306  -3.335
  460   2HB   GLU  64           HB1      GLU  64  73.628   6.604  -2.994
  461   1HG   GLU  64           HG2      GLU  64  74.975   7.470  -4.737
  462   2HG   GLU  64           HG1      GLU  64  75.643   8.197  -3.275
  463    H    VAL  65           HN       VAL  65  74.548   4.397   0.023
  464    HA   VAL  65           HA       VAL  65  71.896   5.522   0.738
  465    HB   VAL  65           HB       VAL  65  73.062   2.807   1.414
  466   1HG1  VAL  65          HG13      VAL  65  70.595   4.223   2.074
  467   2HG1  VAL  65          HG12      VAL  65  70.281   2.690   1.260
  468   3HG1  VAL  65          HG11      VAL  65  71.235   2.722   2.742
  469   1HG2  VAL  65          HG21      VAL  65  72.710   3.521  -1.095
  470   2HG2  VAL  65          HG23      VAL  65  72.110   1.956  -0.548
  471   3HG2  VAL  65          HG22      VAL  65  71.001   3.318  -0.716
  472    H    ASP  66           HN       ASP  66  74.942   4.501   2.240
  473    HA   ASP  66           HA       ASP  66  73.952   5.224   4.918
  474   1HB   ASP  66           HB2      ASP  66  76.168   3.698   3.824
  475   2HB   ASP  66           HB1      ASP  66  76.731   4.848   5.037
  476    H    GLU  67           HN       GLU  67  73.561   7.498   4.597
  477    HA   GLU  67           HA       GLU  67  75.572   9.302   3.608
  478   1HB   GLU  67           HB2      GLU  67  74.170  11.064   4.694
  479   2HB   GLU  67           HB1      GLU  67  73.226   9.973   3.679
  480   1HG   GLU  67           HG2      GLU  67  71.921   9.532   5.459
  481   2HG   GLU  67           HG1      GLU  67  73.312   8.772   6.233
  482    H    ASP  68           HN       ASP  68  74.924   7.885   6.747
  483    HA   ASP  68           HA       ASP  68  76.916   9.667   8.035
  484   1HB   ASP  68           HB2      ASP  68  76.249   8.236  10.088
  485   2HB   ASP  68           HB1      ASP  68  75.036   9.340   9.435
  486    H    GLY  69           HN       GLY  69  76.929   6.818   6.298
  487   1HA   GLY  69           HA2      GLY  69  78.473   5.061   6.104
  488   2HA   GLY  69           HA1      GLY  69  79.645   6.225   6.725
  489    H    SER  70           HN       SER  70  76.802   5.134   8.505
  490    HA   SER  70           HA       SER  70  78.335   4.521  10.850
  491   1HB   SER  70           HB2      SER  70  76.199   3.451  11.640
  492   2HB   SER  70           HB1      SER  70  75.991   5.099  11.054
  493    HG   SER  70           HG       SER  70  74.490   4.109   9.911
  494    H    GLY  71           HN       GLY  71  77.316   2.604   8.090
  495   1HA   GLY  71           HA2      GLY  71  78.573   0.597   7.484
  496   2HA   GLY  71           HA1      GLY  71  78.898   0.333   9.199
  497    H    THR  72           HN       THR  72  75.698   1.325   8.482
  498    HA   THR  72           HA       THR  72  74.677  -1.429   8.196
  499    HB   THR  72           HB       THR  72  73.069  -0.642  10.238
  500    HG1  THR  72           HG1      THR  72  74.297   1.209  10.642
  501   1HG2  THR  72          HG21      THR  72  75.617  -2.219  10.134
  502   2HG2  THR  72          HG23      THR  72  74.820  -1.971  11.687
  503   3HG2  THR  72          HG22      THR  72  73.966  -2.785  10.377
  504    H    ILE  73           HN       ILE  73  72.294  -1.405   7.809
  505    HA   ILE  73           HA       ILE  73  71.425   1.239   6.703
  506    HB   ILE  73           HB       ILE  73  70.722  -1.557   5.764
  507   1HG1  ILE  73          HG12      ILE  73  73.045  -0.614   5.239
  508   2HG1  ILE  73          HG11      ILE  73  72.070  -1.080   3.846
  509   1HG2  ILE  73          HG22      ILE  73  69.908   1.168   4.705
  510   2HG2  ILE  73          HG21      ILE  73  69.536  -0.377   3.939
  511   3HG2  ILE  73          HG23      ILE  73  68.845   0.016   5.514
  512   1HD1  ILE  73          HD13      ILE  73  71.578   1.680   4.671
  513   2HD1  ILE  73          HD12      ILE  73  73.263   1.399   4.228
  514   3HD1  ILE  73          HD11      ILE  73  71.976   1.040   3.076
  515    H    ASP  74           HN       ASP  74  69.378   1.955   7.258
  516    HA   ASP  74           HA       ASP  74  67.822   0.198   9.115
  517   1HB   ASP  74           HB2      ASP  74  68.119   3.218   9.152
  518   2HB   ASP  74           HB1      ASP  74  67.058   2.296  10.217
  519    H    PHE  75           HN       PHE  75  65.419   1.032   9.186
  520    HA   PHE  75           HA       PHE  75  64.238   0.655   6.665
  521   1HB   PHE  75           HB2      PHE  75  63.149   0.650   9.020
  522   2HB   PHE  75           HB1      PHE  75  62.950   2.385   8.774
  523    HD1  PHE  75           HD2      PHE  75  62.763  -0.440   6.336
  524    HD2  PHE  75           HD1      PHE  75  60.663   2.729   8.331
  525    HE1  PHE  75           HE2      PHE  75  60.770  -0.873   4.923
  526    HE2  PHE  75           HE1      PHE  75  58.669   2.299   6.919
  527    HZ   PHE  75           HZ       PHE  75  58.723   0.499   5.215
  528    H    GLU  76           HN       GLU  76  65.214   3.674   8.254
  529    HA   GLU  76           HA       GLU  76  64.038   5.481   6.397
  530   1HB   GLU  76           HB2      GLU  76  66.664   5.839   7.874
  531   2HB   GLU  76           HB1      GLU  76  65.629   7.119   7.240
  532   1HG   GLU  76           HG2      GLU  76  64.431   5.143   9.142
  533   2HG   GLU  76           HG1      GLU  76  65.483   6.400   9.792
  534    H    GLU  77           HN       GLU  77  67.480   4.472   6.517
  535    HA   GLU  77           HA       GLU  77  68.084   5.482   3.907
  536   1HB   GLU  77           HB2      GLU  77  69.486   3.179   5.288
  537   2HB   GLU  77           HB1      GLU  77  70.168   4.302   4.111
  538   1HG   GLU  77           HG2      GLU  77  69.704   6.167   5.748
  539   2HG   GLU  77           HG1      GLU  77  69.272   4.933   6.935
  540    H    PHE  78           HN       PHE  78  66.280   2.759   4.869
  541    HA   PHE  78           HA       PHE  78  66.932   0.961   2.717
  542   1HB   PHE  78           HB2      PHE  78  65.308   0.858   4.967
  543   2HB   PHE  78           HB1      PHE  78  64.155   0.834   3.632
  544    HD1  PHE  78           HD1      PHE  78  67.080  -0.875   5.128
  545    HD2  PHE  78           HD2      PHE  78  64.028  -1.033   2.111
  546    HE1  PHE  78           HE1      PHE  78  67.636  -3.251   4.690
  547    HE2  PHE  78           HE2      PHE  78  64.584  -3.409   1.672
  548    HZ   PHE  78           HZ       PHE  78  66.389  -4.519   2.961
  549    H    LEU  79           HN       LEU  79  64.026   3.012   3.150
  550    HA   LEU  79           HA       LEU  79  62.885   2.738   0.641
  551   1HB   LEU  79           HB2      LEU  79  63.175   5.350   2.161
  552   2HB   LEU  79           HB1      LEU  79  61.973   5.007   0.917
  553    HG   LEU  79           HG       LEU  79  62.240   3.385   3.463
  554   1HD1  LEU  79          HD13      LEU  79  61.402   6.020   3.319
  555   2HD1  LEU  79          HD12      LEU  79  59.893   5.120   3.172
  556   3HD1  LEU  79          HD11      LEU  79  60.936   4.867   4.572
  557   1HD2  LEU  79          HD21      LEU  79  60.075   3.616   1.347
  558   2HD2  LEU  79          HD23      LEU  79  61.144   2.236   1.589
  559   3HD2  LEU  79          HD22      LEU  79  59.951   2.652   2.820
  560    H    VAL  80           HN       VAL  80  65.854   4.381   1.462
  561    HA   VAL  80           HA       VAL  80  66.102   5.937  -0.950
  562    HB   VAL  80           HB       VAL  80  68.208   4.854   0.945
  563   1HG1  VAL  80          HG13      VAL  80  68.400   6.256  -1.614
  564   2HG1  VAL  80          HG12      VAL  80  69.182   7.142  -0.306
  565   3HG1  VAL  80          HG11      VAL  80  69.669   5.486  -0.662
  566   1HG2  VAL  80          HG23      VAL  80  66.409   6.523   1.752
  567   2HG2  VAL  80          HG22      VAL  80  68.094   6.971   2.017
  568   3HG2  VAL  80          HG21      VAL  80  67.191   7.688   0.685
  569    H    MET  81           HN       MET  81  67.464   2.766   0.001
  570    HA   MET  81           HA       MET  81  68.797   2.208  -2.436
  571   1HB   MET  81           HB2      MET  81  67.445   0.328  -0.478
  572   2HB   MET  81           HB1      MET  81  68.501  -0.202  -1.788
  573   1HG   MET  81           HG2      MET  81  70.056   1.712  -0.638
  574   2HG   MET  81           HG1      MET  81  69.184   1.114   0.772
  575   1HE   MET  81           HE2      MET  81  71.633   1.118   1.099
  576   2HE   MET  81           HE1      MET  81  71.906  -0.483   1.782
  577   3HE   MET  81           HE3      MET  81  72.808   0.038   0.353
  578    H    MET  82           HN       MET  82  65.401   2.003  -1.576
  579    HA   MET  82           HA       MET  82  64.578   0.402  -3.826
  580   1HB   MET  82           HB2      MET  82  62.865   2.470  -2.439
  581   2HB   MET  82           HB1      MET  82  62.351   0.967  -3.206
  582   1HG   MET  82           HG2      MET  82  63.951   1.266  -0.652
  583   2HG   MET  82           HG1      MET  82  62.329   0.600  -0.823
  584   1HE   MET  82           HE2      MET  82  62.201  -0.965  -3.181
  585   2HE   MET  82           HE1      MET  82  62.844  -2.581  -2.903
  586   3HE   MET  82           HE3      MET  82  61.778  -1.831  -1.707
  587    H    VAL  83           HN       VAL  83  63.986   3.897  -3.277
  588    HA   VAL  83           HA       VAL  83  63.326   4.470  -5.979
  589    HB   VAL  83           HB       VAL  83  64.657   6.386  -4.048
  590   1HG1  VAL  83          HG11      VAL  83  62.914   6.638  -6.494
  591   2HG1  VAL  83          HG13      VAL  83  62.963   7.926  -5.291
  592   3HG1  VAL  83          HG12      VAL  83  64.437   7.453  -6.135
  593   1HG2  VAL  83          HG21      VAL  83  61.948   5.137  -4.066
  594   2HG2  VAL  83          HG23      VAL  83  62.913   5.706  -2.704
  595   3HG2  VAL  83          HG22      VAL  83  62.033   6.861  -3.705
  596    H    ARG  84           HN       ARG  84  66.354   3.731  -4.565
  597    HA   ARG  84           HA       ARG  84  68.091   5.253  -6.260
  598   1HB   ARG  84           HB2      ARG  84  68.458   3.545  -4.147
  599   2HB   ARG  84           HB1      ARG  84  69.035   2.565  -5.496
  600   1HG   ARG  84           HG2      ARG  84  70.941   3.753  -5.559
  601   2HG   ARG  84           HG1      ARG  84  70.017   5.229  -5.847
  602   1HD   ARG  84           HD2      ARG  84  69.605   4.763  -3.149
  603   2HD   ARG  84           HD1      ARG  84  71.284   4.274  -3.380
  604    HE   ARG  84           HE       ARG  84  70.393   6.967  -3.317
  605   1HH1  ARG  84          HH21      ARG  84  72.532   4.784  -4.893
  606   2HH1  ARG  84          HH22      ARG  84  73.471   6.032  -5.644
  607   1HH2  ARG  84          HH11      ARG  84  71.502   8.615  -4.431
  608   2HH2  ARG  84          HH12      ARG  84  72.889   8.200  -5.382
  609    H    GLN  85           HN       GLN  85  66.977   1.854  -6.546
  610    HA   GLN  85           HA       GLN  85  68.073   1.681  -9.255
  611   1HB   GLN  85           HB2      GLN  85  68.215  -0.387  -8.209
  612   2HB   GLN  85           HB1      GLN  85  66.701  -0.165  -7.335
  613   1HG   GLN  85           HG2      GLN  85  66.407  -1.870  -9.055
  614   2HG   GLN  85           HG1      GLN  85  65.461  -0.439  -9.471
  615   1HE2  GLN  85          HE22      GLN  85  68.864  -1.223 -11.660
  616   2HE2  GLN  85          HE21      GLN  85  68.768  -1.777 -10.057
  617    H    MET  86           HN       MET  86  64.829   1.766  -7.756
  618    HA   MET  86           HA       MET  86  63.256   1.509 -10.064
  619   1HB   MET  86           HB2      MET  86  62.881   3.092  -7.524
  620   2HB   MET  86           HB1      MET  86  61.666   3.130  -8.804
  621   1HG   MET  86           HG2      MET  86  62.061   0.465  -8.651
  622   2HG   MET  86           HG1      MET  86  62.429   0.907  -6.985
  623   1HE   MET  86           HE3      MET  86  60.794   3.552  -6.781
  624   2HE   MET  86           HE2      MET  86  59.285   3.032  -6.035
  625   3HE   MET  86           HE1      MET  86  60.815   2.370  -5.464
  626    H    LYS  87           HN       LYS  87  64.326   4.616  -8.619
  627    HA   LYS  87           HA       LYS  87  63.930   5.860 -11.301
  628   1HB   LYS  87           HB2      LYS  87  63.447   6.734  -8.591
  629   2HB   LYS  87           HB1      LYS  87  64.563   7.843  -9.389
  630   1HG   LYS  87           HG2      LYS  87  62.679   7.339 -11.357
  631   2HG   LYS  87           HG1      LYS  87  61.709   7.402  -9.885
  632   1HD   LYS  87           HD2      LYS  87  63.639   9.511  -9.772
  633   2HD   LYS  87           HD1      LYS  87  62.831   9.586 -11.337
  634   1HE   LYS  87           HE2      LYS  87  60.670   9.723 -10.321
  635   2HE   LYS  87           HE1      LYS  87  61.313   9.294  -8.737
  636   1HZ   LYS  87           HZ2      LYS  87  62.725  11.383  -9.002
  637   2HZ   LYS  87           HZ1      LYS  87  61.639  11.816 -10.236
  638   3HZ   LYS  87           HZ3      LYS  87  61.075  11.588  -8.653
  639    H    GLU  88           HN       GLU  88  66.096   4.493 -11.601
  640    HA   GLU  88           HA       GLU  88  68.461   5.944 -10.582
  641   1HB   GLU  88           HB2      GLU  88  68.094   3.315 -11.018
  642   2HB   GLU  88           HB1      GLU  88  68.735   3.766 -12.599
  643   1HG   GLU  88           HG2      GLU  88  70.121   4.778 -10.142
  644   2HG   GLU  88           HG1      GLU  88  70.380   3.105 -10.633
  645    H    ASP  89           HN       ASP  89  67.417   4.840 -13.834
  646    HA   ASP  89           HA       ASP  89  68.134   7.508 -14.907
  647   1HB   ASP  89           HB2      ASP  89  69.760   5.119 -15.221
  648   2HB   ASP  89           HB1      ASP  89  69.201   5.718 -16.785
  649    H    ALA  90           HN       ALA  90  65.742   5.568 -14.569
  650    HA   ALA  90           HA       ALA  90  64.851   4.572 -17.034
  651   1HB   ALA  90           HB1      ALA  90  63.733   4.715 -14.595
  652   2HB   ALA  90           HB3      ALA  90  62.853   6.032 -15.371
  653   3HB   ALA  90           HB2      ALA  90  62.779   4.403 -16.045
   
  No H/Q in entry =         653
  Start of MODEL   34
    1   1H    ALA   1           HT1      ALA   1  67.222  12.822  15.931
    2   2H    ALA   1           HT3      ALA   1  68.126  11.587  16.661
    3   3H    ALA   1           HT2      ALA   1  68.779  13.150  16.527
    4    HA   ALA   1           HA       ALA   1  69.817  11.881  14.853
    5   1HB   ALA   1           HB2      ALA   1  67.905  10.129  14.994
    6   2HB   ALA   1           HB1      ALA   1  67.109  11.115  13.768
    7   3HB   ALA   1           HB3      ALA   1  68.678  10.384  13.429
    8    H    SER   2           HN       SER   2  68.682  12.044  12.190
    9    HA   SER   2           HA       SER   2  67.678  14.788  11.882
   10   1HB   SER   2           HB2      SER   2  70.322  14.717  12.105
   11   2HB   SER   2           HB1      SER   2  70.230  14.198  10.426
   12    HG   SER   2           HG       SER   2  69.485  16.114   9.864
   13    H    MET   3           HN       MET   3  66.348  14.801  10.126
   14    HA   MET   3           HA       MET   3  66.228  12.419   8.424
   15   1HB   MET   3           HB2      MET   3  64.499  14.675   9.070
   16   2HB   MET   3           HB1      MET   3  64.528  14.353   7.337
   17   1HG   MET   3           HG2      MET   3  63.181  12.581   7.646
   18   2HG   MET   3           HG1      MET   3  64.405  11.839   8.676
   19   1HE   MET   3           HE2      MET   3  63.585  10.762  10.225
   20   2HE   MET   3           HE1      MET   3  64.092  11.802  11.553
   21   3HE   MET   3           HE3      MET   3  62.440  11.176  11.497
   22    H    THR   4           HN       THR   4  67.981  12.353   7.028
   23    HA   THR   4           HA       THR   4  69.145  14.642   5.760
   24    HB   THR   4           HB       THR   4  70.059  12.881   4.140
   25    HG1  THR   4           HG1      THR   4  69.631  10.762   4.686
   26   1HG2  THR   4          HG23      THR   4  70.474  13.150   7.038
   27   2HG2  THR   4          HG22      THR   4  71.054  11.623   6.374
   28   3HG2  THR   4          HG21      THR   4  71.654  13.151   5.728
   29    H    ASP   5           HN       ASP   5  68.730  15.575   3.742
   30    HA   ASP   5           HA       ASP   5  66.078  15.523   2.738
   31   1HB   ASP   5           HB2      ASP   5  68.508  16.225   1.080
   32   2HB   ASP   5           HB1      ASP   5  66.877  16.884   0.948
   33    H    GLN   6           HN       GLN   6  68.753  13.393   2.165
   34    HA   GLN   6           HA       GLN   6  68.010  12.360  -0.389
   35   1HB   GLN   6           HB2      GLN   6  70.026  11.849   1.431
   36   2HB   GLN   6           HB1      GLN   6  69.078  10.363   1.481
   37   1HG   GLN   6           HG2      GLN   6  69.333   9.997  -0.856
   38   2HG   GLN   6           HG1      GLN   6  69.909  11.642  -1.128
   39   1HE2  GLN   6          HE22      GLN   6  72.575   9.338   0.975
   40   2HE2  GLN   6          HE21      GLN   6  70.957   9.421   1.481
   41    H    GLN   7           HN       GLN   7  67.117  11.301   2.904
   42    HA   GLN   7           HA       GLN   7  65.305   9.254   1.880
   43   1HB   GLN   7           HB2      GLN   7  65.556  10.426   4.668
   44   2HB   GLN   7           HB1      GLN   7  64.677   8.956   4.241
   45   1HG   GLN   7           HG2      GLN   7  66.641   7.771   3.746
   46   2HG   GLN   7           HG1      GLN   7  67.586   9.243   3.523
   47   1HE2  GLN   7          HE22      GLN   7  68.616   8.027   6.833
   48   2HE2  GLN   7          HE21      GLN   7  68.855   7.618   5.204
   49    H    ALA   8           HN       ALA   8  65.119  12.631   2.431
   50    HA   ALA   8           HA       ALA   8  62.294  12.802   3.027
   51   1HB   ALA   8           HB2      ALA   8  63.872  14.653   3.503
   52   2HB   ALA   8           HB1      ALA   8  64.130  14.864   1.771
   53   3HB   ALA   8           HB3      ALA   8  62.544  15.185   2.470
   54    H    GLU   9           HN       GLU   9  64.140  13.401   0.012
   55    HA   GLU   9           HA       GLU   9  61.790  13.670  -1.621
   56   1HB   GLU   9           HB2      GLU   9  64.673  13.633  -2.003
   57   2HB   GLU   9           HB1      GLU   9  63.846  12.746  -3.285
   58   1HG   GLU   9           HG2      GLU   9  62.226  14.874  -3.182
   59   2HG   GLU   9           HG1      GLU   9  63.697  15.642  -2.586
   60    H    ALA  10           HN       ALA  10  63.865  10.913  -0.793
   61    HA   ALA  10           HA       ALA  10  62.799   9.016  -2.605
   62   1HB   ALA  10           HB1      ALA  10  63.870   8.688   0.209
   63   2HB   ALA  10           HB3      ALA  10  63.448   7.325  -0.826
   64   3HB   ALA  10           HB2      ALA  10  64.735   8.431  -1.305
   65    H    ARG  11           HN       ARG  11  61.694   9.899   0.672
   66    HA   ARG  11           HA       ARG  11  59.473   8.060   0.674
   67   1HB   ARG  11           HB2      ARG  11  60.534  10.157   2.404
   68   2HB   ARG  11           HB1      ARG  11  58.770  10.175   2.355
   69   1HG   ARG  11           HG2      ARG  11  58.730   7.764   2.886
   70   2HG   ARG  11           HG1      ARG  11  60.493   7.748   2.943
   71   1HD   ARG  11           HD2      ARG  11  59.921   8.008   5.203
   72   2HD   ARG  11           HD1      ARG  11  60.205   9.672   4.689
   73    HE   ARG  11           HE       ARG  11  57.426   8.619   4.607
   74   1HH1  ARG  11          HH21      ARG  11  58.411  11.536   4.290
   75   2HH1  ARG  11          HH22      ARG  11  57.930  12.192   5.820
   76   1HH2  ARG  11          HH11      ARG  11  57.416   9.093   7.287
   77   2HH2  ARG  11          HH12      ARG  11  57.366  10.809   7.517
   78    H    ALA  12           HN       ALA  12  59.900  11.387  -0.415
   79    HA   ALA  12           HA       ALA  12  57.116  11.991  -0.778
   80   1HB   ALA  12           HB3      ALA  12  59.544  13.078  -2.239
   81   2HB   ALA  12           HB2      ALA  12  57.931  13.793  -2.268
   82   3HB   ALA  12           HB1      ALA  12  58.845  13.743  -0.762
   83    H    PHE  13           HN       PHE  13  59.486  10.290  -2.745
   84    HA   PHE  13           HA       PHE  13  57.674  10.210  -5.065
   85   1HB   PHE  13           HB2      PHE  13  60.156  10.366  -5.342
   86   2HB   PHE  13           HB1      PHE  13  60.303   8.765  -4.616
   87    HD1  PHE  13           HD2      PHE  13  59.433   6.769  -5.767
   88    HD2  PHE  13           HD1      PHE  13  59.271  10.658  -7.581
   89    HE1  PHE  13           HE2      PHE  13  58.967   5.723  -7.967
   90    HE2  PHE  13           HE1      PHE  13  58.805   9.614  -9.781
   91    HZ   PHE  13           HZ       PHE  13  58.653   7.145  -9.975
   92    H    LEU  14           HN       LEU  14  58.497   8.259  -2.304
   93    HA   LEU  14           HA       LEU  14  57.181   5.871  -3.466
   94   1HB   LEU  14           HB2      LEU  14  58.444   6.282  -0.736
   95   2HB   LEU  14           HB1      LEU  14  57.892   4.744  -1.401
   96    HG   LEU  14           HG       LEU  14  60.004   6.482  -2.703
   97   1HD1  LEU  14          HD13      LEU  14  60.313   5.101  -0.345
   98   2HD1  LEU  14          HD12      LEU  14  60.791   3.894  -1.538
   99   3HD1  LEU  14          HD11      LEU  14  61.617   5.451  -1.480
  100   1HD2  LEU  14          HD22      LEU  14  58.436   4.449  -3.744
  101   2HD2  LEU  14          HD21      LEU  14  59.998   4.960  -4.383
  102   3HD2  LEU  14          HD23      LEU  14  59.907   3.604  -3.260
  103    H    SER  15           HN       SER  15  55.043   5.505  -3.129
  104    HA   SER  15           HA       SER  15  53.549   7.273  -1.318
  105   1HB   SER  15           HB2      SER  15  51.991   5.104  -2.441
  106   2HB   SER  15           HB1      SER  15  51.839   6.835  -2.718
  107    HG   SER  15           HG       SER  15  52.472   6.140  -4.648
  108    H    GLU  16           HN       GLU  16  52.092   6.387   0.343
  109    HA   GLU  16           HA       GLU  16  53.375   4.555   2.105
  110   1HB   GLU  16           HB2      GLU  16  51.005   6.153   2.101
  111   2HB   GLU  16           HB1      GLU  16  50.557   4.518   2.590
  112   1HG   GLU  16           HG2      GLU  16  51.494   4.825   4.610
  113   2HG   GLU  16           HG1      GLU  16  53.035   5.243   3.863
  114    H    GLU  17           HN       GLU  17  51.503   3.995  -0.713
  115    HA   GLU  17           HA       GLU  17  50.357   1.452  -0.030
  116   1HB   GLU  17           HB2      GLU  17  50.768   3.052  -2.462
  117   2HB   GLU  17           HB1      GLU  17  50.816   1.312  -2.746
  118   1HG   GLU  17           HG2      GLU  17  48.514   2.102  -2.952
  119   2HG   GLU  17           HG1      GLU  17  48.657   1.085  -1.520
  120    H    MET  18           HN       MET  18  53.195   2.094  -2.132
  121    HA   MET  18           HA       MET  18  54.105  -0.642  -1.949
  122   1HB   MET  18           HB2      MET  18  55.529   1.884  -2.837
  123   2HB   MET  18           HB1      MET  18  56.182   0.256  -3.021
  124   1HG   MET  18           HG2      MET  18  54.920  -0.125  -4.849
  125   2HG   MET  18           HG1      MET  18  53.457   0.404  -4.018
  126   1HE   MET  18           HE3      MET  18  55.794   0.838  -6.682
  127   2HE   MET  18           HE2      MET  18  56.020   2.553  -7.023
  128   3HE   MET  18           HE1      MET  18  56.827   1.823  -5.638
  129    H    ILE  19           HN       ILE  19  55.054   2.381  -0.332
  130    HA   ILE  19           HA       ILE  19  57.307   1.469   1.077
  131    HB   ILE  19           HB       ILE  19  55.132   3.383   1.969
  132   1HG1  ILE  19          HG12      ILE  19  57.859   3.754   0.690
  133   2HG1  ILE  19          HG11      ILE  19  56.296   4.104  -0.047
  134   1HG2  ILE  19          HG23      ILE  19  57.841   2.718   3.144
  135   2HG2  ILE  19          HG22      ILE  19  56.990   4.220   3.502
  136   3HG2  ILE  19          HG21      ILE  19  56.274   2.673   3.952
  137   1HD1  ILE  19          HD11      ILE  19  57.041   5.418   2.550
  138   2HD1  ILE  19          HD13      ILE  19  57.668   6.061   1.032
  139   3HD1  ILE  19          HD12      ILE  19  55.927   5.975   1.303
  140    H    ALA  20           HN       ALA  20  53.874   0.957   1.770
  141    HA   ALA  20           HA       ALA  20  54.188  -0.158   4.383
  142   1HB   ALA  20           HB2      ALA  20  52.100  -0.462   2.226
  143   2HB   ALA  20           HB1      ALA  20  51.998  -1.388   3.725
  144   3HB   ALA  20           HB3      ALA  20  51.970   0.375   3.774
  145    H    GLU  21           HN       GLU  21  54.368  -1.603   1.150
  146    HA   GLU  21           HA       GLU  21  54.584  -4.326   2.083
  147   1HB   GLU  21           HB2      GLU  21  55.277  -2.938  -0.508
  148   2HB   GLU  21           HB1      GLU  21  55.626  -4.649  -0.258
  149   1HG   GLU  21           HG2      GLU  21  52.879  -3.588   0.344
  150   2HG   GLU  21           HG1      GLU  21  53.331  -3.954  -1.321
  151    H    PHE  22           HN       PHE  22  56.972  -1.818   1.260
  152    HA   PHE  22           HA       PHE  22  59.298  -3.441   1.505
  153   1HB   PHE  22           HB2      PHE  22  59.068  -0.515   2.259
  154   2HB   PHE  22           HB1      PHE  22  60.524  -1.371   1.750
  155    HD1  PHE  22           HD1      PHE  22  59.007  -3.074  -0.389
  156    HD2  PHE  22           HD2      PHE  22  59.178   1.134   0.456
  157    HE1  PHE  22           HE1      PHE  22  58.472  -2.575  -2.758
  158    HE2  PHE  22           HE2      PHE  22  58.644   1.632  -1.913
  159    HZ   PHE  22           HZ       PHE  22  58.290  -0.223  -3.521
  160    H    LYS  23           HN       LYS  23  57.402  -1.684   3.936
  161    HA   LYS  23           HA       LYS  23  59.184  -2.077   6.131
  162   1HB   LYS  23           HB2      LYS  23  57.375  -0.513   6.379
  163   2HB   LYS  23           HB1      LYS  23  56.176  -1.754   6.013
  164   1HG   LYS  23           HG2      LYS  23  56.260  -1.370   8.432
  165   2HG   LYS  23           HG1      LYS  23  56.861  -2.986   8.061
  166   1HD   LYS  23           HD2      LYS  23  58.706  -2.434   9.237
  167   2HD   LYS  23           HD1      LYS  23  59.130  -1.383   7.885
  168   1HE   LYS  23           HE2      LYS  23  59.153  -0.115   9.992
  169   2HE   LYS  23           HE1      LYS  23  57.861   0.466   8.940
  170   1HZ   LYS  23           HZ2      LYS  23  57.328  -1.652  10.917
  171   2HZ   LYS  23           HZ1      LYS  23  57.347  -0.023  11.399
  172   3HZ   LYS  23           HZ3      LYS  23  56.247  -0.542  10.216
  173    H    ALA  24           HN       ALA  24  56.978  -4.229   4.510
  174    HA   ALA  24           HA       ALA  24  56.764  -6.164   6.654
  175   1HB   ALA  24           HB3      ALA  24  55.135  -6.068   4.797
  176   2HB   ALA  24           HB2      ALA  24  56.406  -6.526   3.663
  177   3HB   ALA  24           HB1      ALA  24  55.882  -7.662   4.906
  178    H    ALA  25           HN       ALA  25  58.935  -5.760   3.873
  179    HA   ALA  25           HA       ALA  25  60.334  -8.268   4.396
  180   1HB   ALA  25           HB2      ALA  25  60.574  -6.012   2.473
  181   2HB   ALA  25           HB1      ALA  25  62.058  -6.900   2.826
  182   3HB   ALA  25           HB3      ALA  25  60.653  -7.751   2.184
  183    H    PHE  26           HN       PHE  26  60.630  -4.940   5.418
  184    HA   PHE  26           HA       PHE  26  63.349  -4.929   6.243
  185   1HB   PHE  26           HB2      PHE  26  61.506  -3.033   6.239
  186   2HB   PHE  26           HB1      PHE  26  61.254  -3.566   7.902
  187    HD1  PHE  26           HD1      PHE  26  64.088  -2.772   5.566
  188    HD2  PHE  26           HD2      PHE  26  62.540  -2.574   9.568
  189    HE1  PHE  26           HE1      PHE  26  66.096  -1.503   6.280
  190    HE2  PHE  26           HE2      PHE  26  64.549  -1.305  10.282
  191    HZ   PHE  26           HZ       PHE  26  66.326  -0.770   8.638
  192    H    ASP  27           HN       ASP  27  60.495  -5.436   8.359
  193    HA   ASP  27           HA       ASP  27  61.944  -6.379  10.597
  194   1HB   ASP  27           HB2      ASP  27  59.132  -6.592   9.644
  195   2HB   ASP  27           HB1      ASP  27  59.636  -7.747  10.879
  196    H    MET  28           HN       MET  28  61.354  -7.899   7.570
  197    HA   MET  28           HA       MET  28  61.349 -10.642   8.283
  198   1HB   MET  28           HB2      MET  28  61.402  -9.204   5.913
  199   2HB   MET  28           HB1      MET  28  62.955 -10.039   5.906
  200   1HG   MET  28           HG2      MET  28  60.230 -11.320   6.274
  201   2HG   MET  28           HG1      MET  28  61.268 -11.461   4.854
  202   1HE   MET  28           HE2      MET  28  63.559 -12.145   4.878
  203   2HE   MET  28           HE1      MET  28  64.283 -11.755   6.436
  204   3HE   MET  28           HE3      MET  28  64.255 -13.429   5.864
  205    H    PHE  29           HN       PHE  29  64.216  -9.005   6.927
  206    HA   PHE  29           HA       PHE  29  65.952 -10.871   8.373
  207   1HB   PHE  29           HB2      PHE  29  67.776  -9.812   7.151
  208   2HB   PHE  29           HB1      PHE  29  66.462 -10.200   6.047
  209    HD1  PHE  29           HD2      PHE  29  65.077  -7.606   7.797
  210    HD2  PHE  29           HD1      PHE  29  68.276  -8.311   5.020
  211    HE1  PHE  29           HE2      PHE  29  64.983  -5.237   7.091
  212    HE2  PHE  29           HE1      PHE  29  68.179  -5.938   4.313
  213    HZ   PHE  29           HZ       PHE  29  66.533  -4.400   5.348
  214    H    ASP  30           HN       ASP  30  64.468  -9.185  10.122
  215    HA   ASP  30           HA       ASP  30  66.663  -7.476  11.223
  216   1HB   ASP  30           HB2      ASP  30  63.951  -6.810  10.582
  217   2HB   ASP  30           HB1      ASP  30  64.144  -6.722  12.333
  218    H    ALA  31           HN       ALA  31  66.948  -9.965  12.010
  219    HA   ALA  31           HA       ALA  31  65.279 -10.830  14.192
  220   1HB   ALA  31           HB1      ALA  31  67.182 -12.056  12.727
  221   2HB   ALA  31           HB3      ALA  31  68.146 -11.636  14.143
  222   3HB   ALA  31           HB2      ALA  31  66.700 -12.633  14.323
  223    H    ASP  32           HN       ASP  32  68.141  -8.781  13.973
  224    HA   ASP  32           HA       ASP  32  68.540  -8.689  16.863
  225   1HB   ASP  32           HB2      ASP  32  70.424  -8.331  15.315
  226   2HB   ASP  32           HB1      ASP  32  69.619  -6.905  14.659
  227    H    GLY  33           HN       GLY  33  66.557  -7.035  14.560
  228   1HA   GLY  33           HA2      GLY  33  64.947  -5.355  14.867
  229   2HA   GLY  33           HA1      GLY  33  65.108  -5.634  16.602
  230    H    GLY  34           HN       GLY  34  68.075  -4.953  15.073
  231   1HA   GLY  34           HA2      GLY  34  68.522  -2.576  16.583
  232   2HA   GLY  34           HA1      GLY  34  69.497  -3.091  15.207
  233    H    GLY  35           HN       GLY  35  67.133  -3.113  13.403
  234   1HA   GLY  35           HA2      GLY  35  65.551  -1.407  12.564
  235   2HA   GLY  35           HA1      GLY  35  66.619  -0.175  13.237
  236    H    ASP  36           HN       ASP  36  68.576  -2.519  11.944
  237    HA   ASP  36           HA       ASP  36  68.422  -1.797   9.131
  238   1HB   ASP  36           HB2      ASP  36  70.712  -0.699   9.128
  239   2HB   ASP  36           HB1      ASP  36  69.426   0.270   9.846
  240    H    ILE  37           HN       ILE  37  69.557  -3.316   7.916
  241    HA   ILE  37           HA       ILE  37  71.108  -5.310   9.501
  242    HB   ILE  37           HB       ILE  37  70.354  -6.979   8.090
  243   1HG1  ILE  37          HG12      ILE  37  71.298  -5.872   6.023
  244   2HG1  ILE  37          HG11      ILE  37  69.774  -6.714   5.753
  245   1HG2  ILE  37          HG21      ILE  37  68.434  -5.484   9.100
  246   2HG2  ILE  37          HG23      ILE  37  68.114  -5.103   7.408
  247   3HG2  ILE  37          HG22      ILE  37  68.044  -6.774   7.963
  248   1HD1  ILE  37          HD13      ILE  37  68.641  -4.446   6.198
  249   2HD1  ILE  37          HD12      ILE  37  70.245  -3.742   5.995
  250   3HD1  ILE  37          HD11      ILE  37  69.496  -4.629   4.667
  251    H    SER  38           HN       SER  38  73.211  -5.875   8.836
  252    HA   SER  38           HA       SER  38  74.886  -3.964   7.714
  253   1HB   SER  38           HB2      SER  38  75.120  -6.693   8.444
  254   2HB   SER  38           HB1      SER  38  75.762  -6.561   6.810
  255    HG   SER  38           HG       SER  38  77.291  -5.217   7.505
  256    H    THR  39           HN       THR  39  75.375  -3.292   5.622
  257    HA   THR  39           HA       THR  39  73.500  -3.759   3.541
  258    HB   THR  39           HB       THR  39  74.898  -2.468   2.154
  259    HG1  THR  39           HG1      THR  39  76.745  -3.767   2.321
  260   1HG2  THR  39          HG23      THR  39  74.578  -1.747   4.888
  261   2HG2  THR  39          HG22      THR  39  76.176  -1.199   4.381
  262   3HG2  THR  39          HG21      THR  39  74.742  -0.675   3.496
  263    H    LYS  40           HN       LYS  40  76.134  -5.681   4.635
  264    HA   LYS  40           HA       LYS  40  76.888  -7.039   2.267
  265   1HB   LYS  40           HB2      LYS  40  76.728  -7.869   5.162
  266   2HB   LYS  40           HB1      LYS  40  77.187  -9.037   3.922
  267   1HG   LYS  40           HG2      LYS  40  78.818  -7.066   3.178
  268   2HG   LYS  40           HG1      LYS  40  78.649  -6.610   4.873
  269   1HD   LYS  40           HD2      LYS  40  79.165  -9.487   4.284
  270   2HD   LYS  40           HD1      LYS  40  80.507  -8.364   4.061
  271   1HE   LYS  40           HE2      LYS  40  80.720  -7.984   6.293
  272   2HE   LYS  40           HE1      LYS  40  78.976  -7.955   6.549
  273   1HZ   LYS  40           HZ1      LYS  40  79.137 -10.463   6.117
  274   2HZ   LYS  40           HZ3      LYS  40  80.790 -10.275   6.444
  275   3HZ   LYS  40           HZ2      LYS  40  79.640  -9.869   7.627
  276    H    ALA  41           HN       ALA  41  74.107  -7.478   4.406
  277    HA   ALA  41           HA       ALA  41  73.102  -9.722   2.775
  278   1HB   ALA  41           HB1      ALA  41  72.887  -9.427   5.370
  279   2HB   ALA  41           HB3      ALA  41  71.542  -8.361   4.961
  280   3HB   ALA  41           HB2      ALA  41  71.508 -10.054   4.466
  281    H    LEU  42           HN       LEU  42  72.830  -6.296   2.927
  282    HA   LEU  42           HA       LEU  42  70.228  -5.775   2.071
  283   1HB   LEU  42           HB2      LEU  42  72.776  -4.412   1.961
  284   2HB   LEU  42           HB1      LEU  42  71.907  -4.154   0.453
  285    HG   LEU  42           HG       LEU  42  71.132  -2.391   1.778
  286   1HD1  LEU  42          HD13      LEU  42  69.332  -4.406   1.172
  287   2HD1  LEU  42          HD12      LEU  42  69.005  -4.076   2.876
  288   3HD1  LEU  42          HD11      LEU  42  68.911  -2.773   1.688
  289   1HD2  LEU  42          HD22      LEU  42  71.430  -4.356   4.021
  290   2HD2  LEU  42          HD21      LEU  42  72.038  -2.705   3.890
  291   3HD2  LEU  42          HD23      LEU  42  70.331  -2.989   4.216
  292    H    GLY  43           HN       GLY  43  72.899  -7.160   0.246
  293   1HA   GLY  43           HA2      GLY  43  71.671  -6.908  -2.354
  294   2HA   GLY  43           HA1      GLY  43  73.006  -7.988  -1.951
  295    H    THR  44           HN       THR  44  71.654  -9.465   0.117
  296    HA   THR  44           HA       THR  44  70.296 -11.412  -1.498
  297    HB   THR  44           HB       THR  44  71.488 -11.554   0.893
  298    HG1  THR  44           HG1      THR  44  70.968 -13.542   0.570
  299   1HG2  THR  44          HG23      THR  44  68.547 -11.248   1.552
  300   2HG2  THR  44          HG22      THR  44  69.750 -11.910   2.657
  301   3HG2  THR  44          HG21      THR  44  69.868 -10.233   2.129
  302    H    VAL  45           HN       VAL  45  69.145  -9.047   0.878
  303    HA   VAL  45           HA       VAL  45  66.372  -9.599   0.675
  304    HB   VAL  45           HB       VAL  45  67.636  -6.874   1.085
  305   1HG1  VAL  45          HG13      VAL  45  64.938  -8.060   1.442
  306   2HG1  VAL  45          HG12      VAL  45  65.502  -7.005   2.739
  307   3HG1  VAL  45          HG11      VAL  45  65.399  -6.395   1.086
  308   1HG2  VAL  45          HG21      VAL  45  68.269  -9.109   2.525
  309   2HG2  VAL  45          HG23      VAL  45  68.266  -7.477   3.193
  310   3HG2  VAL  45          HG22      VAL  45  66.864  -8.524   3.416
  311    H    MET  46           HN       MET  46  68.528  -7.794  -1.429
  312    HA   MET  46           HA       MET  46  66.617  -6.339  -2.935
  313   1HB   MET  46           HB2      MET  46  69.369  -7.368  -3.422
  314   2HB   MET  46           HB1      MET  46  68.430  -6.906  -4.842
  315   1HG   MET  46           HG2      MET  46  68.272  -4.989  -2.608
  316   2HG   MET  46           HG1      MET  46  69.882  -5.155  -3.310
  317   1HE   MET  46           HE2      MET  46  68.958  -2.800  -3.135
  318   2HE   MET  46           HE1      MET  46  69.284  -2.106  -4.721
  319   3HE   MET  46           HE3      MET  46  67.632  -2.139  -4.089
  320    H    ARG  47           HN       ARG  47  67.702  -9.707  -3.225
  321    HA   ARG  47           HA       ARG  47  66.043 -10.170  -5.595
  322   1HB   ARG  47           HB2      ARG  47  68.094 -11.607  -4.109
  323   2HB   ARG  47           HB1      ARG  47  66.728 -12.653  -4.500
  324   1HG   ARG  47           HG2      ARG  47  66.931 -11.524  -6.876
  325   2HG   ARG  47           HG1      ARG  47  68.581 -11.190  -6.350
  326   1HD   ARG  47           HD2      ARG  47  67.232 -13.875  -6.662
  327   2HD   ARG  47           HD1      ARG  47  68.709 -13.300  -7.436
  328    HE   ARG  47           HE       ARG  47  69.080 -13.290  -4.599
  329   1HH1  ARG  47          HH11      ARG  47  71.167 -14.416  -6.268
  330   2HH1  ARG  47          HH12      ARG  47  71.017 -16.125  -6.032
  331   1HH2  ARG  47          HH21      ARG  47  67.809 -15.929  -4.728
  332   2HH2  ARG  47          HH22      ARG  47  69.115 -16.981  -5.161
  333    H    MET  48           HN       MET  48  65.710 -10.442  -2.132
  334    HA   MET  48           HA       MET  48  63.547 -12.312  -2.051
  335   1HB   MET  48           HB2      MET  48  64.461 -10.105  -0.209
  336   2HB   MET  48           HB1      MET  48  63.003 -11.035   0.140
  337   1HG   MET  48           HG2      MET  48  64.984 -12.921  -0.572
  338   2HG   MET  48           HG1      MET  48  65.760 -11.789   0.535
  339   1HE   MET  48           HE1      MET  48  65.998 -12.164   2.552
  340   2HE   MET  48           HE3      MET  48  65.003 -13.015   3.742
  341   3HE   MET  48           HE2      MET  48  65.923 -13.924   2.545
  342    H    LEU  49           HN       LEU  49  63.660  -8.818  -2.585
  343    HA   LEU  49           HA       LEU  49  60.712  -8.666  -2.649
  344   1HB   LEU  49           HB2      LEU  49  62.482  -6.398  -3.488
  345   2HB   LEU  49           HB1      LEU  49  60.959  -6.356  -2.600
  346    HG   LEU  49           HG       LEU  49  63.660  -7.230  -1.544
  347   1HD1  LEU  49          HD13      LEU  49  62.490  -4.720  -1.700
  348   2HD1  LEU  49          HD12      LEU  49  62.079  -5.253  -0.069
  349   3HD1  LEU  49          HD11      LEU  49  63.767  -5.187  -0.577
  350   1HD2  LEU  49          HD22      LEU  49  61.777  -8.682  -0.744
  351   2HD2  LEU  49          HD21      LEU  49  62.522  -7.742   0.549
  352   3HD2  LEU  49          HD23      LEU  49  60.975  -7.235  -0.129
  353    H    GLY  50           HN       GLY  50  63.377  -9.058  -4.825
  354   1HA   GLY  50           HA2      GLY  50  62.683  -9.973  -7.072
  355   2HA   GLY  50           HA1      GLY  50  61.503  -8.665  -7.126
  356    H    GLN  51           HN       GLN  51  65.015  -9.252  -6.928
  357    HA   GLN  51           HA       GLN  51  65.683  -7.474  -9.025
  358   1HB   GLN  51           HB2      GLN  51  64.909  -6.076  -6.709
  359   2HB   GLN  51           HB1      GLN  51  66.669  -5.998  -6.732
  360   1HG   GLN  51           HG2      GLN  51  66.645  -5.130  -9.012
  361   2HG   GLN  51           HG1      GLN  51  64.891  -5.306  -9.088
  362   1HE2  GLN  51          HE22      GLN  51  64.325  -2.174  -7.600
  363   2HE2  GLN  51          HE21      GLN  51  63.725  -3.462  -8.529
  364    H    ASN  52           HN       ASN  52  67.725  -8.059  -9.606
  365    HA   ASN  52           HA       ASN  52  69.648  -8.849  -7.477
  366   1HB   ASN  52           HB2      ASN  52  70.278 -10.873  -8.726
  367   2HB   ASN  52           HB1      ASN  52  68.573 -10.931  -8.284
  368   1HD2  ASN  52          HD22      ASN  52  69.608 -10.988 -12.184
  369   2HD2  ASN  52          HD21      ASN  52  70.764 -11.057 -10.942
  370    HA   PRO  53           HA       PRO  53  71.543  -6.195 -10.721
  371   1HB   PRO  53           HB2      PRO  53  72.639  -4.416  -8.932
  372   2HB   PRO  53           HB1      PRO  53  71.008  -4.250  -9.604
  373   1HG   PRO  53           HG2      PRO  53  71.833  -5.117  -6.871
  374   2HG   PRO  53           HG1      PRO  53  70.325  -4.349  -7.397
  375   1HD   PRO  53           HD2      PRO  53  70.674  -7.101  -6.834
  376   2HD   PRO  53           HD1      PRO  53  69.286  -6.373  -7.672
  377    H    THR  54           HN       THR  54  73.917  -5.761 -11.004
  378    HA   THR  54           HA       THR  54  75.505  -7.992 -10.029
  379    HB   THR  54           HB       THR  54  75.814  -7.000 -12.293
  380    HG1  THR  54           HG1      THR  54  77.546  -8.097 -11.416
  381   1HG2  THR  54          HG23      THR  54  76.672  -4.627 -10.637
  382   2HG2  THR  54          HG22      THR  54  77.183  -4.832 -12.313
  383   3HG2  THR  54          HG21      THR  54  75.470  -4.678 -11.925
  384    H    LYS  55           HN       LYS  55  77.300  -7.879  -8.601
  385    HA   LYS  55           HA       LYS  55  77.062  -6.220  -6.335
  386   1HB   LYS  55           HB2      LYS  55  79.613  -7.466  -7.410
  387   2HB   LYS  55           HB1      LYS  55  79.321  -6.959  -5.746
  388   1HG   LYS  55           HG2      LYS  55  77.157  -8.624  -6.360
  389   2HG   LYS  55           HG1      LYS  55  78.554  -9.431  -7.070
  390   1HD   LYS  55           HD2      LYS  55  79.701  -8.883  -4.777
  391   2HD   LYS  55           HD1      LYS  55  78.044  -8.721  -4.194
  392   1HE   LYS  55           HE2      LYS  55  77.942 -11.060  -5.666
  393   2HE   LYS  55           HE1      LYS  55  79.537 -11.141  -4.919
  394   1HZ   LYS  55           HZ1      LYS  55  77.213 -10.360  -3.296
  395   2HZ   LYS  55           HZ3      LYS  55  77.471 -11.999  -3.641
  396   3HZ   LYS  55           HZ2      LYS  55  78.660 -11.111  -2.814
  397    H    GLU  56           HN       GLU  56  78.344  -5.483  -9.449
  398    HA   GLU  56           HA       GLU  56  80.224  -3.454  -8.784
  399   1HB   GLU  56           HB2      GLU  56  78.559  -4.115 -11.174
  400   2HB   GLU  56           HB1      GLU  56  79.289  -2.509 -11.106
  401   1HG   GLU  56           HG2      GLU  56  81.141  -4.643 -10.320
  402   2HG   GLU  56           HG1      GLU  56  80.563  -4.804 -11.980
  403    H    GLU  57           HN       GLU  57  76.901  -2.858  -9.998
  404    HA   GLU  57           HA       GLU  57  76.880  -0.164  -8.965
  405   1HB   GLU  57           HB2      GLU  57  74.430  -0.261  -9.512
  406   2HB   GLU  57           HB1      GLU  57  75.469  -0.730 -10.857
  407   1HG   GLU  57           HG2      GLU  57  75.089  -3.126  -9.542
  408   2HG   GLU  57           HG1      GLU  57  73.523  -2.335  -9.354
  409    H    LEU  58           HN       LEU  58  76.379  -3.209  -7.497
  410    HA   LEU  58           HA       LEU  58  74.466  -2.433  -5.481
  411   1HB   LEU  58           HB2      LEU  58  75.476  -4.813  -6.221
  412   2HB   LEU  58           HB1      LEU  58  76.531  -4.489  -4.845
  413    HG   LEU  58           HG       LEU  58  74.492  -5.729  -4.164
  414   1HD1  LEU  58          HD12      LEU  58  75.627  -4.093  -2.632
  415   2HD1  LEU  58          HD11      LEU  58  74.475  -2.867  -3.162
  416   3HD1  LEU  58          HD13      LEU  58  73.908  -4.293  -2.294
  417   1HD2  LEU  58          HD21      LEU  58  73.243  -4.011  -5.985
  418   2HD2  LEU  58          HD23      LEU  58  72.437  -5.140  -4.896
  419   3HD2  LEU  58          HD22      LEU  58  72.676  -3.461  -4.409
  420    H    ASP  59           HN       ASP  59  78.016  -2.914  -5.227
  421    HA   ASP  59           HA       ASP  59  78.341  -1.852  -2.644
  422   1HB   ASP  59           HB2      ASP  59  80.046  -2.818  -4.534
  423   2HB   ASP  59           HB1      ASP  59  80.438  -1.100  -4.594
  424    H    ALA  60           HN       ALA  60  78.464  -0.105  -5.763
  425    HA   ALA  60           HA       ALA  60  78.934   2.481  -4.677
  426   1HB   ALA  60           HB1      ALA  60  78.067   1.358  -7.236
  427   2HB   ALA  60           HB3      ALA  60  77.315   2.917  -6.897
  428   3HB   ALA  60           HB2      ALA  60  79.073   2.771  -6.918
  429    H    ILE  61           HN       ILE  61  75.948   0.651  -5.156
  430    HA   ILE  61           HA       ILE  61  74.105   2.743  -4.561
  431    HB   ILE  61           HB       ILE  61  74.002  -0.263  -4.319
  432   1HG1  ILE  61          HG12      ILE  61  72.262   1.564  -5.972
  433   2HG1  ILE  61          HG11      ILE  61  73.871   1.099  -6.527
  434   1HG2  ILE  61          HG23      ILE  61  72.609   0.700  -2.501
  435   2HG2  ILE  61          HG22      ILE  61  71.749   1.668  -3.697
  436   3HG2  ILE  61          HG21      ILE  61  71.631  -0.093  -3.735
  437   1HD1  ILE  61          HD12      ILE  61  72.159  -1.112  -5.538
  438   2HD1  ILE  61          HD11      ILE  61  71.647  -0.361  -7.049
  439   3HD1  ILE  61          HD13      ILE  61  73.258  -1.069  -6.917
  440    H    ILE  62           HN       ILE  62  75.130   0.098  -2.373
  441    HA   ILE  62           HA       ILE  62  74.116   1.109   0.016
  442    HB   ILE  62           HB       ILE  62  76.687  -0.401  -0.515
  443   1HG1  ILE  62          HG12      ILE  62  74.169  -1.421   0.793
  444   2HG1  ILE  62          HG11      ILE  62  74.297  -1.348  -0.965
  445   1HG2  ILE  62          HG21      ILE  62  75.382   0.436   2.076
  446   2HG2  ILE  62          HG23      ILE  62  76.422  -0.985   1.981
  447   3HG2  ILE  62          HG22      ILE  62  77.072   0.607   1.594
  448   1HD1  ILE  62          HD11      ILE  62  76.369  -2.699   0.781
  449   2HD1  ILE  62          HD13      ILE  62  75.002  -3.558   0.068
  450   3HD1  ILE  62          HD12      ILE  62  76.208  -2.801  -0.973
  451    H    GLU  63           HN       GLU  63  76.901   2.217  -1.798
  452    HA   GLU  63           HA       GLU  63  78.126   3.747   0.305
  453   1HB   GLU  63           HB2      GLU  63  78.437   3.422  -2.584
  454   2HB   GLU  63           HB1      GLU  63  78.709   5.086  -2.063
  455   1HG   GLU  63           HG2      GLU  63  80.552   4.538  -0.797
  456   2HG   GLU  63           HG1      GLU  63  79.941   2.927  -0.417
  457    H    GLU  64           HN       GLU  64  76.049   4.818  -2.417
  458    HA   GLU  64           HA       GLU  64  75.728   7.482  -1.395
  459   1HB   GLU  64           HB2      GLU  64  73.803   5.984  -3.192
  460   2HB   GLU  64           HB1      GLU  64  74.008   7.731  -3.070
  461   1HG   GLU  64           HG2      GLU  64  76.518   6.343  -3.647
  462   2HG   GLU  64           HG1      GLU  64  75.296   6.084  -4.893
  463    H    VAL  65           HN       VAL  65  74.438   4.506  -0.367
  464    HA   VAL  65           HA       VAL  65  72.003   5.728   0.789
  465    HB   VAL  65           HB       VAL  65  73.072   2.890   0.888
  466   1HG1  VAL  65          HG12      VAL  65  70.679   4.238   2.097
  467   2HG1  VAL  65          HG11      VAL  65  70.539   2.566   1.554
  468   3HG1  VAL  65          HG13      VAL  65  71.725   2.997   2.785
  469   1HG2  VAL  65          HG21      VAL  65  71.453   4.419  -1.015
  470   2HG2  VAL  65          HG23      VAL  65  72.235   2.850  -1.216
  471   3HG2  VAL  65          HG22      VAL  65  70.644   2.952  -0.461
  472    H    ASP  66           HN       ASP  66  75.222   4.754   1.713
  473    HA   ASP  66           HA       ASP  66  74.579   4.963   4.594
  474   1HB   ASP  66           HB2      ASP  66  76.679   3.747   2.999
  475   2HB   ASP  66           HB1      ASP  66  77.362   4.756   4.276
  476    H    GLU  67           HN       GLU  67  73.955   7.328   4.086
  477    HA   GLU  67           HA       GLU  67  75.952   9.259   3.413
  478   1HB   GLU  67           HB2      GLU  67  73.244   9.296   4.625
  479   2HB   GLU  67           HB1      GLU  67  74.268  10.683   4.997
  480   1HG   GLU  67           HG2      GLU  67  74.075   9.716   2.160
  481   2HG   GLU  67           HG1      GLU  67  72.783  10.715   2.826
  482    H    ASP  68           HN       ASP  68  75.301   7.516   6.347
  483    HA   ASP  68           HA       ASP  68  77.086   9.348   7.876
  484   1HB   ASP  68           HB2      ASP  68  76.315   7.773   9.806
  485   2HB   ASP  68           HB1      ASP  68  75.161   8.941   9.163
  486    H    GLY  69           HN       GLY  69  76.818   6.064   6.642
  487   1HA   GLY  69           HA2      GLY  69  78.648   4.604   6.194
  488   2HA   GLY  69           HA1      GLY  69  79.703   5.694   7.096
  489    H    SER  70           HN       SER  70  76.646   4.300   8.233
  490    HA   SER  70           HA       SER  70  77.904   3.438  10.706
  491   1HB   SER  70           HB2      SER  70  75.602   2.323  11.038
  492   2HB   SER  70           HB1      SER  70  75.632   4.080  10.908
  493    HG   SER  70           HG       SER  70  74.718   2.147   9.115
  494    H    GLY  71           HN       GLY  71  77.613   2.068   7.600
  495   1HA   GLY  71           HA2      GLY  71  78.660   0.025   6.927
  496   2HA   GLY  71           HA1      GLY  71  78.710  -0.477   8.617
  497    H    THR  72           HN       THR  72  75.664   0.742   7.969
  498    HA   THR  72           HA       THR  72  74.583  -1.802   6.912
  499    HB   THR  72           HB       THR  72  73.183  -2.257   8.774
  500    HG1  THR  72           HG1      THR  72  72.534  -0.165   9.236
  501   1HG2  THR  72          HG22      THR  72  75.903  -1.357   9.748
  502   2HG2  THR  72          HG21      THR  72  74.784  -2.319  10.712
  503   3HG2  THR  72          HG23      THR  72  75.446  -2.975   9.216
  504    H    ILE  73           HN       ILE  73  71.981  -1.477   7.013
  505    HA   ILE  73           HA       ILE  73  71.419   1.331   6.154
  506    HB   ILE  73           HB       ILE  73  70.237  -1.129   4.846
  507   1HG1  ILE  73          HG12      ILE  73  72.775  -0.897   4.595
  508   2HG1  ILE  73          HG11      ILE  73  71.852  -0.929   3.093
  509   1HG2  ILE  73          HG22      ILE  73  68.977   1.011   4.673
  510   2HG2  ILE  73          HG21      ILE  73  70.404   1.773   3.971
  511   3HG2  ILE  73          HG23      ILE  73  69.587   0.470   3.108
  512   1HD1  ILE  73          HD12      ILE  73  72.221   1.758   4.273
  513   2HD1  ILE  73          HD11      ILE  73  73.698   0.986   3.696
  514   3HD1  ILE  73          HD13      ILE  73  72.347   1.238   2.591
  515    H    ASP  74           HN       ASP  74  69.576   2.174   7.055
  516    HA   ASP  74           HA       ASP  74  67.935   0.331   8.727
  517   1HB   ASP  74           HB2      ASP  74  67.081   2.605   9.652
  518   2HB   ASP  74           HB1      ASP  74  68.715   2.098  10.085
  519    H    PHE  75           HN       PHE  75  65.536   1.250   8.881
  520    HA   PHE  75           HA       PHE  75  64.258   0.790   6.419
  521   1HB   PHE  75           HB2      PHE  75  63.281   0.936   8.836
  522   2HB   PHE  75           HB1      PHE  75  63.055   2.645   8.462
  523    HD1  PHE  75           HD2      PHE  75  62.780  -0.400   6.299
  524    HD2  PHE  75           HD1      PHE  75  60.768   2.971   8.047
  525    HE1  PHE  75           HE2      PHE  75  60.732  -0.952   5.011
  526    HE2  PHE  75           HE1      PHE  75  58.723   2.419   6.757
  527    HZ   PHE  75           HZ       PHE  75  58.705   0.458   5.240
  528    H    GLU  76           HN       GLU  76  65.211   3.889   7.892
  529    HA   GLU  76           HA       GLU  76  64.065   5.568   5.885
  530   1HB   GLU  76           HB2      GLU  76  66.485   6.010   7.660
  531   2HB   GLU  76           HB1      GLU  76  65.701   7.269   6.706
  532   1HG   GLU  76           HG2      GLU  76  63.525   6.464   7.935
  533   2HG   GLU  76           HG1      GLU  76  64.660   5.795   9.109
  534    H    GLU  77           HN       GLU  77  67.307   4.109   6.164
  535    HA   GLU  77           HA       GLU  77  68.294   5.314   3.728
  536   1HB   GLU  77           HB2      GLU  77  69.243   2.838   5.202
  537   2HB   GLU  77           HB1      GLU  77  70.142   3.691   3.946
  538   1HG   GLU  77           HG2      GLU  77  70.081   5.750   5.357
  539   2HG   GLU  77           HG1      GLU  77  69.299   4.815   6.632
  540    H    PHE  78           HN       PHE  78  66.256   2.606   4.392
  541    HA   PHE  78           HA       PHE  78  66.840   1.050   2.044
  542   1HB   PHE  78           HB2      PHE  78  65.179   0.776   4.269
  543   2HB   PHE  78           HB1      PHE  78  64.059   0.903   2.912
  544    HD1  PHE  78           HD1      PHE  78  66.839  -1.037   4.371
  545    HD2  PHE  78           HD2      PHE  78  64.008  -0.771   1.149
  546    HE1  PHE  78           HE1      PHE  78  67.362  -3.372   3.718
  547    HE2  PHE  78           HE2      PHE  78  64.532  -3.105   0.497
  548    HZ   PHE  78           HZ       PHE  78  66.208  -4.406   1.781
  549    H    LEU  79           HN       LEU  79  63.973   3.096   2.701
  550    HA   LEU  79           HA       LEU  79  62.853   3.177   0.179
  551   1HB   LEU  79           HB2      LEU  79  63.222   5.616   1.946
  552   2HB   LEU  79           HB1      LEU  79  61.974   5.388   0.721
  553    HG   LEU  79           HG       LEU  79  62.322   3.741   3.245
  554   1HD1  LEU  79          HD13      LEU  79  60.263   5.781   2.361
  555   2HD1  LEU  79          HD12      LEU  79  60.052   4.716   3.751
  556   3HD1  LEU  79          HD11      LEU  79  61.358   5.901   3.738
  557   1HD2  LEU  79          HD23      LEU  79  61.067   3.125   0.732
  558   2HD2  LEU  79          HD22      LEU  79  61.114   2.148   2.200
  559   3HD2  LEU  79          HD21      LEU  79  59.815   3.317   1.960
  560    H    VAL  80           HN       VAL  80  65.754   4.874   1.264
  561    HA   VAL  80           HA       VAL  80  66.057   6.491  -1.107
  562    HB   VAL  80           HB       VAL  80  68.000   5.579   1.027
  563   1HG1  VAL  80          HG13      VAL  80  68.446   7.423  -1.338
  564   2HG1  VAL  80          HG12      VAL  80  69.536   7.305   0.044
  565   3HG1  VAL  80          HG11      VAL  80  69.287   5.909  -1.005
  566   1HG2  VAL  80          HG21      VAL  80  66.502   8.130   0.405
  567   2HG2  VAL  80          HG23      VAL  80  66.463   7.179   1.889
  568   3HG2  VAL  80          HG22      VAL  80  67.902   8.109   1.477
  569    H    MET  81           HN       MET  81  67.566   3.419  -0.068
  570    HA   MET  81           HA       MET  81  69.177   2.967  -2.327
  571   1HB   MET  81           HB2      MET  81  68.858   1.569  -0.129
  572   2HB   MET  81           HB1      MET  81  67.654   0.697  -1.079
  573   1HG   MET  81           HG2      MET  81  69.259   0.017  -2.691
  574   2HG   MET  81           HG1      MET  81  70.448   1.185  -2.116
  575   1HE   MET  81           HE3      MET  81  71.180   1.301   0.274
  576   2HE   MET  81           HE2      MET  81  71.917  -0.122   1.006
  577   3HE   MET  81           HE1      MET  81  72.431   0.402  -0.597
  578    H    MET  82           HN       MET  82  65.740   2.137  -1.845
  579    HA   MET  82           HA       MET  82  65.372   0.847  -4.368
  580   1HB   MET  82           HB2      MET  82  63.277   2.444  -2.873
  581   2HB   MET  82           HB1      MET  82  63.013   1.083  -3.964
  582   1HG   MET  82           HG2      MET  82  64.374   1.001  -1.256
  583   2HG   MET  82           HG1      MET  82  62.825   0.274  -1.685
  584   1HE   MET  82           HE1      MET  82  62.491  -1.421  -3.499
  585   2HE   MET  82           HE3      MET  82  63.569  -0.722  -4.714
  586   3HE   MET  82           HE2      MET  82  63.731  -2.416  -4.259
  587    H    VAL  83           HN       VAL  83  64.484   4.191  -3.410
  588    HA   VAL  83           HA       VAL  83  63.804   5.056  -6.032
  589    HB   VAL  83           HB       VAL  83  65.007   6.763  -3.834
  590   1HG1  VAL  83          HG11      VAL  83  63.686   7.257  -6.430
  591   2HG1  VAL  83          HG13      VAL  83  63.055   8.215  -5.090
  592   3HG1  VAL  83          HG12      VAL  83  64.769   8.296  -5.501
  593   1HG2  VAL  83          HG21      VAL  83  62.750   5.146  -3.637
  594   2HG2  VAL  83          HG23      VAL  83  63.091   6.561  -2.642
  595   3HG2  VAL  83          HG22      VAL  83  62.091   6.719  -4.086
  596    H    ARG  84           HN       ARG  84  66.850   4.292  -4.678
  597    HA   ARG  84           HA       ARG  84  68.540   6.082  -6.130
  598   1HB   ARG  84           HB2      ARG  84  68.880   3.912  -4.361
  599   2HB   ARG  84           HB1      ARG  84  69.735   3.464  -5.837
  600   1HG   ARG  84           HG2      ARG  84  71.363   4.677  -4.668
  601   2HG   ARG  84           HG1      ARG  84  70.673   5.903  -5.732
  602   1HD   ARG  84           HD2      ARG  84  69.011   5.962  -3.501
  603   2HD   ARG  84           HD1      ARG  84  70.622   5.745  -2.816
  604    HE   ARG  84           HE       ARG  84  71.253   7.879  -3.704
  605   1HH1  ARG  84          HH21      ARG  84  70.687   8.975  -5.909
  606   2HH1  ARG  84          HH22      ARG  84  69.073   9.602  -5.934
  607   1HH2  ARG  84          HH11      ARG  84  68.040   7.780  -3.169
  608   2HH2  ARG  84          HH12      ARG  84  67.575   8.926  -4.382
  609    H    GLN  85           HN       GLN  85  67.280   2.843  -6.936
  610    HA   GLN  85           HA       GLN  85  68.396   3.151  -9.678
  611   1HB   GLN  85           HB2      GLN  85  67.467   0.832  -8.023
  612   2HB   GLN  85           HB1      GLN  85  67.394   0.699  -9.781
  613   1HG   GLN  85           HG2      GLN  85  69.855   1.380  -8.144
  614   2HG   GLN  85           HG1      GLN  85  69.548  -0.147  -8.975
  615   1HE2  GLN  85          HE22      GLN  85  69.638   1.822 -12.216
  616   2HE2  GLN  85          HE21      GLN  85  68.374   1.056 -11.383
  617    H    MET  86           HN       MET  86  65.630   3.965  -8.085
  618    HA   MET  86           HA       MET  86  63.552   2.980  -9.780
  619   1HB   MET  86           HB2      MET  86  63.845   5.293  -7.899
  620   2HB   MET  86           HB1      MET  86  62.457   5.264  -8.988
  621   1HG   MET  86           HG2      MET  86  62.319   2.736  -8.123
  622   2HG   MET  86           HG1      MET  86  63.129   3.440  -6.724
  623   1HE   MET  86           HE1      MET  86  60.467   2.032  -6.542
  624   2HE   MET  86           HE3      MET  86  61.108   2.873  -5.123
  625   3HE   MET  86           HE2      MET  86  59.428   3.103  -5.604
  626    H    LYS  87           HN       LYS  87  64.161   6.453  -9.737
  627    HA   LYS  87           HA       LYS  87  64.593   6.365 -12.690
  628   1HB   LYS  87           HB2      LYS  87  63.139   8.469 -12.773
  629   2HB   LYS  87           HB1      LYS  87  62.286   6.954 -12.480
  630   1HG   LYS  87           HG2      LYS  87  61.518   7.735 -10.517
  631   2HG   LYS  87           HG1      LYS  87  63.168   8.023  -9.965
  632   1HD   LYS  87           HD2      LYS  87  62.760  10.088 -11.758
  633   2HD   LYS  87           HD1      LYS  87  61.184   9.928 -10.982
  634   1HE   LYS  87           HE2      LYS  87  62.210  10.116  -8.774
  635   2HE   LYS  87           HE1      LYS  87  63.818  10.167  -9.498
  636   1HZ   LYS  87           HZ2      LYS  87  62.359  12.117 -10.782
  637   2HZ   LYS  87           HZ1      LYS  87  61.949  12.272  -9.141
  638   3HZ   LYS  87           HZ3      LYS  87  63.574  12.352  -9.617
  639    H    GLU  88           HN       GLU  88  66.826   6.835 -12.346
  640    HA   GLU  88           HA       GLU  88  67.343   9.570 -11.246
  641   1HB   GLU  88           HB2      GLU  88  68.323   7.468 -10.043
  642   2HB   GLU  88           HB1      GLU  88  69.451   7.428 -11.398
  643   1HG   GLU  88           HG2      GLU  88  70.664   8.857 -10.095
  644   2HG   GLU  88           HG1      GLU  88  69.559  10.066 -10.750
  645    H    ASP  89           HN       ASP  89  67.909   7.280 -13.840
  646    HA   ASP  89           HA       ASP  89  69.518   9.346 -15.277
  647   1HB   ASP  89           HB2      ASP  89  69.964   6.620 -14.948
  648   2HB   ASP  89           HB1      ASP  89  69.295   6.735 -16.576
  649    H    ALA  90           HN       ALA  90  66.662   9.601 -15.022
  650    HA   ALA  90           HA       ALA  90  65.926   9.359 -17.903
  651   1HB   ALA  90           HB3      ALA  90  64.807   7.546 -16.619
  652   2HB   ALA  90           HB2      ALA  90  64.078   8.763 -15.573
  653   3HB   ALA  90           HB1      ALA  90  63.649   8.699 -17.282
   
  No H/Q in entry =         653
  Start of MODEL   35
    1   1H    ALA   1           HT2      ALA   1  74.790  13.644  10.819
    2   2H    ALA   1           HT1      ALA   1  74.212  13.664   9.222
    3   3H    ALA   1           HT3      ALA   1  75.856  13.944   9.529
    4    HA   ALA   1           HA       ALA   1  75.358  16.003  10.648
    5   1HB   ALA   1           HB2      ALA   1  75.581  15.859   8.109
    6   2HB   ALA   1           HB1      ALA   1  73.820  15.916   8.044
    7   3HB   ALA   1           HB3      ALA   1  74.721  17.271   8.723
    8    H    SER   2           HN       SER   2  72.338  15.078   8.958
    9    HA   SER   2           HA       SER   2  70.777  15.323  11.413
   10   1HB   SER   2           HB2      SER   2  71.312  17.717  10.276
   11   2HB   SER   2           HB1      SER   2  69.885  17.267   9.347
   12    HG   SER   2           HG       SER   2  70.182  17.589  12.139
   13    H    MET   3           HN       MET   3  70.268  15.782   7.894
   14    HA   MET   3           HA       MET   3  69.008  13.217   7.553
   15   1HB   MET   3           HB2      MET   3  66.689  13.989   7.218
   16   2HB   MET   3           HB1      MET   3  67.217  14.297   8.873
   17   1HG   MET   3           HG2      MET   3  67.957  16.627   7.900
   18   2HG   MET   3           HG1      MET   3  66.795  16.247   6.629
   19   1HE   MET   3           HE3      MET   3  67.709  17.623   9.533
   20   2HE   MET   3           HE2      MET   3  66.327  18.716   9.561
   21   3HE   MET   3           HE1      MET   3  66.496  17.485  10.812
   22    H    THR   4           HN       THR   4  70.183  13.090   5.635
   23    HA   THR   4           HA       THR   4  70.537  15.150   3.732
   24    HB   THR   4           HB       THR   4  71.263  13.456   2.229
   25    HG1  THR   4           HG1      THR   4  69.552  11.778   3.735
   26   1HG2  THR   4          HG23      THR   4  72.133  13.508   4.842
   27   2HG2  THR   4          HG22      THR   4  71.774  11.798   4.601
   28   3HG2  THR   4          HG21      THR   4  72.914  12.618   3.534
   29    H    ASP   5           HN       ASP   5  69.301  15.858   1.990
   30    HA   ASP   5           HA       ASP   5  66.461  15.555   2.129
   31   1HB   ASP   5           HB2      ASP   5  68.294  16.583  -0.050
   32   2HB   ASP   5           HB1      ASP   5  66.536  16.610  -0.193
   33    H    GLN   6           HN       GLN   6  68.866  13.500   0.855
   34    HA   GLN   6           HA       GLN   6  67.547  12.327  -1.368
   35   1HB   GLN   6           HB2      GLN   6  69.436  11.139   0.683
   36   2HB   GLN   6           HB1      GLN   6  68.892  10.264  -0.749
   37   1HG   GLN   6           HG2      GLN   6  69.678  12.611  -1.877
   38   2HG   GLN   6           HG1      GLN   6  70.806  12.512  -0.526
   39   1HE2  GLN   6          HE22      GLN   6  71.631   9.026  -1.911
   40   2HE2  GLN   6          HE21      GLN   6  70.680   9.479  -0.579
   41    H    GLN   7           HN       GLN   7  67.145  11.811   2.104
   42    HA   GLN   7           HA       GLN   7  65.387   9.513   1.778
   43   1HB   GLN   7           HB2      GLN   7  65.429  11.283   4.215
   44   2HB   GLN   7           HB1      GLN   7  65.183   9.539   4.120
   45   1HG   GLN   7           HG2      GLN   7  67.581   9.396   3.233
   46   2HG   GLN   7           HG1      GLN   7  67.761  11.073   3.754
   47   1HE2  GLN   7          HE22      GLN   7  68.405   8.331   6.487
   48   2HE2  GLN   7          HE21      GLN   7  68.644   8.168   4.814
   49    H    ALA   8           HN       ALA   8  64.952  13.003   2.231
   50    HA   ALA   8           HA       ALA   8  62.081  12.874   2.518
   51   1HB   ALA   8           HB1      ALA   8  63.770  14.818   3.061
   52   2HB   ALA   8           HB3      ALA   8  63.486  15.273   1.381
   53   3HB   ALA   8           HB2      ALA   8  62.138  15.209   2.517
   54    H    GLU   9           HN       GLU   9  64.204  12.591  -0.167
   55    HA   GLU   9           HA       GLU   9  62.192  13.436  -2.142
   56   1HB   GLU   9           HB2      GLU   9  65.038  12.933  -2.125
   57   2HB   GLU   9           HB1      GLU   9  64.273  12.016  -3.423
   58   1HG   GLU   9           HG2      GLU   9  63.030  14.199  -3.994
   59   2HG   GLU   9           HG1      GLU   9  64.213  14.998  -2.959
   60    H    ALA  10           HN       ALA  10  63.996  10.379  -1.606
   61    HA   ALA  10           HA       ALA  10  62.392   8.734  -3.222
   62   1HB   ALA  10           HB2      ALA  10  64.563   8.263  -1.729
   63   2HB   ALA  10           HB1      ALA  10  63.348   7.609  -0.627
   64   3HB   ALA  10           HB3      ALA  10  63.502   6.957  -2.258
   65    H    ARG  11           HN       ARG  11  61.837   9.836   0.095
   66    HA   ARG  11           HA       ARG  11  59.615   8.108   0.653
   67   1HB   ARG  11           HB2      ARG  11  60.974  10.270   1.947
   68   2HB   ARG  11           HB1      ARG  11  59.244  10.613   1.969
   69   1HG   ARG  11           HG2      ARG  11  58.740   8.600   3.103
   70   2HG   ARG  11           HG1      ARG  11  60.311   7.893   2.720
   71   1HD   ARG  11           HD2      ARG  11  60.340   8.580   5.045
   72   2HD   ARG  11           HD1      ARG  11  61.384   9.670   4.135
   73    HE   ARG  11           HE       ARG  11  58.736  10.365   5.277
   74   1HH1  ARG  11          HH21      ARG  11  58.110  12.223   3.683
   75   2HH1  ARG  11          HH22      ARG  11  59.316  13.464   3.620
   76   1HH2  ARG  11          HH11      ARG  11  61.780  11.511   5.082
   77   2HH2  ARG  11          HH12      ARG  11  61.394  13.061   4.413
   78    H    ALA  12           HN       ALA  12  59.865  11.274  -0.916
   79    HA   ALA  12           HA       ALA  12  57.020  11.735  -1.062
   80   1HB   ALA  12           HB2      ALA  12  59.467  12.984  -2.099
   81   2HB   ALA  12           HB1      ALA  12  58.103  13.097  -3.210
   82   3HB   ALA  12           HB3      ALA  12  57.961  13.734  -1.572
   83    H    PHE  13           HN       PHE  13  59.305   9.941  -3.025
   84    HA   PHE  13           HA       PHE  13  57.476   9.669  -5.287
   85   1HB   PHE  13           HB2      PHE  13  59.989   9.562  -5.478
   86   2HB   PHE  13           HB1      PHE  13  59.929   8.008  -4.646
   87    HD1  PHE  13           HD1      PHE  13  57.882   9.637  -7.345
   88    HD2  PHE  13           HD2      PHE  13  60.173   6.219  -6.111
   89    HE1  PHE  13           HE1      PHE  13  57.350   8.508  -9.488
   90    HE2  PHE  13           HE2      PHE  13  59.640   5.089  -8.254
   91    HZ   PHE  13           HZ       PHE  13  58.229   6.233  -9.941
   92    H    LEU  14           HN       LEU  14  58.266   7.831  -2.388
   93    HA   LEU  14           HA       LEU  14  56.555   5.586  -3.293
   94   1HB   LEU  14           HB2      LEU  14  57.927   5.809  -0.613
   95   2HB   LEU  14           HB1      LEU  14  57.439   4.350  -1.475
   96    HG   LEU  14           HG       LEU  14  59.474   6.256  -2.631
   97   1HD1  LEU  14          HD13      LEU  14  60.089   5.347  -0.297
   98   2HD1  LEU  14          HD12      LEU  14  60.158   3.763  -1.068
   99   3HD1  LEU  14          HD11      LEU  14  61.239   5.051  -1.601
  100   1HD2  LEU  14          HD21      LEU  14  58.297   3.640  -3.298
  101   2HD2  LEU  14          HD23      LEU  14  59.098   4.810  -4.347
  102   3HD2  LEU  14          HD22      LEU  14  60.057   3.674  -3.397
  103    H    SER  15           HN       SER  15  54.440   5.481  -2.709
  104    HA   SER  15           HA       SER  15  53.306   7.527  -0.964
  105   1HB   SER  15           HB2      SER  15  51.905   5.069  -2.035
  106   2HB   SER  15           HB1      SER  15  51.177   6.596  -1.544
  107    HG   SER  15           HG       SER  15  51.341   6.837  -3.678
  108    H    GLU  16           HN       GLU  16  51.654   6.657   0.769
  109    HA   GLU  16           HA       GLU  16  53.138   5.388   2.838
  110   1HB   GLU  16           HB2      GLU  16  50.245   6.041   2.405
  111   2HB   GLU  16           HB1      GLU  16  50.682   4.979   3.744
  112   1HG   GLU  16           HG2      GLU  16  52.180   7.552   3.339
  113   2HG   GLU  16           HG1      GLU  16  50.606   7.573   4.137
  114    H    GLU  17           HN       GLU  17  50.769   4.073   0.531
  115    HA   GLU  17           HA       GLU  17  50.756   1.421   1.660
  116   1HB   GLU  17           HB2      GLU  17  49.650   0.760  -0.417
  117   2HB   GLU  17           HB1      GLU  17  48.980   2.293   0.144
  118   1HG   GLU  17           HG2      GLU  17  49.562   3.267  -1.796
  119   2HG   GLU  17           HG1      GLU  17  51.252   2.867  -1.494
  120    H    MET  18           HN       MET  18  52.990   3.116  -0.365
  121    HA   MET  18           HA       MET  18  54.188   0.696  -1.500
  122   1HB   MET  18           HB2      MET  18  54.185   3.075  -2.526
  123   2HB   MET  18           HB1      MET  18  55.499   3.411  -1.395
  124   1HG   MET  18           HG2      MET  18  56.945   2.414  -2.797
  125   2HG   MET  18           HG1      MET  18  56.057   0.901  -2.619
  126   1HE   MET  18           HE3      MET  18  57.777   1.946  -4.763
  127   2HE   MET  18           HE2      MET  18  56.988   0.610  -5.597
  128   3HE   MET  18           HE1      MET  18  57.024   2.205  -6.342
  129    H    ILE  19           HN       ILE  19  55.359   3.202   0.783
  130    HA   ILE  19           HA       ILE  19  57.689   1.779   1.586
  131    HB   ILE  19           HB       ILE  19  56.003   3.854   3.007
  132   1HG1  ILE  19          HG12      ILE  19  58.714   4.584   2.320
  133   2HG1  ILE  19          HG11      ILE  19  57.885   3.955   0.896
  134   1HG2  ILE  19          HG21      ILE  19  58.394   2.306   3.903
  135   2HG2  ILE  19          HG23      ILE  19  58.342   4.026   4.286
  136   3HG2  ILE  19          HG22      ILE  19  57.058   2.958   4.851
  137   1HD1  ILE  19          HD12      ILE  19  56.323   5.821   2.596
  138   2HD1  ILE  19          HD11      ILE  19  57.669   6.527   1.701
  139   3HD1  ILE  19          HD13      ILE  19  56.385   5.682   0.838
  140    H    ALA  20           HN       ALA  20  54.373   1.736   2.862
  141    HA   ALA  20           HA       ALA  20  54.919   0.095   5.142
  142   1HB   ALA  20           HB3      ALA  20  52.446   0.629   3.500
  143   2HB   ALA  20           HB2      ALA  20  52.421  -0.538   4.823
  144   3HB   ALA  20           HB1      ALA  20  52.810   1.153   5.145
  145    H    GLU  21           HN       GLU  21  54.681  -0.629   1.756
  146    HA   GLU  21           HA       GLU  21  54.138  -3.473   2.109
  147   1HB   GLU  21           HB2      GLU  21  54.379  -1.617  -0.089
  148   2HB   GLU  21           HB1      GLU  21  55.370  -3.044  -0.399
  149   1HG   GLU  21           HG2      GLU  21  53.560  -4.398  -0.628
  150   2HG   GLU  21           HG1      GLU  21  52.716  -3.648   0.728
  151    H    PHE  22           HN       PHE  22  57.037  -1.579   1.195
  152    HA   PHE  22           HA       PHE  22  58.807  -3.839   1.188
  153   1HB   PHE  22           HB2      PHE  22  59.285  -0.867   1.504
  154   2HB   PHE  22           HB1      PHE  22  60.599  -2.043   1.454
  155    HD1  PHE  22           HD1      PHE  22  60.545  -3.740  -0.555
  156    HD2  PHE  22           HD2      PHE  22  58.464   0.018  -0.499
  157    HE1  PHE  22           HE1      PHE  22  60.426  -3.768  -3.033
  158    HE2  PHE  22           HE2      PHE  22  58.346  -0.011  -2.976
  159    HZ   PHE  22           HZ       PHE  22  59.326  -1.903  -4.243
  160    H    LYS  23           HN       LYS  23  57.569  -1.792   3.740
  161    HA   LYS  23           HA       LYS  23  59.456  -2.100   5.768
  162   1HB   LYS  23           HB2      LYS  23  57.380  -0.813   6.059
  163   2HB   LYS  23           HB1      LYS  23  56.440  -2.306   6.026
  164   1HG   LYS  23           HG2      LYS  23  56.768  -1.676   8.342
  165   2HG   LYS  23           HG1      LYS  23  57.757  -3.100   8.015
  166   1HD   LYS  23           HD2      LYS  23  59.697  -1.551   7.567
  167   2HD   LYS  23           HD1      LYS  23  58.689  -0.220   8.139
  168   1HE   LYS  23           HE2      LYS  23  58.851  -2.613   9.899
  169   2HE   LYS  23           HE1      LYS  23  60.305  -1.621   9.781
  170   1HZ   LYS  23           HZ1      LYS  23  58.941   0.327  10.313
  171   2HZ   LYS  23           HZ3      LYS  23  57.584  -0.674  10.505
  172   3HZ   LYS  23           HZ2      LYS  23  58.909  -0.832  11.558
  173    H    ALA  24           HN       ALA  24  57.458  -4.546   4.306
  174    HA   ALA  24           HA       ALA  24  57.645  -6.484   6.439
  175   1HB   ALA  24           HB3      ALA  24  56.631  -6.387   3.706
  176   2HB   ALA  24           HB2      ALA  24  57.424  -7.922   4.058
  177   3HB   ALA  24           HB1      ALA  24  56.085  -7.369   5.066
  178    H    ALA  25           HN       ALA  25  59.521  -5.961   3.447
  179    HA   ALA  25           HA       ALA  25  61.311  -8.153   3.813
  180   1HB   ALA  25           HB1      ALA  25  61.475  -5.546   2.314
  181   2HB   ALA  25           HB3      ALA  25  62.879  -6.610   2.406
  182   3HB   ALA  25           HB2      ALA  25  61.382  -7.187   1.673
  183    H    PHE  26           HN       PHE  26  61.385  -4.816   5.010
  184    HA   PHE  26           HA       PHE  26  63.991  -4.659   6.002
  185   1HB   PHE  26           HB2      PHE  26  62.163  -2.888   6.133
  186   2HB   PHE  26           HB1      PHE  26  61.567  -3.733   7.561
  187    HD1  PHE  26           HD1      PHE  26  64.975  -2.841   6.258
  188    HD2  PHE  26           HD2      PHE  26  62.203  -2.678   9.534
  189    HE1  PHE  26           HE1      PHE  26  66.686  -1.702   7.649
  190    HE2  PHE  26           HE2      PHE  26  63.912  -1.538  10.923
  191    HZ   PHE  26           HZ       PHE  26  66.154  -1.050   9.981
  192    H    ASP  27           HN       ASP  27  61.254  -5.514   8.143
  193    HA   ASP  27           HA       ASP  27  62.833  -6.657  10.182
  194   1HB   ASP  27           HB2      ASP  27  60.104  -7.737   9.490
  195   2HB   ASP  27           HB1      ASP  27  60.828  -7.511  11.083
  196    H    MET  28           HN       MET  28  62.066  -7.899   7.056
  197    HA   MET  28           HA       MET  28  62.226 -10.699   7.554
  198   1HB   MET  28           HB2      MET  28  61.920  -9.093   5.313
  199   2HB   MET  28           HB1      MET  28  63.487  -9.863   5.047
  200   1HG   MET  28           HG2      MET  28  60.997 -11.393   5.837
  201   2HG   MET  28           HG1      MET  28  61.512 -11.177   4.165
  202   1HE   MET  28           HE1      MET  28  63.947 -11.148   3.728
  203   2HE   MET  28           HE3      MET  28  65.116 -12.359   4.266
  204   3HE   MET  28           HE2      MET  28  63.845 -12.802   3.130
  205    H    PHE  29           HN       PHE  29  64.822  -8.519   6.373
  206    HA   PHE  29           HA       PHE  29  66.819 -10.545   7.182
  207   1HB   PHE  29           HB2      PHE  29  67.851  -7.967   6.224
  208   2HB   PHE  29           HB1      PHE  29  68.188  -9.595   5.642
  209    HD1  PHE  29           HD1      PHE  29  66.577 -10.710   4.056
  210    HD2  PHE  29           HD2      PHE  29  66.238  -6.572   5.154
  211    HE1  PHE  29           HE1      PHE  29  65.088 -10.316   2.111
  212    HE2  PHE  29           HE2      PHE  29  64.750  -6.177   3.209
  213    HZ   PHE  29           HZ       PHE  29  64.175  -8.049   1.688
  214    H    ASP  30           HN       ASP  30  65.131  -8.412   8.882
  215    HA   ASP  30           HA       ASP  30  67.357  -7.108  10.314
  216   1HB   ASP  30           HB2      ASP  30  64.975  -6.126   9.829
  217   2HB   ASP  30           HB1      ASP  30  64.492  -7.079  11.233
  218    H    ALA  31           HN       ALA  31  67.846  -9.715  10.577
  219    HA   ALA  31           HA       ALA  31  66.466 -10.991  12.778
  220   1HB   ALA  31           HB1      ALA  31  69.096 -11.518  11.381
  221   2HB   ALA  31           HB3      ALA  31  68.547 -12.492  12.746
  222   3HB   ALA  31           HB2      ALA  31  67.596 -12.440  11.261
  223    H    ASP  32           HN       ASP  32  68.769  -8.489  12.617
  224    HA   ASP  32           HA       ASP  32  70.166  -9.048  15.096
  225   1HB   ASP  32           HB2      ASP  32  69.879  -6.621  13.331
  226   2HB   ASP  32           HB1      ASP  32  70.690  -6.511  14.893
  227    H    GLY  33           HN       GLY  33  67.090  -7.684  14.290
  228   1HA   GLY  33           HA2      GLY  33  65.365  -6.888  15.667
  229   2HA   GLY  33           HA1      GLY  33  66.236  -7.603  17.023
  230    H    GLY  34           HN       GLY  34  68.131  -5.434  15.205
  231   1HA   GLY  34           HA2      GLY  34  67.872  -3.419  17.384
  232   2HA   GLY  34           HA1      GLY  34  69.257  -3.575  16.302
  233    H    GLY  35           HN       GLY  35  66.293  -3.890  14.671
  234   1HA   GLY  35           HA2      GLY  35  65.101  -2.441  13.257
  235   2HA   GLY  35           HA1      GLY  35  65.682  -1.103  14.250
  236    H    ASP  36           HN       ASP  36  67.698  -3.458  12.538
  237    HA   ASP  36           HA       ASP  36  68.318  -1.603  10.371
  238   1HB   ASP  36           HB2      ASP  36  70.832  -1.660  11.097
  239   2HB   ASP  36           HB1      ASP  36  69.753  -0.488  11.856
  240    H    ILE  37           HN       ILE  37  69.236  -2.716   8.650
  241    HA   ILE  37           HA       ILE  37  69.722  -5.621   9.117
  242    HB   ILE  37           HB       ILE  37  68.099  -5.519   7.462
  243   1HG1  ILE  37          HG12      ILE  37  70.709  -5.305   5.931
  244   2HG1  ILE  37          HG11      ILE  37  69.958  -6.789   6.522
  245   1HG2  ILE  37          HG23      ILE  37  69.479  -2.978   6.607
  246   2HG2  ILE  37          HG22      ILE  37  68.282  -3.766   5.578
  247   3HG2  ILE  37          HG21      ILE  37  67.823  -3.188   7.180
  248   1HD1  ILE  37          HD13      ILE  37  68.588  -4.909   4.588
  249   2HD1  ILE  37          HD12      ILE  37  69.562  -6.282   4.065
  250   3HD1  ILE  37          HD11      ILE  37  68.105  -6.548   5.020
  251    H    SER  38           HN       SER  38  71.439  -6.556   7.627
  252    HA   SER  38           HA       SER  38  73.870  -4.891   7.882
  253   1HB   SER  38           HB2      SER  38  73.856  -7.672   6.749
  254   2HB   SER  38           HB1      SER  38  75.086  -6.876   7.727
  255    HG   SER  38           HG       SER  38  73.480  -8.534   8.669
  256    H    THR  39           HN       THR  39  74.949  -4.023   6.130
  257    HA   THR  39           HA       THR  39  73.616  -3.666   3.648
  258    HB   THR  39           HB       THR  39  76.188  -3.278   2.920
  259    HG1  THR  39           HG1      THR  39  77.315  -2.625   4.793
  260   1HG2  THR  39          HG23      THR  39  74.232  -1.636   3.232
  261   2HG2  THR  39          HG22      THR  39  74.858  -1.389   4.863
  262   3HG2  THR  39          HG21      THR  39  75.857  -0.993   3.464
  263    H    LYS  40           HN       LYS  40  75.518  -6.305   4.844
  264    HA   LYS  40           HA       LYS  40  76.163  -7.422   2.232
  265   1HB   LYS  40           HB2      LYS  40  76.985  -9.324   3.441
  266   2HB   LYS  40           HB1      LYS  40  77.405  -7.909   4.408
  267   1HG   LYS  40           HG2      LYS  40  75.425  -8.268   5.822
  268   2HG   LYS  40           HG1      LYS  40  74.966  -9.662   4.842
  269   1HD   LYS  40           HD2      LYS  40  76.164 -10.863   6.351
  270   2HD   LYS  40           HD1      LYS  40  77.572 -10.260   5.475
  271   1HE   LYS  40           HE2      LYS  40  77.324  -8.178   7.050
  272   2HE   LYS  40           HE1      LYS  40  76.398  -9.285   8.064
  273   1HZ   LYS  40           HZ1      LYS  40  78.638 -10.682   7.291
  274   2HZ   LYS  40           HZ3      LYS  40  79.208  -9.133   7.675
  275   3HZ   LYS  40           HZ2      LYS  40  78.329 -10.021   8.825
  276    H    ALA  41           HN       ALA  41  73.570  -7.780   4.601
  277    HA   ALA  41           HA       ALA  41  72.307 -10.043   3.330
  278   1HB   ALA  41           HB3      ALA  41  71.928  -9.094   5.718
  279   2HB   ALA  41           HB2      ALA  41  70.838  -7.950   4.934
  280   3HB   ALA  41           HB1      ALA  41  70.519  -9.682   4.836
  281    H    LEU  42           HN       LEU  42  72.487  -6.692   2.589
  282    HA   LEU  42           HA       LEU  42  70.024  -6.224   1.289
  283   1HB   LEU  42           HB2      LEU  42  72.719  -5.066   1.238
  284   2HB   LEU  42           HB1      LEU  42  71.858  -4.897  -0.294
  285    HG   LEU  42           HG       LEU  42  70.013  -3.797   0.764
  286   1HD1  LEU  42          HD12      LEU  42  71.308  -4.823   3.276
  287   2HD1  LEU  42          HD11      LEU  42  70.268  -3.399   3.344
  288   3HD1  LEU  42          HD13      LEU  42  69.621  -4.936   2.770
  289   1HD2  LEU  42          HD22      LEU  42  72.042  -2.422   0.375
  290   2HD2  LEU  42          HD21      LEU  42  71.102  -1.841   1.749
  291   3HD2  LEU  42          HD23      LEU  42  72.573  -2.776   2.019
  292    H    GLY  43           HN       GLY  43  72.997  -7.747   0.037
  293   1HA   GLY  43           HA2      GLY  43  72.317  -8.027  -2.657
  294   2HA   GLY  43           HA1      GLY  43  73.215  -9.257  -1.762
  295    H    THR  44           HN       THR  44  71.216  -9.960   0.110
  296    HA   THR  44           HA       THR  44  69.600 -11.739  -1.528
  297    HB   THR  44           HB       THR  44  69.694 -11.192   1.450
  298    HG1  THR  44           HG1      THR  44  70.667 -13.228   1.445
  299   1HG2  THR  44          HG23      THR  44  67.725 -12.646  -0.184
  300   2HG2  THR  44          HG22      THR  44  68.407 -13.600   1.133
  301   3HG2  THR  44          HG21      THR  44  67.602 -12.070   1.479
  302    H    VAL  45           HN       VAL  45  69.072  -8.694   0.190
  303    HA   VAL  45           HA       VAL  45  66.224  -8.723   0.192
  304    HB   VAL  45           HB       VAL  45  68.012  -6.302  -0.177
  305   1HG1  VAL  45          HG11      VAL  45  65.181  -6.654   0.024
  306   2HG1  VAL  45          HG13      VAL  45  65.741  -5.891   1.513
  307   3HG1  VAL  45          HG12      VAL  45  66.087  -5.142  -0.047
  308   1HG2  VAL  45          HG21      VAL  45  67.146  -7.783   2.325
  309   2HG2  VAL  45          HG23      VAL  45  68.796  -7.585   1.736
  310   3HG2  VAL  45          HG22      VAL  45  67.898  -6.187   2.330
  311    H    MET  46           HN       MET  46  68.539  -7.677  -2.300
  312    HA   MET  46           HA       MET  46  66.656  -6.595  -4.132
  313   1HB   MET  46           HB2      MET  46  69.274  -8.036  -4.665
  314   2HB   MET  46           HB1      MET  46  68.381  -7.104  -5.869
  315   1HG   MET  46           HG2      MET  46  69.227  -5.904  -3.228
  316   2HG   MET  46           HG1      MET  46  70.274  -5.874  -4.647
  317   1HE   MET  46           HE1      MET  46  69.836  -3.411  -3.417
  318   2HE   MET  46           HE3      MET  46  70.379  -3.238  -5.093
  319   3HE   MET  46           HE2      MET  46  69.054  -2.249  -4.485
  320    H    ARG  47           HN       ARG  47  68.251  -9.771  -4.560
  321    HA   ARG  47           HA       ARG  47  66.460 -10.822  -6.428
  322   1HB   ARG  47           HB2      ARG  47  68.641 -11.800  -5.112
  323   2HB   ARG  47           HB1      ARG  47  67.354 -12.755  -4.377
  324   1HG   ARG  47           HG2      ARG  47  66.685 -13.674  -6.442
  325   2HG   ARG  47           HG1      ARG  47  67.500 -12.413  -7.367
  326   1HD   ARG  47           HD2      ARG  47  69.213 -13.872  -7.583
  327   2HD   ARG  47           HD1      ARG  47  69.555 -13.547  -5.884
  328    HE   ARG  47           HE       ARG  47  67.652 -15.726  -6.602
  329   1HH1  ARG  47          HH11      ARG  47  69.064 -14.772  -3.905
  330   2HH1  ARG  47          HH12      ARG  47  70.084 -16.147  -3.646
  331   1HH2  ARG  47          HH21      ARG  47  69.622 -17.425  -6.837
  332   2HH2  ARG  47          HH22      ARG  47  70.400 -17.650  -5.306
  333    H    MET  48           HN       MET  48  65.948 -10.267  -3.041
  334    HA   MET  48           HA       MET  48  63.755 -12.127  -2.708
  335   1HB   MET  48           HB2      MET  48  65.145 -10.163  -1.105
  336   2HB   MET  48           HB1      MET  48  63.401  -9.976  -0.915
  337   1HG   MET  48           HG2      MET  48  64.658 -12.709  -0.804
  338   2HG   MET  48           HG1      MET  48  64.643 -11.675   0.623
  339   1HE   MET  48           HE2      MET  48  62.911 -10.454   1.383
  340   2HE   MET  48           HE1      MET  48  61.176 -10.714   1.220
  341   3HE   MET  48           HE3      MET  48  62.130 -11.737   2.303
  342    H    LEU  49           HN       LEU  49  63.499  -8.574  -2.491
  343    HA   LEU  49           HA       LEU  49  60.799  -8.306  -3.014
  344   1HB   LEU  49           HB2      LEU  49  62.752  -6.451  -4.372
  345   2HB   LEU  49           HB1      LEU  49  61.203  -6.063  -3.624
  346    HG   LEU  49           HG       LEU  49  63.809  -6.755  -2.261
  347   1HD1  LEU  49          HD13      LEU  49  62.256  -4.362  -2.772
  348   2HD1  LEU  49          HD12      LEU  49  62.467  -4.609  -1.038
  349   3HD1  LEU  49          HD11      LEU  49  63.877  -4.512  -2.093
  350   1HD2  LEU  49          HD21      LEU  49  61.044  -7.274  -1.392
  351   2HD2  LEU  49          HD23      LEU  49  62.560  -7.901  -0.745
  352   3HD2  LEU  49          HD22      LEU  49  61.977  -6.314  -0.244
  353    H    GLY  50           HN       GLY  50  63.378  -8.623  -5.458
  354   1HA   GLY  50           HA2      GLY  50  62.268 -10.223  -7.313
  355   2HA   GLY  50           HA1      GLY  50  61.352  -8.743  -7.605
  356    H    GLN  51           HN       GLN  51  62.747  -6.735  -7.946
  357    HA   GLN  51           HA       GLN  51  64.377  -6.922 -10.170
  358   1HB   GLN  51           HB2      GLN  51  65.490  -4.790  -9.324
  359   2HB   GLN  51           HB1      GLN  51  63.728  -4.746  -9.407
  360   1HG   GLN  51           HG2      GLN  51  64.770  -5.775  -6.854
  361   2HG   GLN  51           HG1      GLN  51  65.208  -4.097  -7.178
  362   1HE2  GLN  51          HE22      GLN  51  61.811  -2.930  -7.081
  363   2HE2  GLN  51          HE21      GLN  51  63.339  -2.602  -7.746
  364    H    ASN  52           HN       ASN  52  66.585  -7.263 -10.558
  365    HA   ASN  52           HA       ASN  52  68.283  -7.979  -8.216
  366   1HB   ASN  52           HB2      ASN  52  67.388 -10.094  -9.082
  367   2HB   ASN  52           HB1      ASN  52  67.923  -9.672 -10.709
  368   1HD2  ASN  52          HD22      ASN  52  70.649 -11.001  -7.965
  369   2HD2  ASN  52          HD21      ASN  52  69.071 -10.607  -7.477
  370    HA   PRO  53           HA       PRO  53  70.597  -5.251 -11.026
  371   1HB   PRO  53           HB2      PRO  53  71.905  -3.957  -8.981
  372   2HB   PRO  53           HB1      PRO  53  70.303  -3.484  -9.576
  373   1HG   PRO  53           HG2      PRO  53  71.025  -4.916  -7.059
  374   2HG   PRO  53           HG1      PRO  53  69.625  -3.884  -7.402
  375   1HD   PRO  53           HD2      PRO  53  69.614  -6.710  -7.338
  376   2HD   PRO  53           HD1      PRO  53  68.337  -5.679  -8.019
  377    H    THR  54           HN       THR  54  73.063  -4.933 -11.129
  378    HA   THR  54           HA       THR  54  74.366  -7.506 -10.766
  379    HB   THR  54           HB       THR  54  76.390  -6.237 -11.618
  380    HG1  THR  54           HG1      THR  54  74.551  -4.158 -12.089
  381   1HG2  THR  54          HG22      THR  54  74.631  -7.404 -13.052
  382   2HG2  THR  54          HG21      THR  54  73.926  -5.807 -13.315
  383   3HG2  THR  54          HG23      THR  54  75.571  -6.146 -13.857
  384    H    LYS  55           HN       LYS  55  76.033  -8.011  -9.300
  385    HA   LYS  55           HA       LYS  55  75.904  -6.958  -6.695
  386   1HB   LYS  55           HB2      LYS  55  77.215  -9.046  -7.835
  387   2HB   LYS  55           HB1      LYS  55  78.565  -7.944  -7.558
  388   1HG   LYS  55           HG2      LYS  55  78.172  -7.864  -5.225
  389   2HG   LYS  55           HG1      LYS  55  76.548  -8.534  -5.391
  390   1HD   LYS  55           HD2      LYS  55  77.621 -10.464  -4.762
  391   2HD   LYS  55           HD1      LYS  55  77.955 -10.551  -6.493
  392   1HE   LYS  55           HE2      LYS  55  80.169 -10.269  -6.164
  393   2HE   LYS  55           HE1      LYS  55  79.899  -8.875  -5.117
  394   1HZ   LYS  55           HZ2      LYS  55  79.543 -11.685  -4.236
  395   2HZ   LYS  55           HZ1      LYS  55  80.980 -10.805  -4.013
  396   3HZ   LYS  55           HZ3      LYS  55  79.547 -10.292  -3.264
  397    H    GLU  56           HN       GLU  56  77.694  -5.819  -9.482
  398    HA   GLU  56           HA       GLU  56  79.536  -4.116  -8.079
  399   1HB   GLU  56           HB2      GLU  56  78.392  -3.685 -10.853
  400   2HB   GLU  56           HB1      GLU  56  79.921  -3.067 -10.226
  401   1HG   GLU  56           HG2      GLU  56  80.706  -5.417  -9.926
  402   2HG   GLU  56           HG1      GLU  56  79.208  -5.982 -10.666
  403    H    GLU  57           HN       GLU  57  76.464  -3.339  -9.754
  404    HA   GLU  57           HA       GLU  57  76.344  -0.625  -8.928
  405   1HB   GLU  57           HB2      GLU  57  74.178  -2.623  -9.617
  406   2HB   GLU  57           HB1      GLU  57  73.829  -0.931  -9.264
  407   1HG   GLU  57           HG2      GLU  57  75.994  -1.481 -11.238
  408   2HG   GLU  57           HG1      GLU  57  74.336  -1.788 -11.758
  409    H    LEU  58           HN       LEU  58  75.912  -3.525  -7.123
  410    HA   LEU  58           HA       LEU  58  74.164  -2.463  -5.078
  411   1HB   LEU  58           HB2      LEU  58  74.390  -4.873  -5.350
  412   2HB   LEU  58           HB1      LEU  58  76.121  -4.778  -5.027
  413    HG   LEU  58           HG       LEU  58  74.542  -3.500  -2.930
  414   1HD1  LEU  58          HD11      LEU  58  73.610  -6.045  -3.971
  415   2HD1  LEU  58          HD13      LEU  58  74.166  -6.213  -2.306
  416   3HD1  LEU  58          HD12      LEU  58  72.911  -5.039  -2.703
  417   1HD2  LEU  58          HD21      LEU  58  76.977  -4.949  -3.297
  418   2HD2  LEU  58          HD23      LEU  58  76.432  -4.092  -1.856
  419   3HD2  LEU  58          HD22      LEU  58  76.028  -5.793  -2.073
  420    H    ASP  59           HN       ASP  59  77.709  -2.959  -5.211
  421    HA   ASP  59           HA       ASP  59  78.291  -1.859  -2.662
  422   1HB   ASP  59           HB2      ASP  59  79.766  -2.742  -4.931
  423   2HB   ASP  59           HB1      ASP  59  80.360  -1.135  -4.513
  424    H    ALA  60           HN       ALA  60  78.277  -0.232  -5.856
  425    HA   ALA  60           HA       ALA  60  78.892   2.368  -4.918
  426   1HB   ALA  60           HB2      ALA  60  78.819   1.753  -7.319
  427   2HB   ALA  60           HB1      ALA  60  77.064   1.609  -7.220
  428   3HB   ALA  60           HB3      ALA  60  77.834   3.178  -6.988
  429    H    ILE  61           HN       ILE  61  75.959   0.512  -4.714
  430    HA   ILE  61           HA       ILE  61  74.197   2.752  -4.167
  431    HB   ILE  61           HB       ILE  61  74.015  -0.241  -3.886
  432   1HG1  ILE  61          HG12      ILE  61  72.177   1.708  -5.284
  433   2HG1  ILE  61          HG11      ILE  61  73.635   1.076  -6.052
  434   1HG2  ILE  61          HG23      ILE  61  71.969   1.768  -2.895
  435   2HG2  ILE  61          HG22      ILE  61  71.712   0.028  -3.022
  436   3HG2  ILE  61          HG21      ILE  61  72.903   0.661  -1.885
  437   1HD1  ILE  61          HD12      ILE  61  71.744  -0.863  -4.779
  438   2HD1  ILE  61          HD11      ILE  61  71.309  -0.167  -6.341
  439   3HD1  ILE  61          HD13      ILE  61  72.806  -1.083  -6.169
  440    H    ILE  62           HN       ILE  62  75.607   0.215  -2.064
  441    HA   ILE  62           HA       ILE  62  74.759   1.272   0.409
  442    HB   ILE  62           HB       ILE  62  77.273  -0.249  -0.326
  443   1HG1  ILE  62          HG12      ILE  62  74.697  -1.105   1.031
  444   2HG1  ILE  62          HG11      ILE  62  75.083  -1.392  -0.666
  445   1HG2  ILE  62          HG22      ILE  62  76.160   0.546   2.374
  446   2HG2  ILE  62          HG21      ILE  62  77.315  -0.771   2.161
  447   3HG2  ILE  62          HG23      ILE  62  77.770   0.878   1.733
  448   1HD1  ILE  62          HD11      ILE  62  76.952  -2.295   1.521
  449   2HD1  ILE  62          HD13      ILE  62  75.585  -3.293   1.026
  450   3HD1  ILE  62          HD12      ILE  62  76.840  -2.876  -0.140
  451    H    GLU  63           HN       GLU  63  77.382   2.269  -1.697
  452    HA   GLU  63           HA       GLU  63  78.789   3.886   0.217
  453   1HB   GLU  63           HB2      GLU  63  79.034   3.233  -2.539
  454   2HB   GLU  63           HB1      GLU  63  79.000   4.992  -2.424
  455   1HG   GLU  63           HG2      GLU  63  80.657   4.502  -0.378
  456   2HG   GLU  63           HG1      GLU  63  80.996   3.060  -1.337
  457    H    GLU  64           HN       GLU  64  76.056   4.533  -1.944
  458    HA   GLU  64           HA       GLU  64  76.018   7.359  -1.035
  459   1HB   GLU  64           HB2      GLU  64  75.181   5.961  -3.419
  460   2HB   GLU  64           HB1      GLU  64  73.821   6.855  -2.737
  461   1HG   GLU  64           HG2      GLU  64  76.536   8.133  -3.046
  462   2HG   GLU  64           HG1      GLU  64  75.373   8.122  -4.372
  463    H    VAL  65           HN       VAL  65  74.722   4.409  -0.076
  464    HA   VAL  65           HA       VAL  65  72.148   5.552   0.827
  465    HB   VAL  65           HB       VAL  65  73.303   2.786   1.294
  466   1HG1  VAL  65          HG12      VAL  65  71.216   4.028   2.583
  467   2HG1  VAL  65          HG11      VAL  65  70.389   3.227   1.245
  468   3HG1  VAL  65          HG13      VAL  65  71.366   2.282   2.372
  469   1HG2  VAL  65          HG21      VAL  65  72.662   3.806  -1.138
  470   2HG2  VAL  65          HG23      VAL  65  72.415   2.113  -0.710
  471   3HG2  VAL  65          HG22      VAL  65  71.072   3.253  -0.612
  472    H    ASP  66           HN       ASP  66  75.333   4.907   2.043
  473    HA   ASP  66           HA       ASP  66  74.438   5.150   4.857
  474   1HB   ASP  66           HB2      ASP  66  76.530   3.781   3.641
  475   2HB   ASP  66           HB1      ASP  66  77.327   5.169   4.383
  476    H    GLU  67           HN       GLU  67  73.658   7.415   4.334
  477    HA   GLU  67           HA       GLU  67  75.527   9.500   3.677
  478   1HB   GLU  67           HB2      GLU  67  73.732  10.999   4.691
  479   2HB   GLU  67           HB1      GLU  67  73.194   9.957   3.373
  480   1HG   GLU  67           HG2      GLU  67  72.986   8.553   5.892
  481   2HG   GLU  67           HG1      GLU  67  72.120  10.088   5.979
  482    H    ASP  68           HN       ASP  68  74.928   7.735   6.570
  483    HA   ASP  68           HA       ASP  68  76.301   9.820   8.201
  484   1HB   ASP  68           HB2      ASP  68  75.645   8.064  10.070
  485   2HB   ASP  68           HB1      ASP  68  74.438   9.181   9.435
  486    H    GLY  69           HN       GLY  69  76.548   6.456   7.128
  487   1HA   GLY  69           HA2      GLY  69  78.632   5.322   6.764
  488   2HA   GLY  69           HA1      GLY  69  79.440   6.544   7.746
  489    H    SER  70           HN       SER  70  76.508   4.938   8.817
  490    HA   SER  70           HA       SER  70  77.838   4.059  11.253
  491   1HB   SER  70           HB2      SER  70  75.631   3.109  11.827
  492   2HB   SER  70           HB1      SER  70  75.476   4.770  11.266
  493    HG   SER  70           HG       SER  70  73.960   3.381  10.266
  494    H    GLY  71           HN       GLY  71  77.904   2.832   8.188
  495   1HA   GLY  71           HA2      GLY  71  78.644   0.758   7.369
  496   2HA   GLY  71           HA1      GLY  71  78.987   0.299   9.038
  497    H    THR  72           HN       THR  72  75.796   1.402   8.510
  498    HA   THR  72           HA       THR  72  74.761  -1.332   8.009
  499    HB   THR  72           HB       THR  72  73.107  -0.396  10.045
  500    HG1  THR  72           HG1      THR  72  74.353   0.473  11.544
  501   1HG2  THR  72          HG21      THR  72  75.350  -2.399   9.894
  502   2HG2  THR  72          HG23      THR  72  74.464  -2.158  11.399
  503   3HG2  THR  72          HG22      THR  72  73.610  -2.687   9.949
  504    H    ILE  73           HN       ILE  73  72.317  -1.230   7.691
  505    HA   ILE  73           HA       ILE  73  71.578   1.414   6.498
  506    HB   ILE  73           HB       ILE  73  70.688  -1.357   5.641
  507   1HG1  ILE  73          HG12      ILE  73  73.098  -0.711   5.147
  508   2HG1  ILE  73          HG11      ILE  73  72.115  -1.065   3.726
  509   1HG2  ILE  73          HG21      ILE  73  69.555   1.230   5.223
  510   2HG2  ILE  73          HG23      ILE  73  70.245   0.690   3.692
  511   3HG2  ILE  73          HG22      ILE  73  69.047  -0.308   4.521
  512   1HD1  ILE  73          HD13      ILE  73  71.768   1.697   4.311
  513   2HD1  ILE  73          HD12      ILE  73  73.499   1.366   4.377
  514   3HD1  ILE  73          HD11      ILE  73  72.582   0.982   2.920
  515    H    ASP  74           HN       ASP  74  69.582   2.255   7.063
  516    HA   ASP  74           HA       ASP  74  67.993   0.654   9.028
  517   1HB   ASP  74           HB2      ASP  74  69.117   3.215   9.292
  518   2HB   ASP  74           HB1      ASP  74  67.396   3.497   9.025
  519    H    PHE  75           HN       PHE  75  65.594   1.209   8.966
  520    HA   PHE  75           HA       PHE  75  64.487   0.726   6.430
  521   1HB   PHE  75           HB2      PHE  75  63.372   0.595   8.755
  522   2HB   PHE  75           HB1      PHE  75  63.028   2.311   8.542
  523    HD1  PHE  75           HD2      PHE  75  63.061  -0.576   6.162
  524    HD2  PHE  75           HD1      PHE  75  60.779   2.582   7.963
  525    HE1  PHE  75           HE2      PHE  75  61.130  -1.144   4.709
  526    HE2  PHE  75           HE1      PHE  75  58.848   2.018   6.512
  527    HZ   PHE  75           HZ       PHE  75  59.023   0.153   4.885
  528    H    GLU  76           HN       GLU  76  65.404   3.779   7.912
  529    HA   GLU  76           HA       GLU  76  63.967   5.439   6.018
  530   1HB   GLU  76           HB2      GLU  76  65.287   7.278   6.963
  531   2HB   GLU  76           HB1      GLU  76  64.664   6.253   8.254
  532   1HG   GLU  76           HG2      GLU  76  67.025   5.007   7.753
  533   2HG   GLU  76           HG1      GLU  76  67.458   6.670   7.359
  534    H    GLU  77           HN       GLU  77  67.186   4.004   6.114
  535    HA   GLU  77           HA       GLU  77  68.057   5.538   3.757
  536   1HB   GLU  77           HB2      GLU  77  69.488   3.183   4.993
  537   2HB   GLU  77           HB1      GLU  77  70.178   4.519   4.071
  538   1HG   GLU  77           HG2      GLU  77  69.808   6.069   5.844
  539   2HG   GLU  77           HG1      GLU  77  68.746   4.948   6.698
  540    H    PHE  78           HN       PHE  78  66.500   2.518   4.415
  541    HA   PHE  78           HA       PHE  78  67.362   1.105   2.062
  542   1HB   PHE  78           HB2      PHE  78  66.409  -0.383   3.537
  543   2HB   PHE  78           HB1      PHE  78  65.243   0.794   4.134
  544    HD1  PHE  78           HD2      PHE  78  63.288   1.427   2.649
  545    HD2  PHE  78           HD1      PHE  78  65.803  -1.963   1.875
  546    HE1  PHE  78           HE2      PHE  78  61.534   0.463   1.176
  547    HE2  PHE  78           HE1      PHE  78  64.055  -2.930   0.401
  548    HZ   PHE  78           HZ       PHE  78  61.919  -1.715   0.052
  549    H    LEU  79           HN       LEU  79  64.557   3.181   2.786
  550    HA   LEU  79           HA       LEU  79  63.170   2.914   0.350
  551   1HB   LEU  79           HB2      LEU  79  63.539   5.442   1.991
  552   2HB   LEU  79           HB1      LEU  79  62.260   5.157   0.810
  553    HG   LEU  79           HG       LEU  79  62.698   3.322   3.169
  554   1HD1  LEU  79          HD13      LEU  79  61.292   5.957   2.996
  555   2HD1  LEU  79          HD12      LEU  79  60.543   4.676   3.949
  556   3HD1  LEU  79          HD11      LEU  79  62.164   5.242   4.350
  557   1HD2  LEU  79          HD21      LEU  79  60.478   3.823   1.177
  558   2HD2  LEU  79          HD23      LEU  79  61.351   2.320   1.474
  559   3HD2  LEU  79          HD22      LEU  79  60.211   2.929   2.674
  560    H    VAL  80           HN       VAL  80  66.087   4.726   1.109
  561    HA   VAL  80           HA       VAL  80  66.162   6.243  -1.350
  562    HB   VAL  80           HB       VAL  80  68.526   5.397   0.347
  563   1HG1  VAL  80          HG12      VAL  80  67.995   7.417  -1.781
  564   2HG1  VAL  80          HG11      VAL  80  69.055   7.901  -0.457
  565   3HG1  VAL  80          HG13      VAL  80  69.461   6.496  -1.445
  566   1HG2  VAL  80          HG22      VAL  80  66.235   6.929   1.114
  567   2HG2  VAL  80          HG21      VAL  80  67.708   6.631   2.040
  568   3HG2  VAL  80          HG23      VAL  80  67.604   8.031   0.971
  569    H    MET  81           HN       MET  81  67.393   3.093  -0.332
  570    HA   MET  81           HA       MET  81  69.088   2.522  -2.514
  571   1HB   MET  81           HB2      MET  81  68.262   1.156  -0.292
  572   2HB   MET  81           HB1      MET  81  67.448   0.257  -1.574
  573   1HG   MET  81           HG2      MET  81  69.427  -0.431  -2.541
  574   2HG   MET  81           HG1      MET  81  70.305   0.998  -1.999
  575   1HE   MET  81           HE3      MET  81  69.990   1.603   0.413
  576   2HE   MET  81           HE2      MET  81  70.248   0.525   1.783
  577   3HE   MET  81           HE1      MET  81  71.607   0.968   0.753
  578    H    MET  82           HN       MET  82  65.613   1.711  -2.163
  579    HA   MET  82           HA       MET  82  65.246   0.533  -4.696
  580   1HB   MET  82           HB2      MET  82  63.513   1.832  -2.679
  581   2HB   MET  82           HB1      MET  82  62.858   1.782  -4.316
  582   1HG   MET  82           HG2      MET  82  62.198  -0.234  -3.108
  583   2HG   MET  82           HG1      MET  82  63.321  -0.656  -4.399
  584   1HE   MET  82           HE3      MET  82  65.066  -1.573  -4.415
  585   2HE   MET  82           HE2      MET  82  66.427  -1.174  -3.371
  586   3HE   MET  82           HE1      MET  82  65.587  -2.709  -3.164
  587    H    VAL  83           HN       VAL  83  64.041   3.807  -3.972
  588    HA   VAL  83           HA       VAL  83  63.806   4.647  -6.641
  589    HB   VAL  83           HB       VAL  83  64.592   6.457  -4.346
  590   1HG1  VAL  83          HG12      VAL  83  64.111   6.977  -7.032
  591   2HG1  VAL  83          HG11      VAL  83  62.560   7.323  -6.267
  592   3HG1  VAL  83          HG13      VAL  83  64.016   8.157  -5.725
  593   1HG2  VAL  83          HG23      VAL  83  62.011   5.057  -5.005
  594   2HG2  VAL  83          HG22      VAL  83  62.777   5.285  -3.433
  595   3HG2  VAL  83          HG21      VAL  83  61.979   6.641  -4.231
  596    H    ARG  84           HN       ARG  84  66.690   4.166  -4.803
  597    HA   ARG  84           HA       ARG  84  68.440   6.034  -6.026
  598   1HB   ARG  84           HB2      ARG  84  68.690   3.749  -4.342
  599   2HB   ARG  84           HB1      ARG  84  69.809   3.538  -5.688
  600   1HG   ARG  84           HG2      ARG  84  70.307   6.116  -5.174
  601   2HG   ARG  84           HG1      ARG  84  69.772   5.632  -3.564
  602   1HD   ARG  84           HD2      ARG  84  71.709   4.552  -3.177
  603   2HD   ARG  84           HD1      ARG  84  71.558   3.644  -4.682
  604    HE   ARG  84           HE       ARG  84  73.115   6.103  -4.300
  605   1HH1  ARG  84          HH21      ARG  84  72.857   3.337  -6.088
  606   2HH1  ARG  84          HH22      ARG  84  73.210   4.055  -7.624
  607   1HH2  ARG  84          HH11      ARG  84  73.005   7.310  -6.446
  608   2HH2  ARG  84          HH12      ARG  84  73.294   6.306  -7.827
  609    H    GLN  85           HN       GLN  85  67.658   2.687  -7.036
  610    HA   GLN  85           HA       GLN  85  69.084   3.124  -9.584
  611   1HB   GLN  85           HB2      GLN  85  67.461   0.711  -8.732
  612   2HB   GLN  85           HB1      GLN  85  68.670   0.787 -10.013
  613   1HG   GLN  85           HG2      GLN  85  69.849   1.735  -7.573
  614   2HG   GLN  85           HG1      GLN  85  69.084   0.175  -7.268
  615   1HE2  GLN  85          HE22      GLN  85  71.253  -1.609  -9.515
  616   2HE2  GLN  85          HE21      GLN  85  69.699  -1.631  -8.830
  617    H    MET  86           HN       MET  86  65.850   3.232  -8.325
  618    HA   MET  86           HA       MET  86  64.545   2.927 -10.920
  619   1HB   MET  86           HB2      MET  86  63.385   4.122  -8.389
  620   2HB   MET  86           HB1      MET  86  62.501   3.416  -9.742
  621   1HG   MET  86           HG2      MET  86  64.482   1.567  -8.663
  622   2HG   MET  86           HG1      MET  86  63.320   2.073  -7.437
  623   1HE   MET  86           HE1      MET  86  61.076   2.811  -8.427
  624   2HE   MET  86           HE3      MET  86  60.059   1.813  -9.472
  625   3HE   MET  86           HE2      MET  86  60.368   1.320  -7.808
  626    H    LYS  87           HN       LYS  87  66.359   5.382  -9.566
  627    HA   LYS  87           HA       LYS  87  65.166   7.339 -11.456
  628   1HB   LYS  87           HB2      LYS  87  65.464   7.677  -8.483
  629   2HB   LYS  87           HB1      LYS  87  65.618   9.082  -9.541
  630   1HG   LYS  87           HG2      LYS  87  63.357   7.699 -10.477
  631   2HG   LYS  87           HG1      LYS  87  63.222   7.674  -8.718
  632   1HD   LYS  87           HD2      LYS  87  63.734  10.168  -8.765
  633   2HD   LYS  87           HD1      LYS  87  63.518  10.092 -10.513
  634   1HE   LYS  87           HE2      LYS  87  61.236   9.407 -10.297
  635   2HE   LYS  87           HE1      LYS  87  61.424   9.093  -8.572
  636   1HZ   LYS  87           HZ3      LYS  87  62.038  11.560  -8.447
  637   2HZ   LYS  87           HZ2      LYS  87  61.312  11.684  -9.979
  638   3HZ   LYS  87           HZ1      LYS  87  60.403  11.155  -8.644
  639    H    GLU  88           HN       GLU  88  67.175   6.678 -12.609
  640    HA   GLU  88           HA       GLU  88  69.407   8.443 -11.833
  641   1HB   GLU  88           HB2      GLU  88  69.552   5.869 -10.958
  642   2HB   GLU  88           HB1      GLU  88  70.288   5.706 -12.552
  643   1HG   GLU  88           HG2      GLU  88  71.763   7.678 -11.972
  644   2HG   GLU  88           HG1      GLU  88  71.138   7.575 -10.326
  645    H    ASP  89           HN       ASP  89  70.922   8.749 -13.629
  646    HA   ASP  89           HA       ASP  89  69.564   8.551 -16.220
  647   1HB   ASP  89           HB2      ASP  89  71.977   9.919 -15.140
  648   2HB   ASP  89           HB1      ASP  89  71.991   9.532 -16.861
  649    H    ALA  90           HN       ALA  90  69.565   6.440 -16.967
  650    HA   ALA  90           HA       ALA  90  71.880   5.363 -18.184
  651   1HB   ALA  90           HB2      ALA  90  71.856   4.950 -15.371
  652   2HB   ALA  90           HB1      ALA  90  71.504   3.395 -16.127
  653   3HB   ALA  90           HB3      ALA  90  72.975   4.269 -16.552
   
  No H/Q in entry =         653
  Start of MODEL   36
    1   1H    ALA   1           HT1      ALA   1  60.867  12.320  12.727
    2   2H    ALA   1           HT3      ALA   1  60.601  11.012  11.679
    3   3H    ALA   1           HT2      ALA   1  60.280  10.847  13.338
    4    HA   ALA   1           HA       ALA   1  62.557  10.930  13.903
    5   1HB   ALA   1           HB2      ALA   1  61.519   9.037  11.959
    6   2HB   ALA   1           HB1      ALA   1  63.265   9.223  11.791
    7   3HB   ALA   1           HB3      ALA   1  62.573   8.745  13.343
    8    H    SER   2           HN       SER   2  64.734  10.341  12.236
    9    HA   SER   2           HA       SER   2  65.237  13.021  11.099
   10   1HB   SER   2           HB2      SER   2  66.841  10.888  12.247
   11   2HB   SER   2           HB1      SER   2  67.502  11.412  10.701
   12    HG   SER   2           HG       SER   2  68.076  12.597  12.756
   13    H    MET   3           HN       MET   3  66.519  13.018   8.949
   14    HA   MET   3           HA       MET   3  66.332  10.876   7.093
   15   1HB   MET   3           HB2      MET   3  64.438  12.060   5.692
   16   2HB   MET   3           HB1      MET   3  64.004  10.943   6.986
   17   1HG   MET   3           HG2      MET   3  63.609  12.759   8.522
   18   2HG   MET   3           HG1      MET   3  64.276  13.934   7.387
   19   1HE   MET   3           HE2      MET   3  63.269  15.033   5.707
   20   2HE   MET   3           HE1      MET   3  61.531  15.174   5.461
   21   3HE   MET   3           HE3      MET   3  62.243  15.592   7.026
   22    H    THR   4           HN       THR   4  67.635  11.413   5.385
   23    HA   THR   4           HA       THR   4  68.696  14.147   5.267
   24    HB   THR   4           HB       THR   4  69.900  12.957   3.193
   25    HG1  THR   4           HG1      THR   4  69.670  10.871   3.185
   26   1HG2  THR   4          HG21      THR   4  70.394  12.695   6.147
   27   2HG2  THR   4          HG23      THR   4  71.492  11.942   4.990
   28   3HG2  THR   4          HG22      THR   4  71.247  13.688   4.966
   29    H    ASP   5           HN       ASP   5  68.977  15.045   2.903
   30    HA   ASP   5           HA       ASP   5  66.405  15.694   1.887
   31   1HB   ASP   5           HB2      ASP   5  69.005  15.730   0.330
   32   2HB   ASP   5           HB1      ASP   5  67.566  16.699   0.014
   33    H    GLN   6           HN       GLN   6  68.805  13.324   0.703
   34    HA   GLN   6           HA       GLN   6  67.361  12.413  -1.551
   35   1HB   GLN   6           HB2      GLN   6  68.602  10.247  -1.190
   36   2HB   GLN   6           HB1      GLN   6  69.639  11.673  -1.193
   37   1HG   GLN   6           HG2      GLN   6  69.832  11.664   1.181
   38   2HG   GLN   6           HG1      GLN   6  68.502  10.519   1.360
   39   1HE2  GLN   6          HE22      GLN   6  71.154   8.142   1.680
   40   2HE2  GLN   6          HE21      GLN   6  70.034   9.075   2.549
   41    H    GLN   7           HN       GLN   7  66.980  11.691   1.871
   42    HA   GLN   7           HA       GLN   7  65.079   9.522   1.421
   43   1HB   GLN   7           HB2      GLN   7  66.129  11.015   3.798
   44   2HB   GLN   7           HB1      GLN   7  64.623  10.112   3.971
   45   1HG   GLN   7           HG2      GLN   7  65.802   8.102   3.019
   46   2HG   GLN   7           HG1      GLN   7  67.305   9.022   3.077
   47   1HE2  GLN   7          HE22      GLN   7  67.651   8.751   6.606
   48   2HE2  GLN   7          HE21      GLN   7  68.197   9.543   5.206
   49    H    ALA   8           HN       ALA   8  64.931  13.000   1.807
   50    HA   ALA   8           HA       ALA   8  62.139  13.179   2.482
   51   1HB   ALA   8           HB3      ALA   8  63.797  15.051   2.716
   52   2HB   ALA   8           HB2      ALA   8  63.807  15.200   0.960
   53   3HB   ALA   8           HB1      ALA   8  62.327  15.518   1.864
   54    H    GLU   9           HN       GLU   9  63.887  13.170  -0.617
   55    HA   GLU   9           HA       GLU   9  61.401  13.447  -2.144
   56   1HB   GLU   9           HB2      GLU   9  63.580  14.353  -2.967
   57   2HB   GLU   9           HB1      GLU   9  64.179  12.700  -3.106
   58   1HG   GLU   9           HG2      GLU   9  63.403  13.127  -5.276
   59   2HG   GLU   9           HG1      GLU   9  62.022  12.313  -4.540
   60    H    ALA  10           HN       ALA  10  63.343  10.869  -0.866
   61    HA   ALA  10           HA       ALA  10  62.480   8.790  -2.664
   62   1HB   ALA  10           HB2      ALA  10  63.752   8.897   0.043
   63   2HB   ALA  10           HB1      ALA  10  63.029   7.374  -0.476
   64   3HB   ALA  10           HB3      ALA  10  64.318   8.108  -1.430
   65    H    ARG  11           HN       ARG  11  61.440   9.504   0.695
   66    HA   ARG  11           HA       ARG  11  59.173   7.745   0.576
   67   1HB   ARG  11           HB2      ARG  11  60.349   9.583   2.476
   68   2HB   ARG  11           HB1      ARG  11  58.597   9.789   2.435
   69   1HG   ARG  11           HG2      ARG  11  58.196   7.701   3.276
   70   2HG   ARG  11           HG1      ARG  11  59.562   6.985   2.421
   71   1HD   ARG  11           HD2      ARG  11  61.007   7.370   4.140
   72   2HD   ARG  11           HD1      ARG  11  60.287   8.933   4.526
   73    HE   ARG  11           HE       ARG  11  58.477   6.821   5.246
   74   1HH1  ARG  11          HH11      ARG  11  58.794   8.993   7.111
   75   2HH1  ARG  11          HH12      ARG  11  59.803   8.342   8.360
   76   1HH2  ARG  11          HH21      ARG  11  60.926   5.687   6.433
   77   2HH2  ARG  11          HH22      ARG  11  61.010   6.470   7.975
   78    H    ALA  12           HN       ALA  12  59.658  11.106  -0.332
   79    HA   ALA  12           HA       ALA  12  56.870  11.806  -0.531
   80   1HB   ALA  12           HB2      ALA  12  59.308  12.937  -1.938
   81   2HB   ALA  12           HB1      ALA  12  57.703  13.669  -1.977
   82   3HB   ALA  12           HB3      ALA  12  58.580  13.545  -0.451
   83    H    PHE  13           HN       PHE  13  59.157  10.241  -2.706
   84    HA   PHE  13           HA       PHE  13  57.244  10.316  -4.947
   85   1HB   PHE  13           HB2      PHE  13  59.541  10.514  -5.591
   86   2HB   PHE  13           HB1      PHE  13  60.008   9.133  -4.600
   87    HD1  PHE  13           HD2      PHE  13  59.314   6.827  -5.251
   88    HD2  PHE  13           HD1      PHE  13  58.592  10.221  -7.784
   89    HE1  PHE  13           HE2      PHE  13  58.902   5.309  -7.167
   90    HE2  PHE  13           HE1      PHE  13  58.181   8.703  -9.701
   91    HZ   PHE  13           HZ       PHE  13  58.335   6.246  -9.393
   92    H    LEU  14           HN       LEU  14  58.033   8.266  -2.297
   93    HA   LEU  14           HA       LEU  14  56.834   5.886  -3.591
   94   1HB   LEU  14           HB2      LEU  14  58.034   6.280  -0.832
   95   2HB   LEU  14           HB1      LEU  14  57.441   4.743  -1.464
   96    HG   LEU  14           HG       LEU  14  59.622   6.400  -2.762
   97   1HD1  LEU  14          HD12      LEU  14  59.863   5.007  -0.420
   98   2HD1  LEU  14          HD11      LEU  14  60.249   3.757  -1.602
   99   3HD1  LEU  14          HD13      LEU  14  61.182   5.254  -1.564
  100   1HD2  LEU  14          HD23      LEU  14  58.018   4.121  -3.591
  101   2HD2  LEU  14          HD22      LEU  14  59.177   5.065  -4.528
  102   3HD2  LEU  14          HD21      LEU  14  59.731   3.705  -3.552
  103    H    SER  15           HN       SER  15  54.724   5.335  -3.273
  104    HA   SER  15           HA       SER  15  52.971   7.082  -1.770
  105   1HB   SER  15           HB2      SER  15  52.354   4.302  -2.803
  106   2HB   SER  15           HB1      SER  15  51.201   5.584  -2.446
  107    HG   SER  15           HG       SER  15  51.730   6.580  -4.256
  108    H    GLU  16           HN       GLU  16  52.167   6.802   0.305
  109    HA   GLU  16           HA       GLU  16  53.560   5.400   2.260
  110   1HB   GLU  16           HB2      GLU  16  51.570   5.599   3.672
  111   2HB   GLU  16           HB1      GLU  16  51.775   7.072   2.724
  112   1HG   GLU  16           HG2      GLU  16  49.547   6.694   2.287
  113   2HG   GLU  16           HG1      GLU  16  50.240   5.702   1.003
  114    H    GLU  17           HN       GLU  17  51.155   4.167   0.028
  115    HA   GLU  17           HA       GLU  17  50.661   1.683   1.409
  116   1HB   GLU  17           HB2      GLU  17  49.345   2.829  -0.548
  117   2HB   GLU  17           HB1      GLU  17  50.473   1.949  -1.578
  118   1HG   GLU  17           HG2      GLU  17  49.823  -0.096  -0.057
  119   2HG   GLU  17           HG1      GLU  17  48.393   0.872   0.300
  120    H    MET  18           HN       MET  18  52.887   2.589  -1.234
  121    HA   MET  18           HA       MET  18  53.975  -0.056  -1.553
  122   1HB   MET  18           HB2      MET  18  54.308   2.475  -2.777
  123   2HB   MET  18           HB1      MET  18  55.903   1.982  -2.212
  124   1HG   MET  18           HG2      MET  18  55.708  -0.151  -3.370
  125   2HG   MET  18           HG1      MET  18  54.052   0.227  -3.849
  126   1HE   MET  18           HE3      MET  18  56.264  -0.809  -5.290
  127   2HE   MET  18           HE2      MET  18  56.169  -0.038  -6.871
  128   3HE   MET  18           HE1      MET  18  57.564   0.259  -5.836
  129    H    ILE  19           HN       ILE  19  55.107   2.799   0.268
  130    HA   ILE  19           HA       ILE  19  57.526   1.767   1.242
  131    HB   ILE  19           HB       ILE  19  55.498   3.600   2.536
  132   1HG1  ILE  19          HG12      ILE  19  58.170   4.583   1.816
  133   2HG1  ILE  19          HG11      ILE  19  57.261   3.972   0.434
  134   1HG2  ILE  19          HG22      ILE  19  58.045   2.450   3.577
  135   2HG2  ILE  19          HG21      ILE  19  57.757   4.164   3.870
  136   3HG2  ILE  19          HG23      ILE  19  56.603   2.965   4.454
  137   1HD1  ILE  19          HD12      ILE  19  55.562   5.552   2.177
  138   2HD1  ILE  19          HD11      ILE  19  56.964   6.482   1.645
  139   3HD1  ILE  19          HD13      ILE  19  55.885   5.754   0.455
  140    H    ALA  20           HN       ALA  20  54.343   1.595   2.886
  141    HA   ALA  20           HA       ALA  20  55.195  -0.117   4.990
  142   1HB   ALA  20           HB2      ALA  20  52.920   1.172   4.566
  143   2HB   ALA  20           HB1      ALA  20  52.427  -0.369   3.864
  144   3HB   ALA  20           HB3      ALA  20  52.945  -0.293   5.548
  145    H    GLU  21           HN       GLU  21  54.502  -0.788   1.650
  146    HA   GLU  21           HA       GLU  21  53.992  -3.619   1.967
  147   1HB   GLU  21           HB2      GLU  21  54.901  -1.974  -0.411
  148   2HB   GLU  21           HB1      GLU  21  54.515  -3.693  -0.502
  149   1HG   GLU  21           HG2      GLU  21  52.427  -2.198   0.872
  150   2HG   GLU  21           HG1      GLU  21  52.701  -1.583  -0.758
  151    H    PHE  22           HN       PHE  22  56.901  -1.721   1.132
  152    HA   PHE  22           HA       PHE  22  58.609  -4.041   0.903
  153   1HB   PHE  22           HB2      PHE  22  59.339  -1.152   1.483
  154   2HB   PHE  22           HB1      PHE  22  60.457  -2.412   0.962
  155    HD1  PHE  22           HD1      PHE  22  58.490  -3.813  -0.949
  156    HD2  PHE  22           HD2      PHE  22  59.599   0.305  -0.427
  157    HE1  PHE  22           HE1      PHE  22  57.906  -3.356  -3.315
  158    HE2  PHE  22           HE2      PHE  22  59.015   0.761  -2.793
  159    HZ   PHE  22           HZ       PHE  22  58.169  -1.069  -4.238
  160    H    LYS  23           HN       LYS  23  57.433  -2.162   3.576
  161    HA   LYS  23           HA       LYS  23  59.377  -2.494   5.542
  162   1HB   LYS  23           HB2      LYS  23  56.728  -1.724   5.524
  163   2HB   LYS  23           HB1      LYS  23  56.687  -3.196   6.496
  164   1HG   LYS  23           HG2      LYS  23  58.873  -1.236   7.045
  165   2HG   LYS  23           HG1      LYS  23  57.247  -0.822   7.587
  166   1HD   LYS  23           HD2      LYS  23  57.138  -2.600   9.074
  167   2HD   LYS  23           HD1      LYS  23  58.287  -3.573   8.154
  168   1HE   LYS  23           HE2      LYS  23  60.105  -2.012   8.830
  169   2HE   LYS  23           HE1      LYS  23  58.944  -1.119   9.812
  170   1HZ   LYS  23           HZ3      LYS  23  58.872  -3.928  10.329
  171   2HZ   LYS  23           HZ2      LYS  23  60.415  -3.272  10.614
  172   3HZ   LYS  23           HZ1      LYS  23  59.056  -2.636  11.412
  173    H    ALA  24           HN       ALA  24  57.477  -4.961   3.986
  174    HA   ALA  24           HA       ALA  24  57.836  -6.992   6.019
  175   1HB   ALA  24           HB3      ALA  24  56.344  -6.771   3.693
  176   2HB   ALA  24           HB2      ALA  24  57.561  -7.976   3.274
  177   3HB   ALA  24           HB1      ALA  24  56.511  -8.232   4.667
  178    H    ALA  25           HN       ALA  25  59.530  -6.241   2.965
  179    HA   ALA  25           HA       ALA  25  61.380  -8.388   3.031
  180   1HB   ALA  25           HB3      ALA  25  61.631  -5.571   1.948
  181   2HB   ALA  25           HB2      ALA  25  62.864  -6.809   1.701
  182   3HB   ALA  25           HB1      ALA  25  61.241  -7.039   1.050
  183    H    PHE  26           HN       PHE  26  61.905  -5.034   4.180
  184    HA   PHE  26           HA       PHE  26  64.412  -5.545   5.421
  185   1HB   PHE  26           HB2      PHE  26  63.852  -3.276   5.070
  186   2HB   PHE  26           HB1      PHE  26  62.270  -3.457   5.828
  187    HD1  PHE  26           HD1      PHE  26  65.919  -3.284   6.468
  188    HD2  PHE  26           HD2      PHE  26  61.993  -3.313   8.202
  189    HE1  PHE  26           HE1      PHE  26  66.879  -2.595   8.649
  190    HE2  PHE  26           HE2      PHE  26  62.950  -2.624  10.385
  191    HZ   PHE  26           HZ       PHE  26  65.394  -2.264  10.608
  192    H    ASP  27           HN       ASP  27  61.102  -5.926   6.599
  193    HA   ASP  27           HA       ASP  27  61.596  -6.230   9.359
  194   1HB   ASP  27           HB2      ASP  27  59.334  -6.140   8.371
  195   2HB   ASP  27           HB1      ASP  27  59.586  -7.735   7.660
  196    H    MET  28           HN       MET  28  62.592  -8.257   6.777
  197    HA   MET  28           HA       MET  28  62.715 -10.728   8.307
  198   1HB   MET  28           HB2      MET  28  62.964 -10.009   5.605
  199   2HB   MET  28           HB1      MET  28  64.548 -10.632   6.065
  200   1HG   MET  28           HG2      MET  28  63.248 -12.578   7.165
  201   2HG   MET  28           HG1      MET  28  61.876 -12.024   6.207
  202   1HE   MET  28           HE2      MET  28  65.482 -12.309   6.209
  203   2HE   MET  28           HE1      MET  28  65.912 -13.572   5.059
  204   3HE   MET  28           HE3      MET  28  65.774 -11.891   4.523
  205    H    PHE  29           HN       PHE  29  65.208  -8.416   7.159
  206    HA   PHE  29           HA       PHE  29  67.280  -9.771   8.705
  207   1HB   PHE  29           HB2      PHE  29  67.189  -7.220   7.096
  208   2HB   PHE  29           HB1      PHE  29  68.613  -7.678   8.031
  209    HD1  PHE  29           HD1      PHE  29  69.672  -9.951   7.610
  210    HD2  PHE  29           HD2      PHE  29  66.740  -8.218   4.998
  211    HE1  PHE  29           HE1      PHE  29  70.373 -11.497   5.803
  212    HE2  PHE  29           HE2      PHE  29  67.439  -9.756   3.191
  213    HZ   PHE  29           HZ       PHE  29  69.256 -11.401   3.592
  214    H    ASP  30           HN       ASP  30  64.968  -7.299   9.334
  215    HA   ASP  30           HA       ASP  30  66.525  -6.173  11.572
  216   1HB   ASP  30           HB2      ASP  30  64.798  -4.572  11.788
  217   2HB   ASP  30           HB1      ASP  30  64.891  -4.866  10.051
  218    H    ALA  31           HN       ALA  31  65.203  -9.046  11.279
  219    HA   ALA  31           HA       ALA  31  63.426  -9.143  13.593
  220   1HB   ALA  31           HB2      ALA  31  64.229 -10.917  11.467
  221   2HB   ALA  31           HB1      ALA  31  64.409 -11.737  13.018
  222   3HB   ALA  31           HB3      ALA  31  62.850 -11.055  12.557
  223    H    ASP  32           HN       ASP  32  66.681  -8.673  13.384
  224    HA   ASP  32           HA       ASP  32  67.649 -10.536  15.376
  225   1HB   ASP  32           HB2      ASP  32  68.706  -8.003  14.142
  226   2HB   ASP  32           HB1      ASP  32  69.520  -8.710  15.538
  227    H    GLY  33           HN       GLY  33  65.635  -7.831  15.582
  228   1HA   GLY  33           HA2      GLY  33  64.594  -7.195  17.677
  229   2HA   GLY  33           HA1      GLY  33  66.036  -7.756  18.527
  230    H    GLY  34           HN       GLY  34  67.975  -6.440  16.894
  231   1HA   GLY  34           HA2      GLY  34  68.116  -3.899  18.156
  232   2HA   GLY  34           HA1      GLY  34  69.070  -4.370  16.749
  233    H    GLY  35           HN       GLY  35  67.017  -4.798  14.885
  234   1HA   GLY  35           HA2      GLY  35  65.173  -3.639  13.808
  235   2HA   GLY  35           HA1      GLY  35  65.535  -2.219  14.790
  236    H    ASP  36           HN       ASP  36  67.775  -4.210  12.861
  237    HA   ASP  36           HA       ASP  36  68.001  -2.176  10.779
  238   1HB   ASP  36           HB2      ASP  36  70.465  -1.776  11.283
  239   2HB   ASP  36           HB1      ASP  36  69.334  -1.017  12.403
  240    H    ILE  37           HN       ILE  37  69.857  -2.806   9.247
  241    HA   ILE  37           HA       ILE  37  70.443  -5.723   9.393
  242    HB   ILE  37           HB       ILE  37  68.677  -5.812   7.882
  243   1HG1  ILE  37          HG12      ILE  37  71.083  -5.163   6.154
  244   2HG1  ILE  37          HG11      ILE  37  70.638  -6.757   6.765
  245   1HG2  ILE  37          HG22      ILE  37  68.440  -3.284   7.883
  246   2HG2  ILE  37          HG21      ILE  37  69.605  -3.257   6.557
  247   3HG2  ILE  37          HG23      ILE  37  68.055  -4.073   6.354
  248   1HD1  ILE  37          HD13      ILE  37  68.766  -5.118   5.053
  249   2HD1  ILE  37          HD12      ILE  37  69.945  -6.226   4.352
  250   3HD1  ILE  37          HD11      ILE  37  68.681  -6.842   5.415
  251    H    SER  38           HN       SER  38  72.157  -6.293   7.724
  252    HA   SER  38           HA       SER  38  74.241  -4.173   7.790
  253   1HB   SER  38           HB2      SER  38  75.629  -6.248   6.916
  254   2HB   SER  38           HB1      SER  38  75.202  -6.121   8.620
  255    HG   SER  38           HG       SER  38  74.643  -8.091   7.057
  256    H    THR  39           HN       THR  39  75.317  -3.514   5.869
  257    HA   THR  39           HA       THR  39  73.728  -3.363   3.507
  258    HB   THR  39           HB       THR  39  75.850  -2.568   2.422
  259    HG1  THR  39           HG1      THR  39  77.499  -2.294   4.282
  260   1HG2  THR  39          HG23      THR  39  74.946  -1.488   5.086
  261   2HG2  THR  39          HG22      THR  39  76.223  -0.689   4.169
  262   3HG2  THR  39          HG21      THR  39  74.614  -0.860   3.471
  263    H    LYS  40           HN       LYS  40  76.061  -5.735   4.608
  264    HA   LYS  40           HA       LYS  40  76.484  -7.000   2.045
  265   1HB   LYS  40           HB2      LYS  40  76.878  -7.864   4.909
  266   2HB   LYS  40           HB1      LYS  40  77.120  -8.997   3.580
  267   1HG   LYS  40           HG2      LYS  40  78.450  -6.626   2.819
  268   2HG   LYS  40           HG1      LYS  40  78.873  -6.894   4.511
  269   1HD   LYS  40           HD2      LYS  40  79.157  -9.409   3.642
  270   2HD   LYS  40           HD1      LYS  40  79.468  -8.576   2.119
  271   1HE   LYS  40           HE2      LYS  40  81.140  -7.136   3.352
  272   2HE   LYS  40           HE1      LYS  40  80.930  -8.199   4.744
  273   1HZ   LYS  40           HZ2      LYS  40  81.792  -9.065   2.035
  274   2HZ   LYS  40           HZ1      LYS  40  82.818  -8.859   3.373
  275   3HZ   LYS  40           HZ3      LYS  40  81.626 -10.066   3.399
  276    H    ALA  41           HN       ALA  41  74.012  -7.216   4.512
  277    HA   ALA  41           HA       ALA  41  72.847  -9.669   3.400
  278   1HB   ALA  41           HB2      ALA  41  72.695  -8.399   5.858
  279   2HB   ALA  41           HB1      ALA  41  71.126  -8.047   5.136
  280   3HB   ALA  41           HB3      ALA  41  71.653  -9.719   5.327
  281    H    LEU  42           HN       LEU  42  72.823  -6.405   2.554
  282    HA   LEU  42           HA       LEU  42  70.114  -6.009   1.757
  283   1HB   LEU  42           HB2      LEU  42  72.670  -4.690   1.364
  284   2HB   LEU  42           HB1      LEU  42  71.710  -4.659  -0.116
  285    HG   LEU  42           HG       LEU  42  69.903  -3.554   0.946
  286   1HD1  LEU  42          HD11      LEU  42  71.214  -4.536   3.468
  287   2HD1  LEU  42          HD13      LEU  42  70.152  -3.129   3.529
  288   3HD1  LEU  42          HD12      LEU  42  69.530  -4.680   2.964
  289   1HD2  LEU  42          HD21      LEU  42  71.899  -2.122   0.560
  290   2HD2  LEU  42          HD23      LEU  42  70.927  -1.560   1.919
  291   3HD2  LEU  42          HD22      LEU  42  72.424  -2.446   2.213
  292    H    GLY  43           HN       GLY  43  72.888  -7.423   0.018
  293   1HA   GLY  43           HA2      GLY  43  71.813  -7.745  -2.528
  294   2HA   GLY  43           HA1      GLY  43  72.839  -8.966  -1.769
  295    H    THR  44           HN       THR  44  70.989  -9.456   0.433
  296    HA   THR  44           HA       THR  44  69.289 -11.422  -0.875
  297    HB   THR  44           HB       THR  44  69.643 -10.532   1.993
  298    HG1  THR  44           HG1      THR  44  70.364 -12.767   2.079
  299   1HG2  THR  44          HG21      THR  44  67.355 -11.821   0.837
  300   2HG2  THR  44          HG23      THR  44  68.206 -12.981   1.855
  301   3HG2  THR  44          HG22      THR  44  67.662 -11.448   2.533
  302    H    VAL  45           HN       VAL  45  68.761  -8.320   0.809
  303    HA   VAL  45           HA       VAL  45  65.901  -8.393   0.688
  304    HB   VAL  45           HB       VAL  45  67.549  -5.866   0.529
  305   1HG1  VAL  45          HG11      VAL  45  64.864  -6.214   0.604
  306   2HG1  VAL  45          HG13      VAL  45  65.214  -6.213   2.333
  307   3HG1  VAL  45          HG12      VAL  45  65.672  -4.829   1.340
  308   1HG2  VAL  45          HG22      VAL  45  67.126  -7.755   2.854
  309   2HG2  VAL  45          HG21      VAL  45  68.649  -7.107   2.244
  310   3HG2  VAL  45          HG23      VAL  45  67.518  -6.051   3.090
  311    H    MET  46           HN       MET  46  68.275  -7.948  -1.746
  312    HA   MET  46           HA       MET  46  66.776  -6.294  -3.560
  313   1HB   MET  46           HB2      MET  46  69.038  -8.262  -3.915
  314   2HB   MET  46           HB1      MET  46  68.302  -7.449  -5.296
  315   1HG   MET  46           HG2      MET  46  69.494  -6.045  -2.886
  316   2HG   MET  46           HG1      MET  46  70.291  -6.222  -4.449
  317   1HE   MET  46           HE3      MET  46  70.514  -3.815  -3.657
  318   2HE   MET  46           HE2      MET  46  70.411  -3.547  -5.396
  319   3HE   MET  46           HE1      MET  46  69.491  -2.522  -4.298
  320    H    ARG  47           HN       ARG  47  67.496  -9.770  -4.001
  321    HA   ARG  47           HA       ARG  47  65.412 -10.257  -5.846
  322   1HB   ARG  47           HB2      ARG  47  66.992 -11.981  -3.968
  323   2HB   ARG  47           HB1      ARG  47  65.599 -12.679  -4.796
  324   1HG   ARG  47           HG2      ARG  47  66.636 -11.639  -6.943
  325   2HG   ARG  47           HG1      ARG  47  68.118 -11.540  -5.990
  326   1HD   ARG  47           HD2      ARG  47  66.874 -14.138  -5.666
  327   2HD   ARG  47           HD1      ARG  47  67.153 -13.793  -7.373
  328    HE   ARG  47           HE       ARG  47  69.557 -13.117  -6.343
  329   1HH1  ARG  47          HH21      ARG  47  70.192 -14.358  -4.146
  330   2HH1  ARG  47          HH22      ARG  47  70.274 -16.066  -4.422
  331   1HH2  ARG  47          HH11      ARG  47  68.484 -15.941  -7.389
  332   2HH2  ARG  47          HH12      ARG  47  69.308 -16.963  -6.259
  333    H    MET  48           HN       MET  48  65.278  -9.801  -2.416
  334    HA   MET  48           HA       MET  48  62.874 -11.230  -1.833
  335   1HB   MET  48           HB2      MET  48  64.557  -9.257  -0.520
  336   2HB   MET  48           HB1      MET  48  62.849  -8.936  -0.221
  337   1HG   MET  48           HG2      MET  48  62.537 -10.900   0.931
  338   2HG   MET  48           HG1      MET  48  63.742 -11.771  -0.018
  339   1HE   MET  48           HE2      MET  48  64.074  -8.282   1.504
  340   2HE   MET  48           HE1      MET  48  63.141  -9.076   2.770
  341   3HE   MET  48           HE3      MET  48  64.798  -8.548   3.087
  342    H    LEU  49           HN       LEU  49  63.413  -7.889  -2.960
  343    HA   LEU  49           HA       LEU  49  60.506  -7.423  -3.102
  344   1HB   LEU  49           HB2      LEU  49  62.406  -5.525  -4.390
  345   2HB   LEU  49           HB1      LEU  49  61.015  -5.196  -3.360
  346    HG   LEU  49           HG       LEU  49  63.781  -6.075  -2.513
  347   1HD1  LEU  49          HD12      LEU  49  62.794  -3.584  -2.871
  348   2HD1  LEU  49          HD11      LEU  49  62.273  -3.871  -1.211
  349   3HD1  LEU  49          HD13      LEU  49  63.983  -3.972  -1.628
  350   1HD2  LEU  49          HD22      LEU  49  61.258  -6.781  -1.333
  351   2HD2  LEU  49          HD21      LEU  49  62.880  -7.143  -0.744
  352   3HD2  LEU  49          HD23      LEU  49  62.082  -5.644  -0.267
  353    H    GLY  50           HN       GLY  50  63.098  -6.968  -5.535
  354   1HA   GLY  50           HA2      GLY  50  62.024  -8.765  -7.462
  355   2HA   GLY  50           HA1      GLY  50  61.352  -7.164  -7.773
  356    H    GLN  51           HN       GLN  51  63.650  -5.652  -6.943
  357    HA   GLN  51           HA       GLN  51  65.165  -5.678  -9.382
  358   1HB   GLN  51           HB2      GLN  51  65.367  -4.261  -6.752
  359   2HB   GLN  51           HB1      GLN  51  66.765  -4.229  -7.827
  360   1HG   GLN  51           HG2      GLN  51  65.538  -2.332  -8.490
  361   2HG   GLN  51           HG1      GLN  51  65.056  -3.555  -9.668
  362   1HE2  GLN  51          HE22      GLN  51  62.356  -2.383  -6.795
  363   2HE2  GLN  51          HE21      GLN  51  64.013  -2.119  -6.534
  364    H    ASN  52           HN       ASN  52  67.147  -6.617  -9.851
  365    HA   ASN  52           HA       ASN  52  68.672  -7.933  -7.689
  366   1HB   ASN  52           HB2      ASN  52  66.881  -9.534  -8.693
  367   2HB   ASN  52           HB1      ASN  52  67.929  -9.565 -10.113
  368   1HD2  ASN  52          HD22      ASN  52  69.708 -12.180  -8.536
  369   2HD2  ASN  52          HD21      ASN  52  68.774 -11.700  -9.870
  370    HA   PRO  53           HA       PRO  53  71.185  -6.101 -11.120
  371   1HB   PRO  53           HB2      PRO  53  72.546  -4.329  -9.518
  372   2HB   PRO  53           HB1      PRO  53  71.018  -3.942 -10.329
  373   1HG   PRO  53           HG2      PRO  53  71.519  -4.530  -7.448
  374   2HG   PRO  53           HG1      PRO  53  70.232  -3.566  -8.188
  375   1HD   PRO  53           HD2      PRO  53  69.973  -6.215  -7.222
  376   2HD   PRO  53           HD1      PRO  53  68.804  -5.360  -8.253
  377    H    THR  54           HN       THR  54  73.759  -5.801 -10.923
  378    HA   THR  54           HA       THR  54  74.766  -8.327  -9.843
  379    HB   THR  54           HB       THR  54  75.573  -7.376 -12.007
  380    HG1  THR  54           HG1      THR  54  77.407  -7.737  -9.887
  381   1HG2  THR  54          HG23      THR  54  75.666  -5.002 -10.639
  382   2HG2  THR  54          HG22      THR  54  77.368  -5.465 -10.665
  383   3HG2  THR  54          HG21      THR  54  76.476  -5.301 -12.177
  384    H    LYS  55           HN       LYS  55  76.432  -8.488  -8.225
  385    HA   LYS  55           HA       LYS  55  76.085  -6.908  -5.919
  386   1HB   LYS  55           HB2      LYS  55  77.287  -9.172  -6.160
  387   2HB   LYS  55           HB1      LYS  55  78.710  -8.234  -6.619
  388   1HG   LYS  55           HG2      LYS  55  77.211  -7.477  -4.133
  389   2HG   LYS  55           HG1      LYS  55  78.303  -8.861  -4.086
  390   1HD   LYS  55           HD2      LYS  55  79.796  -6.959  -5.425
  391   2HD   LYS  55           HD1      LYS  55  78.929  -5.999  -4.226
  392   1HE   LYS  55           HE2      LYS  55  80.744  -6.654  -2.952
  393   2HE   LYS  55           HE1      LYS  55  79.651  -7.998  -2.623
  394   1HZ   LYS  55           HZ2      LYS  55  81.165  -8.374  -5.021
  395   2HZ   LYS  55           HZ1      LYS  55  82.162  -8.193  -3.658
  396   3HZ   LYS  55           HZ3      LYS  55  80.978  -9.408  -3.685
  397    H    GLU  56           HN       GLU  56  77.971  -6.285  -8.776
  398    HA   GLU  56           HA       GLU  56  79.826  -4.397  -7.703
  399   1HB   GLU  56           HB2      GLU  56  79.342  -5.456 -10.194
  400   2HB   GLU  56           HB1      GLU  56  78.804  -3.789 -10.396
  401   1HG   GLU  56           HG2      GLU  56  81.147  -3.473  -8.982
  402   2HG   GLU  56           HG1      GLU  56  81.524  -4.841 -10.029
  403    H    GLU  57           HN       GLU  57  76.968  -3.559  -9.691
  404    HA   GLU  57           HA       GLU  57  76.843  -0.853  -8.953
  405   1HB   GLU  57           HB2      GLU  57  74.632  -2.788  -9.684
  406   2HB   GLU  57           HB1      GLU  57  74.364  -1.057  -9.478
  407   1HG   GLU  57           HG2      GLU  57  76.168  -0.648 -11.186
  408   2HG   GLU  57           HG1      GLU  57  76.212  -2.388 -11.476
  409    H    LEU  58           HN       LEU  58  76.055  -3.660  -7.087
  410    HA   LEU  58           HA       LEU  58  74.260  -2.383  -5.219
  411   1HB   LEU  58           HB2      LEU  58  74.498  -4.872  -5.530
  412   2HB   LEU  58           HB1      LEU  58  76.063  -4.770  -4.720
  413    HG   LEU  58           HG       LEU  58  74.589  -3.447  -2.911
  414   1HD1  LEU  58          HD11      LEU  58  72.674  -4.739  -4.686
  415   2HD1  LEU  58          HD13      LEU  58  72.505  -5.309  -3.026
  416   3HD1  LEU  58          HD12      LEU  58  72.386  -3.587  -3.382
  417   1HD2  LEU  58          HD22      LEU  58  75.987  -5.595  -2.717
  418   2HD2  LEU  58          HD21      LEU  58  74.624  -5.447  -1.606
  419   3HD2  LEU  58          HD23      LEU  58  74.489  -6.469  -3.037
  420    H    ASP  59           HN       ASP  59  77.758  -3.139  -5.078
  421    HA   ASP  59           HA       ASP  59  78.304  -2.049  -2.541
  422   1HB   ASP  59           HB2      ASP  59  79.937  -3.273  -4.032
  423   2HB   ASP  59           HB1      ASP  59  80.102  -1.787  -4.969
  424    H    ALA  60           HN       ALA  60  78.282  -0.379  -5.706
  425    HA   ALA  60           HA       ALA  60  78.937   2.206  -4.700
  426   1HB   ALA  60           HB3      ALA  60  78.643   1.278  -7.175
  427   2HB   ALA  60           HB2      ALA  60  77.016   1.927  -6.981
  428   3HB   ALA  60           HB1      ALA  60  78.414   2.989  -6.820
  429    H    ILE  61           HN       ILE  61  75.889   0.446  -4.877
  430    HA   ILE  61           HA       ILE  61  74.142   2.631  -4.285
  431    HB   ILE  61           HB       ILE  61  73.969  -0.356  -3.883
  432   1HG1  ILE  61          HG12      ILE  61  72.542   1.665  -5.635
  433   2HG1  ILE  61          HG11      ILE  61  73.716   0.461  -6.159
  434   1HG2  ILE  61          HG22      ILE  61  72.729   0.704  -2.021
  435   2HG2  ILE  61          HG21      ILE  61  71.844   1.692  -3.183
  436   3HG2  ILE  61          HG23      ILE  61  71.630  -0.059  -3.171
  437   1HD1  ILE  61          HD13      ILE  61  71.181  -0.350  -4.740
  438   2HD1  ILE  61          HD12      ILE  61  71.210  -0.096  -6.485
  439   3HD1  ILE  61          HD11      ILE  61  72.233  -1.335  -5.758
  440    H    ILE  62           HN       ILE  62  75.687   0.230  -2.129
  441    HA   ILE  62           HA       ILE  62  74.696   1.334   0.308
  442    HB   ILE  62           HB       ILE  62  77.182  -0.274  -0.322
  443   1HG1  ILE  62          HG12      ILE  62  74.964  -1.308   1.355
  444   2HG1  ILE  62          HG11      ILE  62  74.570  -1.032  -0.342
  445   1HG2  ILE  62          HG23      ILE  62  76.295   1.045   2.178
  446   2HG2  ILE  62          HG22      ILE  62  76.765  -0.649   2.337
  447   3HG2  ILE  62          HG21      ILE  62  77.909   0.526   1.687
  448   1HD1  ILE  62          HD13      ILE  62  76.678  -2.329  -0.924
  449   2HD1  ILE  62          HD12      ILE  62  76.768  -2.786   0.778
  450   3HD1  ILE  62          HD11      ILE  62  75.385  -3.283  -0.197
  451    H    GLU  63           HN       GLU  63  77.386   2.229  -1.760
  452    HA   GLU  63           HA       GLU  63  78.771   3.882   0.143
  453   1HB   GLU  63           HB2      GLU  63  78.956   3.257  -2.680
  454   2HB   GLU  63           HB1      GLU  63  79.176   4.987  -2.415
  455   1HG   GLU  63           HG2      GLU  63  81.237   4.638  -1.586
  456   2HG   GLU  63           HG1      GLU  63  80.594   3.521  -0.381
  457    H    GLU  64           HN       GLU  64  76.007   4.427  -1.967
  458    HA   GLU  64           HA       GLU  64  76.002   7.308  -1.225
  459   1HB   GLU  64           HB2      GLU  64  74.864   5.698  -3.435
  460   2HB   GLU  64           HB1      GLU  64  73.841   7.009  -2.848
  461   1HG   GLU  64           HG2      GLU  64  76.008   8.450  -2.986
  462   2HG   GLU  64           HG1      GLU  64  76.601   7.165  -4.040
  463    H    VAL  65           HN       VAL  65  74.653   4.366  -0.216
  464    HA   VAL  65           HA       VAL  65  72.151   5.600   0.772
  465    HB   VAL  65           HB       VAL  65  73.226   2.780   1.091
  466   1HG1  VAL  65          HG13      VAL  65  70.738   4.189   1.993
  467   2HG1  VAL  65          HG12      VAL  65  70.625   2.496   1.512
  468   3HG1  VAL  65          HG11      VAL  65  71.697   2.969   2.830
  469   1HG2  VAL  65          HG21      VAL  65  72.486   3.809  -1.242
  470   2HG2  VAL  65          HG23      VAL  65  71.981   2.184  -0.778
  471   3HG2  VAL  65          HG22      VAL  65  70.867   3.538  -0.596
  472    H    ASP  66           HN       ASP  66  75.338   4.782   1.885
  473    HA   ASP  66           HA       ASP  66  74.553   4.996   4.727
  474   1HB   ASP  66           HB2      ASP  66  76.907   4.055   3.221
  475   2HB   ASP  66           HB1      ASP  66  77.302   4.949   4.689
  476    H    GLU  67           HN       GLU  67  73.788   7.311   4.001
  477    HA   GLU  67           HA       GLU  67  75.637   9.373   3.423
  478   1HB   GLU  67           HB2      GLU  67  72.884   9.178   4.336
  479   2HB   GLU  67           HB1      GLU  67  73.719  10.522   5.117
  480   1HG   GLU  67           HG2      GLU  67  74.352  10.330   2.271
  481   2HG   GLU  67           HG1      GLU  67  72.627  10.558   2.560
  482    H    ASP  68           HN       ASP  68  75.104   7.603   6.355
  483    HA   ASP  68           HA       ASP  68  76.649   9.608   7.919
  484   1HB   ASP  68           HB2      ASP  68  76.060   7.940   9.825
  485   2HB   ASP  68           HB1      ASP  68  74.765   8.938   9.165
  486    H    GLY  69           HN       GLY  69  76.907   6.479   6.433
  487   1HA   GLY  69           HA2      GLY  69  78.862   5.204   6.071
  488   2HA   GLY  69           HA1      GLY  69  79.770   6.413   6.980
  489    H    SER  70           HN       SER  70  76.902   4.851   8.273
  490    HA   SER  70           HA       SER  70  78.417   3.947  10.598
  491   1HB   SER  70           HB2      SER  70  76.145   2.909  11.201
  492   2HB   SER  70           HB1      SER  70  76.194   4.663  11.051
  493    HG   SER  70           HG       SER  70  75.631   3.087   8.797
  494    H    GLY  71           HN       GLY  71  77.640   2.630   7.536
  495   1HA   GLY  71           HA2      GLY  71  78.344   0.558   6.636
  496   2HA   GLY  71           HA1      GLY  71  78.958   0.116   8.229
  497    H    THR  72           HN       THR  72  75.736   1.268   8.228
  498    HA   THR  72           HA       THR  72  74.629  -1.486   8.026
  499    HB   THR  72           HB       THR  72  73.210  -0.566  10.141
  500    HG1  THR  72           HG1      THR  72  74.981   0.270  11.537
  501   1HG2  THR  72          HG22      THR  72  74.851  -2.646   9.675
  502   2HG2  THR  72          HG21      THR  72  75.846  -1.759  10.829
  503   3HG2  THR  72          HG23      THR  72  74.222  -2.279  11.282
  504    H    ILE  73           HN       ILE  73  72.536  -1.512   7.194
  505    HA   ILE  73           HA       ILE  73  71.438   1.156   6.425
  506    HB   ILE  73           HB       ILE  73  70.806  -1.571   5.260
  507   1HG1  ILE  73          HG12      ILE  73  73.190  -0.698   4.942
  508   2HG1  ILE  73          HG11      ILE  73  72.291  -1.029   3.461
  509   1HG2  ILE  73          HG23      ILE  73  69.608   1.049   5.007
  510   2HG2  ILE  73          HG22      ILE  73  70.266   0.531   3.456
  511   3HG2  ILE  73          HG21      ILE  73  69.090  -0.478   4.296
  512   1HD1  ILE  73          HD12      ILE  73  71.927   1.703   4.510
  513   2HD1  ILE  73          HD11      ILE  73  73.574   1.337   3.998
  514   3HD1  ILE  73          HD13      ILE  73  72.238   1.163   2.859
  515    H    ASP  74           HN       ASP  74  69.410   1.740   7.115
  516    HA   ASP  74           HA       ASP  74  67.917  -0.270   8.753
  517   1HB   ASP  74           HB2      ASP  74  66.949   1.979   9.767
  518   2HB   ASP  74           HB1      ASP  74  68.491   1.340  10.333
  519    H    PHE  75           HN       PHE  75  65.484   0.286   8.818
  520    HA   PHE  75           HA       PHE  75  64.368   0.168   6.255
  521   1HB   PHE  75           HB2      PHE  75  63.237  -0.264   8.522
  522   2HB   PHE  75           HB1      PHE  75  62.943   1.476   8.575
  523    HD1  PHE  75           HD2      PHE  75  62.865  -1.077   5.839
  524    HD2  PHE  75           HD1      PHE  75  60.736   1.961   7.997
  525    HE1  PHE  75           HE2      PHE  75  60.923  -1.359   4.317
  526    HE2  PHE  75           HE1      PHE  75  58.793   1.682   6.479
  527    HZ   PHE  75           HZ       PHE  75  58.887   0.021   4.638
  528    H    GLU  76           HN       GLU  76  65.440   2.977   8.034
  529    HA   GLU  76           HA       GLU  76  63.972   4.899   6.424
  530   1HB   GLU  76           HB2      GLU  76  66.383   5.202   8.235
  531   2HB   GLU  76           HB1      GLU  76  65.538   6.553   7.477
  532   1HG   GLU  76           HG2      GLU  76  64.333   6.519   9.422
  533   2HG   GLU  76           HG1      GLU  76  63.432   5.256   8.581
  534    H    GLU  77           HN       GLU  77  67.228   3.495   6.314
  535    HA   GLU  77           HA       GLU  77  67.957   5.182   4.011
  536   1HB   GLU  77           HB2      GLU  77  69.397   2.958   5.479
  537   2HB   GLU  77           HB1      GLU  77  70.073   3.795   4.082
  538   1HG   GLU  77           HG2      GLU  77  69.936   5.935   5.255
  539   2HG   GLU  77           HG1      GLU  77  69.172   5.152   6.639
  540    H    PHE  78           HN       PHE  78  66.333   2.227   4.502
  541    HA   PHE  78           HA       PHE  78  67.236   0.811   2.166
  542   1HB   PHE  78           HB2      PHE  78  66.141  -0.646   3.571
  543   2HB   PHE  78           HB1      PHE  78  65.005   0.579   4.127
  544    HD1  PHE  78           HD2      PHE  78  63.121   1.282   2.628
  545    HD2  PHE  78           HD1      PHE  78  65.586  -2.125   1.783
  546    HE1  PHE  78           HE2      PHE  78  61.397   0.429   1.053
  547    HE2  PHE  78           HE1      PHE  78  63.871  -2.983   0.208
  548    HZ   PHE  78           HZ       PHE  78  61.776  -1.706  -0.156
  549    H    LEU  79           HN       LEU  79  64.396   2.895   2.786
  550    HA   LEU  79           HA       LEU  79  63.217   2.765   0.238
  551   1HB   LEU  79           HB2      LEU  79  63.435   5.224   2.002
  552   2HB   LEU  79           HB1      LEU  79  62.234   4.952   0.738
  553    HG   LEU  79           HG       LEU  79  62.581   3.154   3.153
  554   1HD1  LEU  79          HD11      LEU  79  61.698   5.672   3.365
  555   2HD1  LEU  79          HD13      LEU  79  60.205   4.925   2.797
  556   3HD1  LEU  79          HD12      LEU  79  60.968   4.354   4.281
  557   1HD2  LEU  79          HD22      LEU  79  61.553   2.290   0.948
  558   2HD2  LEU  79          HD21      LEU  79  60.595   2.080   2.414
  559   3HD2  LEU  79          HD23      LEU  79  60.212   3.384   1.289
  560    H    VAL  80           HN       VAL  80  65.925   4.782   1.354
  561    HA   VAL  80           HA       VAL  80  66.210   6.350  -1.008
  562    HB   VAL  80           HB       VAL  80  68.402   5.367   0.849
  563   1HG1  VAL  80          HG11      VAL  80  68.610   6.729  -1.555
  564   2HG1  VAL  80          HG13      VAL  80  68.618   8.028  -0.364
  565   3HG1  VAL  80          HG12      VAL  80  69.815   6.738  -0.270
  566   1HG2  VAL  80          HG22      VAL  80  66.298   7.469   1.073
  567   2HG2  VAL  80          HG21      VAL  80  67.074   6.517   2.339
  568   3HG2  VAL  80          HG23      VAL  80  67.916   7.896   1.632
  569    H    MET  81           HN       MET  81  67.395   3.123  -0.163
  570    HA   MET  81           HA       MET  81  69.159   2.701  -2.326
  571   1HB   MET  81           HB2      MET  81  68.550   1.174  -0.285
  572   2HB   MET  81           HB1      MET  81  67.325   0.515  -1.371
  573   1HG   MET  81           HG2      MET  81  68.876  -0.447  -2.762
  574   2HG   MET  81           HG1      MET  81  70.071   0.818  -2.475
  575   1HE   MET  81           HE2      MET  81  70.424   1.398  -0.088
  576   2HE   MET  81           HE1      MET  81  70.235   0.316   1.289
  577   3HE   MET  81           HE3      MET  81  71.780   0.403   0.432
  578    H    MET  82           HN       MET  82  65.652   2.011  -2.138
  579    HA   MET  82           HA       MET  82  65.370   1.070  -4.808
  580   1HB   MET  82           HB2      MET  82  63.324   2.583  -3.154
  581   2HB   MET  82           HB1      MET  82  62.984   1.536  -4.532
  582   1HG   MET  82           HG2      MET  82  64.387   0.589  -2.019
  583   2HG   MET  82           HG1      MET  82  62.651   0.431  -2.286
  584   1HE   MET  82           HE2      MET  82  65.984  -0.388  -2.723
  585   2HE   MET  82           HE1      MET  82  65.905  -2.122  -3.027
  586   3HE   MET  82           HE3      MET  82  66.216  -0.999  -4.358
  587    H    VAL  83           HN       VAL  83  64.768   4.354  -3.498
  588    HA   VAL  83           HA       VAL  83  64.311   5.508  -6.100
  589    HB   VAL  83           HB       VAL  83  65.339   7.148  -3.811
  590   1HG1  VAL  83          HG12      VAL  83  64.586   8.061  -6.071
  591   2HG1  VAL  83          HG11      VAL  83  62.957   7.543  -5.636
  592   3HG1  VAL  83          HG13      VAL  83  63.785   8.760  -4.664
  593   1HG2  VAL  83          HG23      VAL  83  62.982   5.356  -3.780
  594   2HG2  VAL  83          HG22      VAL  83  63.876   6.063  -2.433
  595   3HG2  VAL  83          HG21      VAL  83  62.664   7.018  -3.287
  596    H    ARG  84           HN       ARG  84  67.119   4.347  -4.672
  597    HA   ARG  84           HA       ARG  84  69.033   6.307  -5.527
  598   1HB   ARG  84           HB2      ARG  84  69.111   3.943  -4.079
  599   2HB   ARG  84           HB1      ARG  84  69.989   3.540  -5.557
  600   1HG   ARG  84           HG2      ARG  84  71.726   4.468  -4.371
  601   2HG   ARG  84           HG1      ARG  84  71.077   5.941  -5.092
  602   1HD   ARG  84           HD2      ARG  84  69.511   5.760  -2.882
  603   2HD   ARG  84           HD1      ARG  84  70.994   5.023  -2.276
  604    HE   ARG  84           HE       ARG  84  71.909   7.184  -2.236
  605   1HH1  ARG  84          HH21      ARG  84  68.857   7.792  -3.148
  606   2HH1  ARG  84          HH22      ARG  84  69.199   9.068  -4.270
  607   1HH2  ARG  84          HH11      ARG  84  72.613   8.470  -4.318
  608   2HH2  ARG  84          HH12      ARG  84  71.326   9.450  -4.931
  609    H    GLN  85           HN       GLN  85  67.701   3.392  -7.090
  610    HA   GLN  85           HA       GLN  85  68.931   4.368  -9.639
  611   1HB   GLN  85           HB2      GLN  85  69.046   1.957 -10.321
  612   2HB   GLN  85           HB1      GLN  85  70.086   2.347  -8.950
  613   1HG   GLN  85           HG2      GLN  85  68.996   0.878  -7.640
  614   2HG   GLN  85           HG1      GLN  85  67.449   1.641  -8.009
  615   1HE2  GLN  85          HE21      GLN  85  67.427   1.145 -10.857
  616   2HE2  GLN  85          HE22      GLN  85  67.266  -0.528 -11.091
  617    H    MET  86           HN       MET  86  66.083   4.136  -8.083
  618    HA   MET  86           HA       MET  86  64.403   2.813 -10.019
  619   1HB   MET  86           HB2      MET  86  64.041   4.433  -7.594
  620   2HB   MET  86           HB1      MET  86  62.771   4.671  -8.792
  621   1HG   MET  86           HG2      MET  86  62.637   2.123  -8.949
  622   2HG   MET  86           HG1      MET  86  63.640   2.080  -7.499
  623   1HE   MET  86           HE3      MET  86  60.711   3.109  -9.308
  624   2HE   MET  86           HE2      MET  86  59.359   3.145  -8.178
  625   3HE   MET  86           HE1      MET  86  60.349   4.584  -8.402
  626    H    LYS  87           HN       LYS  87  66.124   5.718 -10.157
  627    HA   LYS  87           HA       LYS  87  64.595   6.519 -12.569
  628   1HB   LYS  87           HB2      LYS  87  64.774   8.943 -11.771
  629   2HB   LYS  87           HB1      LYS  87  63.581   7.943 -10.938
  630   1HG   LYS  87           HG2      LYS  87  65.157   7.538  -9.106
  631   2HG   LYS  87           HG1      LYS  87  66.398   8.469  -9.946
  632   1HD   LYS  87           HD2      LYS  87  64.618  10.380  -9.947
  633   2HD   LYS  87           HD1      LYS  87  63.860   9.445  -8.657
  634   1HE   LYS  87           HE2      LYS  87  65.408  11.113  -7.718
  635   2HE   LYS  87           HE1      LYS  87  65.986   9.478  -7.392
  636   1HZ   LYS  87           HZ1      LYS  87  66.931  10.463  -9.896
  637   2HZ   LYS  87           HZ3      LYS  87  67.387  11.483  -8.620
  638   3HZ   LYS  87           HZ2      LYS  87  67.807   9.837  -8.582
  639    H    GLU  88           HN       GLU  88  66.483   5.777 -13.717
  640    HA   GLU  88           HA       GLU  88  68.543   7.814 -13.990
  641   1HB   GLU  88           HB2      GLU  88  70.415   6.136 -13.499
  642   2HB   GLU  88           HB1      GLU  88  69.559   6.774 -12.096
  643   1HG   GLU  88           HG2      GLU  88  69.096   4.655 -11.495
  644   2HG   GLU  88           HG1      GLU  88  68.073   4.531 -12.927
  645    H    ASP  89           HN       ASP  89  67.462   4.515 -14.712
  646    HA   ASP  89           HA       ASP  89  68.579   4.873 -17.466
  647   1HB   ASP  89           HB2      ASP  89  68.675   2.608 -15.579
  648   2HB   ASP  89           HB1      ASP  89  68.203   2.168 -17.221
  649    H    ALA  90           HN       ALA  90  65.876   5.555 -16.258
  650    HA   ALA  90           HA       ALA  90  64.274   4.093 -18.305
  651   1HB   ALA  90           HB2      ALA  90  63.920   3.089 -16.016
  652   2HB   ALA  90           HB1      ALA  90  63.294   4.651 -15.491
  653   3HB   ALA  90           HB3      ALA  90  62.456   3.744 -16.750
   
  No H/Q in entry =         653
  Start of MODEL   37
    1   1H    ALA   1           HT3      ALA   1  62.147   9.589  13.274
    2   2H    ALA   1           HT2      ALA   1  60.600  10.081  13.777
    3   3H    ALA   1           HT1      ALA   1  61.074  10.282  12.157
    4    HA   ALA   1           HA       ALA   1  61.227  12.404  13.154
    5   1HB   ALA   1           HB1      ALA   1  61.510  11.064  15.491
    6   2HB   ALA   1           HB3      ALA   1  63.186  11.535  15.210
    7   3HB   ALA   1           HB2      ALA   1  61.927  12.767  15.304
    8    H    SER   2           HN       SER   2  62.578  11.010  11.084
    9    HA   SER   2           HA       SER   2  65.054  12.577  10.997
   10   1HB   SER   2           HB2      SER   2  66.026  10.700  12.079
   11   2HB   SER   2           HB1      SER   2  65.063   9.560  11.143
   12    HG   SER   2           HG       SER   2  67.337  11.027  10.428
   13    H    MET   3           HN       MET   3  64.048  13.537   9.159
   14    HA   MET   3           HA       MET   3  63.799  11.707   6.801
   15   1HB   MET   3           HB2      MET   3  62.263  13.613   5.934
   16   2HB   MET   3           HB1      MET   3  61.618  12.530   7.166
   17   1HG   MET   3           HG2      MET   3  63.063  15.013   8.027
   18   2HG   MET   3           HG1      MET   3  61.396  15.142   7.465
   19   1HE   MET   3           HE1      MET   3  59.965  15.655   9.158
   20   2HE   MET   3           HE3      MET   3  59.305  14.087   8.669
   21   3HE   MET   3           HE2      MET   3  59.404  14.512  10.376
   22    H    THR   4           HN       THR   4  66.189  12.187   6.630
   23    HA   THR   4           HA       THR   4  67.203  14.802   6.141
   24    HB   THR   4           HB       THR   4  69.117  13.692   5.128
   25    HG1  THR   4           HG1      THR   4  68.765  11.992   3.981
   26   1HG2  THR   4          HG23      THR   4  67.932  12.013   7.360
   27   2HG2  THR   4          HG22      THR   4  69.634  12.045   6.894
   28   3HG2  THR   4          HG21      THR   4  68.877  13.487   7.571
   29    H    ASP   5           HN       ASP   5  68.291  15.067   3.725
   30    HA   ASP   5           HA       ASP   5  66.052  15.682   2.016
   31   1HB   ASP   5           HB2      ASP   5  69.013  15.560   1.363
   32   2HB   ASP   5           HB1      ASP   5  67.773  16.327   0.369
   33    H    GLN   6           HN       GLN   6  68.651  13.230   1.786
   34    HA   GLN   6           HA       GLN   6  67.785  12.005  -0.609
   35   1HB   GLN   6           HB2      GLN   6  69.604  11.380   1.543
   36   2HB   GLN   6           HB1      GLN   6  68.704   9.934   1.085
   37   1HG   GLN   6           HG2      GLN   6  69.489   9.979  -1.118
   38   2HG   GLN   6           HG1      GLN   6  69.877  11.699  -1.046
   39   1HE2  GLN   6          HE22      GLN   6  72.453   9.538   1.267
   40   2HE2  GLN   6          HE21      GLN   6  70.783   9.477   1.558
   41    H    GLN   7           HN       GLN   7  66.814  11.342   2.757
   42    HA   GLN   7           HA       GLN   7  64.917   9.279   1.957
   43   1HB   GLN   7           HB2      GLN   7  65.231  10.805   4.562
   44   2HB   GLN   7           HB1      GLN   7  64.174   9.412   4.331
   45   1HG   GLN   7           HG2      GLN   7  65.894   7.975   4.559
   46   2HG   GLN   7           HG1      GLN   7  66.856   8.852   3.369
   47   1HE2  GLN   7          HE22      GLN   7  69.007   9.845   5.977
   48   2HE2  GLN   7          HE21      GLN   7  68.846   9.100   4.461
   49    H    ALA   8           HN       ALA   8  64.896  12.712   2.071
   50    HA   ALA   8           HA       ALA   8  62.061  13.088   2.514
   51   1HB   ALA   8           HB3      ALA   8  64.362  14.739   2.041
   52   2HB   ALA   8           HB2      ALA   8  63.083  15.211   0.922
   53   3HB   ALA   8           HB1      ALA   8  62.780  15.214   2.659
   54    H    GLU   9           HN       GLU   9  64.075  13.105  -0.448
   55    HA   GLU   9           HA       GLU   9  61.778  13.294  -2.205
   56   1HB   GLU   9           HB2      GLU   9  64.567  13.486  -2.482
   57   2HB   GLU   9           HB1      GLU   9  64.105  12.085  -3.449
   58   1HG   GLU   9           HG2      GLU   9  64.000  14.173  -4.776
   59   2HG   GLU   9           HG1      GLU   9  62.409  13.431  -4.614
   60    H    ALA  10           HN       ALA  10  63.650  10.648  -0.824
   61    HA   ALA  10           HA       ALA  10  62.703   8.553  -2.510
   62   1HB   ALA  10           HB3      ALA  10  64.557   8.476  -0.716
   63   2HB   ALA  10           HB2      ALA  10  63.252   8.218   0.441
   64   3HB   ALA  10           HB1      ALA  10  63.522   7.057  -0.860
   65    H    ARG  11           HN       ARG  11  61.486   9.613   0.690
   66    HA   ARG  11           HA       ARG  11  59.161   7.911   0.577
   67   1HB   ARG  11           HB2      ARG  11  60.278   9.912   2.382
   68   2HB   ARG  11           HB1      ARG  11  58.522  10.041   2.265
   69   1HG   ARG  11           HG2      ARG  11  58.237   7.723   2.865
   70   2HG   ARG  11           HG1      ARG  11  59.972   7.428   2.756
   71   1HD   ARG  11           HD2      ARG  11  59.211   7.702   5.110
   72   2HD   ARG  11           HD1      ARG  11  60.382   8.933   4.639
   73    HE   ARG  11           HE       ARG  11  58.066  10.227   4.113
   74   1HH1  ARG  11          HH21      ARG  11  57.418   7.844   6.219
   75   2HH1  ARG  11          HH22      ARG  11  57.149   8.834   7.614
   76   1HH2  ARG  11          HH11      ARG  11  58.423  11.707   6.149
   77   2HH2  ARG  11          HH12      ARG  11  57.717  11.020   7.575
   78    H    ALA  12           HN       ALA  12  59.899  11.074  -0.691
   79    HA   ALA  12           HA       ALA  12  57.136  11.897  -1.057
   80   1HB   ALA  12           HB1      ALA  12  59.388  13.305  -1.063
   81   2HB   ALA  12           HB3      ALA  12  59.343  12.946  -2.790
   82   3HB   ALA  12           HB2      ALA  12  58.006  13.814  -2.035
   83    H    PHE  13           HN       PHE  13  59.423   9.960  -2.848
   84    HA   PHE  13           HA       PHE  13  57.787  10.039  -5.301
   85   1HB   PHE  13           HB2      PHE  13  60.270   9.930  -5.432
   86   2HB   PHE  13           HB1      PHE  13  60.223   8.361  -4.630
   87    HD1  PHE  13           HD2      PHE  13  58.913   6.468  -5.728
   88    HD2  PHE  13           HD1      PHE  13  59.900  10.118  -7.766
   89    HE1  PHE  13           HE2      PHE  13  58.500   5.363  -7.909
   90    HE2  PHE  13           HE1      PHE  13  59.487   9.014  -9.947
   91    HZ   PHE  13           HZ       PHE  13  58.786   6.634 -10.018
   92    H    LEU  14           HN       LEU  14  58.417   7.896  -2.571
   93    HA   LEU  14           HA       LEU  14  56.731   5.778  -3.775
   94   1HB   LEU  14           HB2      LEU  14  58.061   5.803  -1.053
   95   2HB   LEU  14           HB1      LEU  14  57.433   4.402  -1.922
   96    HG   LEU  14           HG       LEU  14  59.627   6.154  -3.044
   97   1HD1  LEU  14          HD11      LEU  14  59.885   4.650  -0.745
   98   2HD1  LEU  14          HD13      LEU  14  60.382   3.512  -1.998
   99   3HD1  LEU  14          HD12      LEU  14  61.207   5.063  -1.836
  100   1HD2  LEU  14          HD23      LEU  14  58.051   3.977  -4.022
  101   2HD2  LEU  14          HD22      LEU  14  59.373   4.813  -4.836
  102   3HD2  LEU  14          HD21      LEU  14  59.708   3.404  -3.829
  103    H    SER  15           HN       SER  15  54.681   5.264  -3.003
  104    HA   SER  15           HA       SER  15  53.389   7.317  -1.325
  105   1HB   SER  15           HB2      SER  15  52.544   5.616  -3.420
  106   2HB   SER  15           HB1      SER  15  51.674   5.088  -1.983
  107    HG   SER  15           HG       SER  15  50.545   6.762  -2.968
  108    H    GLU  16           HN       GLU  16  52.142   6.708   0.594
  109    HA   GLU  16           HA       GLU  16  53.566   5.045   2.408
  110   1HB   GLU  16           HB2      GLU  16  50.977   6.481   2.394
  111   2HB   GLU  16           HB1      GLU  16  51.069   5.110   3.501
  112   1HG   GLU  16           HG2      GLU  16  52.998   6.021   4.604
  113   2HG   GLU  16           HG1      GLU  16  53.186   7.268   3.371
  114    H    GLU  17           HN       GLU  17  51.092   4.302   0.066
  115    HA   GLU  17           HA       GLU  17  50.256   1.787   1.205
  116   1HB   GLU  17           HB2      GLU  17  49.903   3.230  -1.354
  117   2HB   GLU  17           HB1      GLU  17  49.811   1.471  -1.467
  118   1HG   GLU  17           HG2      GLU  17  47.641   1.783  -0.849
  119   2HG   GLU  17           HG1      GLU  17  48.318   1.920   0.773
  120    H    MET  18           HN       MET  18  52.905   2.754  -0.909
  121    HA   MET  18           HA       MET  18  53.663  -0.080  -1.334
  122   1HB   MET  18           HB2      MET  18  54.847   2.513  -2.369
  123   2HB   MET  18           HB1      MET  18  55.458   0.909  -2.773
  124   1HG   MET  18           HG2      MET  18  52.569   1.120  -3.152
  125   2HG   MET  18           HG1      MET  18  53.460   2.276  -4.142
  126   1HE   MET  18           HE2      MET  18  55.544   1.627  -5.585
  127   2HE   MET  18           HE1      MET  18  55.123   0.425  -6.802
  128   3HE   MET  18           HE3      MET  18  53.989   1.725  -6.405
  129    H    ILE  19           HN       ILE  19  54.407   2.566   0.739
  130    HA   ILE  19           HA       ILE  19  57.108   1.654   1.395
  131    HB   ILE  19           HB       ILE  19  55.250   3.738   2.546
  132   1HG1  ILE  19          HG12      ILE  19  57.930   4.548   1.798
  133   2HG1  ILE  19          HG11      ILE  19  57.152   3.692   0.467
  134   1HG2  ILE  19          HG21      ILE  19  57.864   2.685   3.627
  135   2HG2  ILE  19          HG23      ILE  19  57.351   4.345   3.932
  136   3HG2  ILE  19          HG22      ILE  19  56.362   2.998   4.497
  137   1HD1  ILE  19          HD13      ILE  19  55.220   5.437   1.645
  138   2HD1  ILE  19          HD12      ILE  19  56.687   6.368   1.346
  139   3HD1  ILE  19          HD11      ILE  19  55.904   5.506   0.020
  140    H    ALA  20           HN       ALA  20  53.853   1.255   2.705
  141    HA   ALA  20           HA       ALA  20  54.620   0.099   5.212
  142   1HB   ALA  20           HB3      ALA  20  52.140  -0.033   3.507
  143   2HB   ALA  20           HB2      ALA  20  52.283  -1.038   4.950
  144   3HB   ALA  20           HB1      ALA  20  52.356   0.719   5.088
  145    H    GLU  21           HN       GLU  21  54.418  -1.185   1.959
  146    HA   GLU  21           HA       GLU  21  54.550  -3.978   2.801
  147   1HB   GLU  21           HB2      GLU  21  55.052  -2.674   0.107
  148   2HB   GLU  21           HB1      GLU  21  54.956  -4.412   0.382
  149   1HG   GLU  21           HG2      GLU  21  52.734  -2.468   1.071
  150   2HG   GLU  21           HG1      GLU  21  52.801  -3.398  -0.428
  151    H    PHE  22           HN       PHE  22  56.861  -1.526   1.672
  152    HA   PHE  22           HA       PHE  22  59.130  -3.212   1.403
  153   1HB   PHE  22           HB2      PHE  22  58.944  -0.312   2.277
  154   2HB   PHE  22           HB1      PHE  22  60.454  -1.126   1.860
  155    HD1  PHE  22           HD1      PHE  22  59.499  -2.858  -0.392
  156    HD2  PHE  22           HD2      PHE  22  58.712   1.265   0.518
  157    HE1  PHE  22           HE1      PHE  22  59.077  -2.408  -2.793
  158    HE2  PHE  22           HE2      PHE  22  58.290   1.716  -1.883
  159    HZ   PHE  22           HZ       PHE  22  58.473  -0.121  -3.539
  160    H    LYS  23           HN       LYS  23  57.700  -1.689   4.261
  161    HA   LYS  23           HA       LYS  23  59.793  -2.219   6.105
  162   1HB   LYS  23           HB2      LYS  23  57.282  -1.099   6.262
  163   2HB   LYS  23           HB1      LYS  23  57.076  -2.595   7.174
  164   1HG   LYS  23           HG2      LYS  23  59.407  -0.726   7.641
  165   2HG   LYS  23           HG1      LYS  23  57.884  -0.573   8.516
  166   1HD   LYS  23           HD2      LYS  23  58.301  -3.205   8.871
  167   2HD   LYS  23           HD1      LYS  23  59.978  -2.680   8.715
  168   1HE   LYS  23           HE2      LYS  23  59.909  -1.417  10.644
  169   2HE   LYS  23           HE1      LYS  23  58.187  -1.073  10.483
  170   1HZ   LYS  23           HZ2      LYS  23  58.490  -3.829  10.786
  171   2HZ   LYS  23           HZ1      LYS  23  59.427  -3.084  11.991
  172   3HZ   LYS  23           HZ3      LYS  23  57.773  -2.730  11.865
  173    H    ALA  24           HN       ALA  24  57.312  -4.317   4.758
  174    HA   ALA  24           HA       ALA  24  57.501  -6.464   6.617
  175   1HB   ALA  24           HB3      ALA  24  56.158  -5.988   4.208
  176   2HB   ALA  24           HB2      ALA  24  57.186  -7.381   3.871
  177   3HB   ALA  24           HB1      ALA  24  56.034  -7.438   5.204
  178    H    ALA  25           HN       ALA  25  59.456  -5.663   3.764
  179    HA   ALA  25           HA       ALA  25  61.061  -8.085   3.954
  180   1HB   ALA  25           HB1      ALA  25  60.644  -6.455   1.911
  181   2HB   ALA  25           HB3      ALA  25  62.036  -5.606   2.578
  182   3HB   ALA  25           HB2      ALA  25  62.187  -7.292   2.082
  183    H    PHE  26           HN       PHE  26  61.411  -4.714   5.010
  184    HA   PHE  26           HA       PHE  26  64.077  -4.681   5.829
  185   1HB   PHE  26           HB2      PHE  26  62.366  -2.799   6.004
  186   2HB   PHE  26           HB1      PHE  26  61.827  -3.549   7.507
  187    HD1  PHE  26           HD1      PHE  26  65.022  -2.533   5.816
  188    HD2  PHE  26           HD2      PHE  26  62.820  -2.841   9.491
  189    HE1  PHE  26           HE1      PHE  26  66.892  -1.444   7.026
  190    HE2  PHE  26           HE2      PHE  26  64.691  -1.752  10.703
  191    HZ   PHE  26           HZ       PHE  26  66.726  -1.053   9.470
  192    H    ASP  27           HN       ASP  27  61.487  -5.230   8.233
  193    HA   ASP  27           HA       ASP  27  63.167  -6.449  10.151
  194   1HB   ASP  27           HB2      ASP  27  60.285  -6.157   9.718
  195   2HB   ASP  27           HB1      ASP  27  60.700  -7.664  10.537
  196    H    MET  28           HN       MET  28  61.759  -7.752   7.246
  197    HA   MET  28           HA       MET  28  61.797 -10.522   7.867
  198   1HB   MET  28           HB2      MET  28  61.328  -8.954   5.587
  199   2HB   MET  28           HB1      MET  28  62.674 -10.005   5.146
  200   1HG   MET  28           HG2      MET  28  61.316 -11.939   6.096
  201   2HG   MET  28           HG1      MET  28  59.950 -10.825   6.173
  202   1HE   MET  28           HE1      MET  28  62.481 -12.693   4.297
  203   2HE   MET  28           HE3      MET  28  62.065 -12.624   2.579
  204   3HE   MET  28           HE2      MET  28  62.876 -11.261   3.349
  205    H    PHE  29           HN       PHE  29  64.381  -8.404   6.623
  206    HA   PHE  29           HA       PHE  29  66.307 -10.624   6.636
  207   1HB   PHE  29           HB2      PHE  29  67.043  -7.716   6.360
  208   2HB   PHE  29           HB1      PHE  29  67.816  -9.125   5.635
  209    HD1  PHE  29           HD1      PHE  29  66.208 -10.578   4.075
  210    HD2  PHE  29           HD2      PHE  29  65.640  -6.427   5.022
  211    HE1  PHE  29           HE1      PHE  29  64.794 -10.311   2.055
  212    HE2  PHE  29           HE2      PHE  29  64.227  -6.160   3.001
  213    HZ   PHE  29           HZ       PHE  29  63.804  -8.100   1.518
  214    H    ASP  30           HN       ASP  30  65.640  -7.710   8.566
  215    HA   ASP  30           HA       ASP  30  67.562  -8.766  10.603
  216   1HB   ASP  30           HB2      ASP  30  68.289  -6.606   9.669
  217   2HB   ASP  30           HB1      ASP  30  66.729  -5.894  10.083
  218    H    ALA  31           HN       ALA  31  65.438 -10.027  11.108
  219    HA   ALA  31           HA       ALA  31  63.107  -8.875  12.122
  220   1HB   ALA  31           HB2      ALA  31  63.789 -11.380  11.929
  221   2HB   ALA  31           HB1      ALA  31  64.428 -11.171  13.560
  222   3HB   ALA  31           HB3      ALA  31  62.711 -10.908  13.245
  223    H    ASP  32           HN       ASP  32  65.777  -9.946  14.252
  224    HA   ASP  32           HA       ASP  32  64.874  -8.047  16.304
  225   1HB   ASP  32           HB2      ASP  32  67.015  -8.995  17.480
  226   2HB   ASP  32           HB1      ASP  32  65.609 -10.042  17.287
  227    H    GLY  33           HN       GLY  33  68.309  -8.430  16.088
  228   1HA   GLY  33           HA2      GLY  33  69.976  -6.811  15.834
  229   2HA   GLY  33           HA1      GLY  33  69.079  -6.360  14.381
  230    H    GLY  34           HN       GLY  34  70.142  -4.245  15.383
  231   1HA   GLY  34           HA2      GLY  34  68.502  -3.034  17.506
  232   2HA   GLY  34           HA1      GLY  34  69.866  -2.270  16.689
  233    H    GLY  35           HN       GLY  35  67.582  -3.749  14.597
  234   1HA   GLY  35           HA2      GLY  35  65.593  -2.744  13.614
  235   2HA   GLY  35           HA1      GLY  35  66.140  -1.173  14.204
  236    H    ASP  36           HN       ASP  36  68.450  -3.310  12.722
  237    HA   ASP  36           HA       ASP  36  68.160  -2.100  10.061
  238   1HB   ASP  36           HB2      ASP  36  70.666  -1.373  10.224
  239   2HB   ASP  36           HB1      ASP  36  69.431  -0.316  10.911
  240    H    ILE  37           HN       ILE  37  69.202  -3.353   8.479
  241    HA   ILE  37           HA       ILE  37  70.486  -5.836   9.523
  242    HB   ILE  37           HB       ILE  37  69.182  -6.972   8.079
  243   1HG1  ILE  37          HG12      ILE  37  71.024  -6.461   6.397
  244   2HG1  ILE  37          HG11      ILE  37  69.444  -6.821   5.698
  245   1HG2  ILE  37          HG22      ILE  37  67.617  -5.041   8.507
  246   2HG2  ILE  37          HG21      ILE  37  68.165  -4.340   6.984
  247   3HG2  ILE  37          HG23      ILE  37  67.330  -5.892   6.989
  248   1HD1  ILE  37          HD13      ILE  37  69.588  -4.008   6.260
  249   2HD1  ILE  37          HD12      ILE  37  71.011  -4.478   5.331
  250   3HD1  ILE  37          HD11      ILE  37  69.398  -4.808   4.701
  251    H    SER  38           HN       SER  38  72.503  -6.472   8.698
  252    HA   SER  38           HA       SER  38  74.301  -4.405   7.909
  253   1HB   SER  38           HB2      SER  38  74.848  -6.709   8.926
  254   2HB   SER  38           HB1      SER  38  74.710  -7.334   7.285
  255    HG   SER  38           HG       SER  38  76.287  -5.734   6.691
  256    H    THR  39           HN       THR  39  75.124  -3.847   5.835
  257    HA   THR  39           HA       THR  39  73.288  -4.125   3.656
  258    HB   THR  39           HB       THR  39  74.817  -2.875   2.369
  259    HG1  THR  39           HG1      THR  39  76.712  -4.119   4.032
  260   1HG2  THR  39          HG21      THR  39  74.451  -2.221   5.152
  261   2HG2  THR  39          HG23      THR  39  76.015  -1.623   4.603
  262   3HG2  THR  39          HG22      THR  39  74.542  -1.136   3.766
  263    H    LYS  40           HN       LYS  40  75.826  -6.172   4.807
  264    HA   LYS  40           HA       LYS  40  76.529  -7.505   2.392
  265   1HB   LYS  40           HB2      LYS  40  77.228  -9.368   3.810
  266   2HB   LYS  40           HB1      LYS  40  77.685  -7.851   4.584
  267   1HG   LYS  40           HG2      LYS  40  76.074  -8.046   6.238
  268   2HG   LYS  40           HG1      LYS  40  75.009  -9.026   5.232
  269   1HD   LYS  40           HD2      LYS  40  77.479 -10.437   5.586
  270   2HD   LYS  40           HD1      LYS  40  76.891  -9.926   7.167
  271   1HE   LYS  40           HE2      LYS  40  74.784 -10.975   5.402
  272   2HE   LYS  40           HE1      LYS  40  76.019 -12.162   5.823
  273   1HZ   LYS  40           HZ3      LYS  40  75.698 -11.576   8.163
  274   2HZ   LYS  40           HZ2      LYS  40  74.458 -10.500   7.725
  275   3HZ   LYS  40           HZ1      LYS  40  74.272 -12.167   7.460
  276    H    ALA  41           HN       ALA  41  73.677  -7.638   4.385
  277    HA   ALA  41           HA       ALA  41  72.656 -10.049   3.018
  278   1HB   ALA  41           HB1      ALA  41  71.442  -8.237   5.126
  279   2HB   ALA  41           HB3      ALA  41  70.653  -9.677   4.479
  280   3HB   ALA  41           HB2      ALA  41  72.155  -9.828   5.393
  281    H    LEU  42           HN       LEU  42  72.495  -6.597   2.753
  282    HA   LEU  42           HA       LEU  42  70.023  -6.099   1.600
  283   1HB   LEU  42           HB2      LEU  42  72.687  -4.915   1.410
  284   2HB   LEU  42           HB1      LEU  42  71.790  -4.744  -0.096
  285    HG   LEU  42           HG       LEU  42  71.231  -2.819   1.176
  286   1HD1  LEU  42          HD12      LEU  42  69.279  -4.742   0.564
  287   2HD1  LEU  42          HD11      LEU  42  68.864  -4.155   2.175
  288   3HD1  LEU  42          HD13      LEU  42  69.020  -3.019   0.835
  289   1HD2  LEU  42          HD21      LEU  42  71.416  -4.721   3.428
  290   2HD2  LEU  42          HD23      LEU  42  71.816  -3.003   3.365
  291   3HD2  LEU  42          HD22      LEU  42  70.140  -3.512   3.581
  292    H    GLY  43           HN       GLY  43  72.858  -7.577   0.048
  293   1HA   GLY  43           HA2      GLY  43  72.003  -7.744  -2.599
  294   2HA   GLY  43           HA1      GLY  43  72.947  -9.013  -1.816
  295    H    THR  44           HN       THR  44  71.207 -10.037   0.033
  296    HA   THR  44           HA       THR  44  69.479 -11.679  -1.556
  297    HB   THR  44           HB       THR  44  69.613 -11.148   1.425
  298    HG1  THR  44           HG1      THR  44  70.211 -13.544   1.046
  299   1HG2  THR  44          HG21      THR  44  67.668 -12.718  -0.199
  300   2HG2  THR  44          HG23      THR  44  68.255 -13.454   1.291
  301   3HG2  THR  44          HG22      THR  44  67.439 -11.892   1.342
  302    H    VAL  45           HN       VAL  45  68.971  -8.746   0.333
  303    HA   VAL  45           HA       VAL  45  66.109  -8.693   0.170
  304    HB   VAL  45           HB       VAL  45  68.071  -6.384   0.353
  305   1HG1  VAL  45          HG13      VAL  45  65.104  -6.637   0.557
  306   2HG1  VAL  45          HG12      VAL  45  65.910  -5.528   1.665
  307   3HG1  VAL  45          HG11      VAL  45  66.076  -5.309  -0.078
  308   1HG2  VAL  45          HG23      VAL  45  67.004  -8.362   2.309
  309   2HG2  VAL  45          HG22      VAL  45  68.562  -7.538   2.285
  310   3HG2  VAL  45          HG21      VAL  45  67.123  -6.689   2.850
  311    H    MET  46           HN       MET  46  68.599  -8.058  -2.144
  312    HA   MET  46           HA       MET  46  67.191  -6.246  -3.857
  313   1HB   MET  46           HB2      MET  46  69.234  -8.343  -4.648
  314   2HB   MET  46           HB1      MET  46  68.804  -6.899  -5.564
  315   1HG   MET  46           HG2      MET  46  70.119  -6.981  -2.835
  316   2HG   MET  46           HG1      MET  46  70.863  -6.460  -4.347
  317   1HE   MET  46           HE1      MET  46  71.042  -4.268  -5.079
  318   2HE   MET  46           HE3      MET  46  70.591  -2.882  -4.076
  319   3HE   MET  46           HE2      MET  46  71.611  -4.157  -3.414
  320    H    ARG  47           HN       ARG  47  67.853  -9.675  -4.634
  321    HA   ARG  47           HA       ARG  47  65.669  -9.843  -6.487
  322   1HB   ARG  47           HB2      ARG  47  67.622 -11.369  -6.540
  323   2HB   ARG  47           HB1      ARG  47  67.096 -12.080  -5.013
  324   1HG   ARG  47           HG2      ARG  47  65.276 -13.145  -5.973
  325   2HG   ARG  47           HG1      ARG  47  65.140 -11.965  -7.278
  326   1HD   ARG  47           HD2      ARG  47  66.811 -12.966  -8.541
  327   2HD   ARG  47           HD1      ARG  47  67.607 -13.659  -7.129
  328    HE   ARG  47           HE       ARG  47  65.483 -15.183  -7.057
  329   1HH1  ARG  47          HH11      ARG  47  63.869 -15.181  -9.111
  330   2HH1  ARG  47          HH12      ARG  47  64.669 -15.845 -10.497
  331   1HH2  ARG  47          HH21      ARG  47  67.852 -15.459  -9.174
  332   2HH2  ARG  47          HH22      ARG  47  66.924 -16.002 -10.533
  333    H    MET  48           HN       MET  48  65.694  -9.791  -3.097
  334    HA   MET  48           HA       MET  48  63.475 -11.587  -2.607
  335   1HB   MET  48           HB2      MET  48  65.151  -9.766  -1.058
  336   2HB   MET  48           HB1      MET  48  63.462  -9.707  -0.550
  337   1HG   MET  48           HG2      MET  48  64.940 -12.314  -0.957
  338   2HG   MET  48           HG1      MET  48  64.908 -11.477   0.595
  339   1HE   MET  48           HE3      MET  48  62.817 -10.533   1.588
  340   2HE   MET  48           HE2      MET  48  61.792 -10.154   0.207
  341   3HE   MET  48           HE1      MET  48  61.197 -11.233   1.465
  342    H    LEU  49           HN       LEU  49  63.731  -8.342  -3.785
  343    HA   LEU  49           HA       LEU  49  60.787  -7.988  -3.386
  344   1HB   LEU  49           HB2      LEU  49  62.673  -5.747  -4.090
  345   2HB   LEU  49           HB1      LEU  49  61.103  -5.660  -3.290
  346    HG   LEU  49           HG       LEU  49  63.592  -6.908  -2.093
  347   1HD1  LEU  49          HD11      LEU  49  62.493  -4.165  -2.090
  348   2HD1  LEU  49          HD13      LEU  49  62.917  -4.794  -0.499
  349   3HD1  LEU  49          HD12      LEU  49  64.136  -4.718  -1.771
  350   1HD2  LEU  49          HD22      LEU  49  61.269  -7.783  -1.425
  351   2HD2  LEU  49          HD21      LEU  49  62.302  -7.212  -0.114
  352   3HD2  LEU  49          HD23      LEU  49  60.996  -6.191  -0.717
  353    H    GLY  50           HN       GLY  50  63.424  -7.992  -5.708
  354   1HA   GLY  50           HA2      GLY  50  62.520  -8.855  -7.976
  355   2HA   GLY  50           HA1      GLY  50  61.454  -7.453  -7.888
  356    H    GLN  51           HN       GLN  51  64.840  -7.525  -6.855
  357    HA   GLN  51           HA       GLN  51  65.439  -5.611  -9.077
  358   1HB   GLN  51           HB2      GLN  51  65.515  -5.075  -6.362
  359   2HB   GLN  51           HB1      GLN  51  67.196  -5.457  -6.732
  360   1HG   GLN  51           HG2      GLN  51  67.477  -3.513  -7.836
  361   2HG   GLN  51           HG1      GLN  51  66.022  -3.779  -8.796
  362   1HE2  GLN  51          HE22      GLN  51  65.875  -1.349  -5.532
  363   2HE2  GLN  51          HE21      GLN  51  67.296  -2.188  -5.929
  364    H    ASN  52           HN       ASN  52  67.112  -6.207 -10.389
  365    HA   ASN  52           HA       ASN  52  69.022  -8.265  -9.374
  366   1HB   ASN  52           HB2      ASN  52  67.064  -8.619 -11.419
  367   2HB   ASN  52           HB1      ASN  52  68.648  -8.589 -12.196
  368   1HD2  ASN  52          HD22      ASN  52  69.789 -11.394 -10.049
  369   2HD2  ASN  52          HD21      ASN  52  70.319  -9.818 -10.392
  370    HA   PRO  53           HA       PRO  53  71.085  -4.621 -11.408
  371   1HB   PRO  53           HB2      PRO  53  72.397  -3.735  -9.159
  372   2HB   PRO  53           HB1      PRO  53  70.790  -3.167  -9.643
  373   1HG   PRO  53           HG2      PRO  53  71.534  -5.046  -7.450
  374   2HG   PRO  53           HG1      PRO  53  70.123  -3.983  -7.585
  375   1HD   PRO  53           HD2      PRO  53  70.148  -6.771  -8.065
  376   2HD   PRO  53           HD1      PRO  53  68.849  -5.646  -8.516
  377    H    THR  54           HN       THR  54  73.607  -4.209 -11.247
  378    HA   THR  54           HA       THR  54  74.895  -6.862 -11.340
  379    HB   THR  54           HB       THR  54  76.887  -5.133 -11.951
  380    HG1  THR  54           HG1      THR  54  75.623  -3.545 -13.301
  381   1HG2  THR  54          HG21      THR  54  74.756  -6.502 -13.486
  382   2HG2  THR  54          HG23      THR  54  75.650  -5.258 -14.360
  383   3HG2  THR  54          HG22      THR  54  76.509  -6.620 -13.641
  384    H    LYS  55           HN       LYS  55  76.537  -7.511  -9.932
  385    HA   LYS  55           HA       LYS  55  76.555  -6.672  -7.275
  386   1HB   LYS  55           HB2      LYS  55  78.078  -8.452  -8.868
  387   2HB   LYS  55           HB1      LYS  55  79.236  -7.434  -8.012
  388   1HG   LYS  55           HG2      LYS  55  78.283  -8.003  -5.878
  389   2HG   LYS  55           HG1      LYS  55  76.911  -8.806  -6.642
  390   1HD   LYS  55           HD2      LYS  55  78.061 -10.734  -6.777
  391   2HD   LYS  55           HD1      LYS  55  79.365  -9.931  -7.652
  392   1HE   LYS  55           HE2      LYS  55  80.159  -9.061  -5.381
  393   2HE   LYS  55           HE1      LYS  55  79.037 -10.216  -4.660
  394   1HZ   LYS  55           HZ2      LYS  55  80.569 -11.460  -6.688
  395   2HZ   LYS  55           HZ1      LYS  55  81.600 -10.716  -5.561
  396   3HZ   LYS  55           HZ3      LYS  55  80.456 -11.854  -5.040
  397    H    GLU  56           HN       GLU  56  78.734  -5.555  -9.877
  398    HA   GLU  56           HA       GLU  56  80.320  -3.790  -8.364
  399   1HB   GLU  56           HB2      GLU  56  79.335  -3.240 -11.175
  400   2HB   GLU  56           HB1      GLU  56  80.839  -2.685 -10.438
  401   1HG   GLU  56           HG2      GLU  56  81.107  -5.357 -10.078
  402   2HG   GLU  56           HG1      GLU  56  80.154  -5.344 -11.563
  403    H    GLU  57           HN       GLU  57  77.128  -3.219  -9.837
  404    HA   GLU  57           HA       GLU  57  77.049  -0.433  -8.998
  405   1HB   GLU  57           HB2      GLU  57  75.380  -2.263 -10.521
  406   2HB   GLU  57           HB1      GLU  57  74.415  -1.297  -9.404
  407   1HG   GLU  57           HG2      GLU  57  74.707  -0.173 -11.607
  408   2HG   GLU  57           HG1      GLU  57  75.400   0.762 -10.283
  409    H    LEU  58           HN       LEU  58  76.309  -3.478  -7.512
  410    HA   LEU  58           HA       LEU  58  74.457  -2.471  -5.530
  411   1HB   LEU  58           HB2      LEU  58  75.148  -4.960  -6.317
  412   2HB   LEU  58           HB1      LEU  58  76.161  -4.819  -4.881
  413    HG   LEU  58           HG       LEU  58  73.286  -3.980  -4.720
  414   1HD1  LEU  58          HD13      LEU  58  74.332  -6.746  -5.079
  415   2HD1  LEU  58          HD12      LEU  58  73.114  -6.513  -3.826
  416   3HD1  LEU  58          HD11      LEU  58  72.755  -6.078  -5.497
  417   1HD2  LEU  58          HD22      LEU  58  74.869  -3.580  -2.846
  418   2HD2  LEU  58          HD21      LEU  58  73.594  -4.710  -2.390
  419   3HD2  LEU  58          HD23      LEU  58  75.206  -5.311  -2.778
  420    H    ASP  59           HN       ASP  59  77.956  -3.215  -5.451
  421    HA   ASP  59           HA       ASP  59  78.392  -2.444  -2.751
  422   1HB   ASP  59           HB2      ASP  59  80.720  -2.381  -3.294
  423   2HB   ASP  59           HB1      ASP  59  80.020  -3.636  -4.317
  424    H    ALA  60           HN       ALA  60  78.578  -0.512  -5.751
  425    HA   ALA  60           HA       ALA  60  79.339   1.928  -4.440
  426   1HB   ALA  60           HB3      ALA  60  78.843   1.083  -7.091
  427   2HB   ALA  60           HB2      ALA  60  77.727   2.415  -6.788
  428   3HB   ALA  60           HB1      ALA  60  79.460   2.650  -6.570
  429    H    ILE  61           HN       ILE  61  76.202   0.479  -5.219
  430    HA   ILE  61           HA       ILE  61  74.563   2.708  -4.546
  431    HB   ILE  61           HB       ILE  61  74.106  -0.279  -4.487
  432   1HG1  ILE  61          HG12      ILE  61  72.764   1.834  -6.178
  433   2HG1  ILE  61          HG11      ILE  61  74.318   1.139  -6.639
  434   1HG2  ILE  61          HG22      ILE  61  72.153   1.941  -3.813
  435   2HG2  ILE  61          HG21      ILE  61  71.679   0.281  -4.175
  436   3HG2  ILE  61          HG23      ILE  61  72.665   0.625  -2.754
  437   1HD1  ILE  61          HD11      ILE  61  72.921  -1.122  -6.059
  438   2HD1  ILE  61          HD13      ILE  61  71.622  -0.086  -6.654
  439   3HD1  ILE  61          HD12      ILE  61  73.018  -0.425  -7.676
  440    H    ILE  62           HN       ILE  62  75.900   0.094  -2.537
  441    HA   ILE  62           HA       ILE  62  74.578   0.819  -0.107
  442    HB   ILE  62           HB       ILE  62  77.298  -0.476  -0.484
  443   1HG1  ILE  62          HG12      ILE  62  74.851  -2.033   0.195
  444   2HG1  ILE  62          HG11      ILE  62  74.971  -1.435  -1.461
  445   1HG2  ILE  62          HG22      ILE  62  76.634   0.482   1.818
  446   2HG2  ILE  62          HG21      ILE  62  75.407  -0.786   1.851
  447   3HG2  ILE  62          HG23      ILE  62  77.116  -1.214   1.761
  448   1HD1  ILE  62          HD13      ILE  62  77.524  -2.483  -0.690
  449   2HD1  ILE  62          HD12      ILE  62  76.288  -3.687  -0.319
  450   3HD1  ILE  62          HD11      ILE  62  76.444  -3.058  -1.959
  451    H    GLU  63           HN       GLU  63  77.633   1.883  -1.568
  452    HA   GLU  63           HA       GLU  63  78.512   3.455   0.670
  453   1HB   GLU  63           HB2      GLU  63  79.538   2.757  -1.827
  454   2HB   GLU  63           HB1      GLU  63  79.334   4.507  -1.924
  455   1HG   GLU  63           HG2      GLU  63  80.565   3.318   0.540
  456   2HG   GLU  63           HG1      GLU  63  81.550   3.497  -0.913
  457    H    GLU  64           HN       GLU  64  76.185   4.031  -1.866
  458    HA   GLU  64           HA       GLU  64  76.107   6.928  -1.233
  459   1HB   GLU  64           HB2      GLU  64  74.735   5.238  -3.336
  460   2HB   GLU  64           HB1      GLU  64  74.366   6.945  -3.085
  461   1HG   GLU  64           HG2      GLU  64  76.991   7.214  -3.248
  462   2HG   GLU  64           HG1      GLU  64  76.882   5.684  -4.118
  463    H    VAL  65           HN       VAL  65  74.592   4.023  -0.296
  464    HA   VAL  65           HA       VAL  65  72.055   5.356   0.448
  465    HB   VAL  65           HB       VAL  65  73.046   2.502   0.610
  466   1HG1  VAL  65          HG12      VAL  65  70.793   3.846   2.030
  467   2HG1  VAL  65          HG11      VAL  65  70.470   2.262   1.321
  468   3HG1  VAL  65          HG13      VAL  65  71.754   2.449   2.516
  469   1HG2  VAL  65          HG23      VAL  65  71.572   4.069  -1.284
  470   2HG2  VAL  65          HG22      VAL  65  72.007   2.364  -1.384
  471   3HG2  VAL  65          HG21      VAL  65  70.492   2.843  -0.620
  472    H    ASP  66           HN       ASP  66  75.074   4.332   1.871
  473    HA   ASP  66           HA       ASP  66  74.019   4.714   4.614
  474   1HB   ASP  66           HB2      ASP  66  75.942   3.027   3.591
  475   2HB   ASP  66           HB1      ASP  66  76.917   4.322   4.288
  476    H    GLU  67           HN       GLU  67  73.633   7.076   3.779
  477    HA   GLU  67           HA       GLU  67  75.899   8.822   3.469
  478   1HB   GLU  67           HB2      GLU  67  74.282  10.641   3.798
  479   2HB   GLU  67           HB1      GLU  67  73.606   9.418   2.724
  480   1HG   GLU  67           HG2      GLU  67  71.994   8.815   4.216
  481   2HG   GLU  67           HG1      GLU  67  73.084   8.964   5.595
  482    H    ASP  68           HN       ASP  68  74.550   7.274   6.204
  483    HA   ASP  68           HA       ASP  68  75.402   9.303   8.138
  484   1HB   ASP  68           HB2      ASP  68  74.756   6.433   8.801
  485   2HB   ASP  68           HB1      ASP  68  74.523   7.870   9.796
  486    H    GLY  69           HN       GLY  69  76.906   6.782   6.400
  487   1HA   GLY  69           HA2      GLY  69  79.066   5.875   6.524
  488   2HA   GLY  69           HA1      GLY  69  79.487   7.302   7.475
  489    H    SER  70           HN       SER  70  76.888   5.474   8.747
  490    HA   SER  70           HA       SER  70  78.414   4.814  11.125
  491   1HB   SER  70           HB2      SER  70  76.151   3.373  11.431
  492   2HB   SER  70           HB1      SER  70  76.226   5.105  11.741
  493    HG   SER  70           HG       SER  70  74.520   4.270  10.266
  494    H    GLY  71           HN       GLY  71  77.325   3.038   8.270
  495   1HA   GLY  71           HA2      GLY  71  78.720   1.143   7.510
  496   2HA   GLY  71           HA1      GLY  71  78.986   0.737   9.206
  497    H    THR  72           HN       THR  72  75.800   1.727   8.677
  498    HA   THR  72           HA       THR  72  74.849  -1.014   8.052
  499    HB   THR  72           HB       THR  72  73.182  -0.684  10.025
  500    HG1  THR  72           HG1      THR  72  73.553   0.996  11.196
  501   1HG2  THR  72          HG23      THR  72  75.963  -1.644   9.961
  502   2HG2  THR  72          HG22      THR  72  75.358  -1.305  11.582
  503   3HG2  THR  72          HG21      THR  72  74.507  -2.450  10.545
  504    H    ILE  73           HN       ILE  73  72.330  -0.926   7.889
  505    HA   ILE  73           HA       ILE  73  71.537   1.726   6.748
  506    HB   ILE  73           HB       ILE  73  71.014  -1.061   5.696
  507   1HG1  ILE  73          HG12      ILE  73  72.474   1.408   4.769
  508   2HG1  ILE  73          HG11      ILE  73  73.037  -0.262   4.803
  509   1HG2  ILE  73          HG22      ILE  73  69.733   1.565   4.862
  510   2HG2  ILE  73          HG21      ILE  73  69.531   0.021   4.036
  511   3HG2  ILE  73          HG23      ILE  73  68.908   0.232   5.672
  512   1HD1  ILE  73          HD13      ILE  73  70.855   0.781   2.977
  513   2HD1  ILE  73          HD12      ILE  73  72.532   0.532   2.493
  514   3HD1  ILE  73          HD11      ILE  73  71.536  -0.845   2.969
  515    H    ASP  74           HN       ASP  74  69.212   2.166   6.877
  516    HA   ASP  74           HA       ASP  74  67.752   0.477   8.856
  517   1HB   ASP  74           HB2      ASP  74  68.276   3.445   8.969
  518   2HB   ASP  74           HB1      ASP  74  66.850   2.751   9.743
  519    H    PHE  75           HN       PHE  75  65.333   1.268   8.886
  520    HA   PHE  75           HA       PHE  75  64.189   0.864   6.360
  521   1HB   PHE  75           HB2      PHE  75  63.076   0.896   8.705
  522   2HB   PHE  75           HB1      PHE  75  62.862   2.623   8.418
  523    HD1  PHE  75           HD2      PHE  75  62.730  -0.241   6.020
  524    HD2  PHE  75           HD1      PHE  75  60.571   2.918   7.968
  525    HE1  PHE  75           HE2      PHE  75  60.752  -0.721   4.602
  526    HE2  PHE  75           HE1      PHE  75  58.591   2.439   6.551
  527    HZ   PHE  75           HZ       PHE  75  58.682   0.621   4.868
  528    H    GLU  76           HN       GLU  76  65.120   3.914   7.918
  529    HA   GLU  76           HA       GLU  76  63.966   5.700   6.038
  530   1HB   GLU  76           HB2      GLU  76  66.626   6.087   7.438
  531   2HB   GLU  76           HB1      GLU  76  65.527   7.343   6.869
  532   1HG   GLU  76           HG2      GLU  76  65.086   5.393   9.141
  533   2HG   GLU  76           HG1      GLU  76  65.155   7.152   9.228
  534    H    GLU  77           HN       GLU  77  67.402   4.672   6.138
  535    HA   GLU  77           HA       GLU  77  67.937   5.607   3.472
  536   1HB   GLU  77           HB2      GLU  77  69.429   3.463   5.013
  537   2HB   GLU  77           HB1      GLU  77  70.056   4.445   3.690
  538   1HG   GLU  77           HG2      GLU  77  70.054   6.417   4.996
  539   2HG   GLU  77           HG1      GLU  77  68.982   5.714   6.207
  540    H    PHE  78           HN       PHE  78  66.167   2.953   4.572
  541    HA   PHE  78           HA       PHE  78  66.847   0.994   2.576
  542   1HB   PHE  78           HB2      PHE  78  65.193   1.064   4.797
  543   2HB   PHE  78           HB1      PHE  78  64.049   0.976   3.457
  544    HD1  PHE  78           HD1      PHE  78  67.013  -0.661   4.994
  545    HD2  PHE  78           HD2      PHE  78  63.804  -1.012   2.161
  546    HE1  PHE  78           HE1      PHE  78  67.518  -3.074   4.723
  547    HE2  PHE  78           HE2      PHE  78  64.310  -3.426   1.887
  548    HZ   PHE  78           HZ       PHE  78  66.166  -4.456   3.170
  549    H    LEU  79           HN       LEU  79  63.966   3.112   2.800
  550    HA   LEU  79           HA       LEU  79  63.018   2.628   0.179
  551   1HB   LEU  79           HB2      LEU  79  62.826   5.245   1.706
  552   2HB   LEU  79           HB1      LEU  79  61.757   4.701   0.412
  553    HG   LEU  79           HG       LEU  79  62.123   3.056   2.914
  554   1HD1  LEU  79          HD12      LEU  79  60.660   5.606   2.558
  555   2HD1  LEU  79          HD11      LEU  79  59.734   4.302   3.299
  556   3HD1  LEU  79          HD13      LEU  79  61.244   4.839   4.034
  557   1HD2  LEU  79          HD23      LEU  79  60.696   2.778   0.473
  558   2HD2  LEU  79          HD22      LEU  79  60.624   1.727   1.887
  559   3HD2  LEU  79          HD21      LEU  79  59.499   3.076   1.732
  560    H    VAL  80           HN       VAL  80  65.757   4.417   1.274
  561    HA   VAL  80           HA       VAL  80  66.024   6.186  -0.995
  562    HB   VAL  80           HB       VAL  80  67.993   5.152   1.061
  563   1HG1  VAL  80          HG11      VAL  80  68.486   6.454  -1.500
  564   2HG1  VAL  80          HG13      VAL  80  69.075   7.427  -0.150
  565   3HG1  VAL  80          HG12      VAL  80  69.640   5.770  -0.356
  566   1HG2  VAL  80          HG22      VAL  80  66.018   7.167   1.078
  567   2HG2  VAL  80          HG21      VAL  80  67.289   6.915   2.275
  568   3HG2  VAL  80          HG23      VAL  80  67.560   8.011   0.922
  569    H    MET  81           HN       MET  81  67.642   3.101  -0.153
  570    HA   MET  81           HA       MET  81  69.149   2.808  -2.514
  571   1HB   MET  81           HB2      MET  81  69.102   1.329  -0.385
  572   2HB   MET  81           HB1      MET  81  67.789   0.466  -1.186
  573   1HG   MET  81           HG2      MET  81  69.207  -0.061  -3.078
  574   2HG   MET  81           HG1      MET  81  70.502   0.957  -2.445
  575   1HE   MET  81           HE1      MET  81  71.009   0.864  -0.029
  576   2HE   MET  81           HE3      MET  81  71.392  -0.613   0.866
  577   3HE   MET  81           HE2      MET  81  72.387  -0.124  -0.505
  578    H    MET  82           HN       MET  82  65.722   2.299  -1.946
  579    HA   MET  82           HA       MET  82  65.186   0.798  -4.342
  580   1HB   MET  82           HB2      MET  82  63.430   2.559  -2.613
  581   2HB   MET  82           HB1      MET  82  62.817   1.623  -3.977
  582   1HG   MET  82           HG2      MET  82  64.277   0.480  -1.578
  583   2HG   MET  82           HG1      MET  82  62.538   0.384  -1.860
  584   1HE   MET  82           HE2      MET  82  65.658  -1.127  -1.895
  585   2HE   MET  82           HE1      MET  82  65.771  -2.332  -3.178
  586   3HE   MET  82           HE3      MET  82  66.108  -0.629  -3.525
  587    H    VAL  83           HN       VAL  83  64.352   4.220  -3.660
  588    HA   VAL  83           HA       VAL  83  63.785   4.939  -6.326
  589    HB   VAL  83           HB       VAL  83  65.102   6.773  -4.310
  590   1HG1  VAL  83          HG11      VAL  83  64.236   7.198  -6.908
  591   2HG1  VAL  83          HG13      VAL  83  62.859   7.726  -5.940
  592   3HG1  VAL  83          HG12      VAL  83  64.448   8.450  -5.684
  593   1HG2  VAL  83          HG21      VAL  83  62.699   5.254  -4.018
  594   2HG2  VAL  83          HG23      VAL  83  63.324   6.511  -2.950
  595   3HG2  VAL  83          HG22      VAL  83  62.241   6.938  -4.274
  596    H    ARG  84           HN       ARG  84  66.861   4.426  -4.770
  597    HA   ARG  84           HA       ARG  84  68.517   5.915  -6.560
  598   1HB   ARG  84           HB2      ARG  84  68.895   3.733  -4.594
  599   2HB   ARG  84           HB1      ARG  84  70.112   3.820  -5.867
  600   1HG   ARG  84           HG2      ARG  84  70.047   6.410  -5.286
  601   2HG   ARG  84           HG1      ARG  84  69.451   5.817  -3.737
  602   1HD   ARG  84           HD2      ARG  84  71.529   5.210  -3.133
  603   2HD   ARG  84           HD1      ARG  84  71.675   4.194  -4.568
  604    HE   ARG  84           HE       ARG  84  72.599   7.002  -4.338
  605   1HH1  ARG  84          HH21      ARG  84  72.523   7.663  -6.762
  606   2HH1  ARG  84          HH22      ARG  84  73.419   6.577  -7.773
  607   1HH2  ARG  84          HH11      ARG  84  73.583   4.069  -5.386
  608   2HH2  ARG  84          HH12      ARG  84  74.019   4.542  -6.993
  609    H    GLN  85           HN       GLN  85  67.257   2.596  -6.705
  610    HA   GLN  85           HA       GLN  85  68.670   1.972  -9.172
  611   1HB   GLN  85           HB2      GLN  85  67.165   0.540  -7.248
  612   2HB   GLN  85           HB1      GLN  85  66.315   0.349  -8.782
  613   1HG   GLN  85           HG2      GLN  85  69.235  -0.253  -8.232
  614   2HG   GLN  85           HG1      GLN  85  67.966  -1.416  -8.618
  615   1HE2  GLN  85          HE22      GLN  85  70.004  -0.040 -11.664
  616   2HE2  GLN  85          HE21      GLN  85  70.565  -0.256 -10.076
  617    H    MET  86           HN       MET  86  65.447   3.165  -8.326
  618    HA   MET  86           HA       MET  86  64.662   3.158 -11.184
  619   1HB   MET  86           HB2      MET  86  63.157   3.889  -8.654
  620   2HB   MET  86           HB1      MET  86  62.471   3.999 -10.276
  621   1HG   MET  86           HG2      MET  86  63.085   1.546 -10.570
  622   2HG   MET  86           HG1      MET  86  63.430   1.514  -8.840
  623   1HE   MET  86           HE1      MET  86  62.235   1.558  -7.175
  624   2HE   MET  86           HE3      MET  86  60.917   2.734  -7.075
  625   3HE   MET  86           HE2      MET  86  60.566   1.008  -7.061
  626    H    LYS  87           HN       LYS  87  66.806   4.933 -10.113
  627    HA   LYS  87           HA       LYS  87  65.589   7.620 -10.208
  628   1HB   LYS  87           HB2      LYS  87  68.136   6.465  -9.342
  629   2HB   LYS  87           HB1      LYS  87  68.348   7.942 -10.286
  630   1HG   LYS  87           HG2      LYS  87  66.405   7.719  -7.974
  631   2HG   LYS  87           HG1      LYS  87  68.057   8.308  -7.795
  632   1HD   LYS  87           HD2      LYS  87  67.479  10.337  -8.579
  633   2HD   LYS  87           HD1      LYS  87  66.768   9.621 -10.026
  634   1HE   LYS  87           HE2      LYS  87  64.939   8.984  -8.040
  635   2HE   LYS  87           HE1      LYS  87  65.453  10.614  -7.610
  636   1HZ   LYS  87           HZ2      LYS  87  65.127  10.595 -10.355
  637   2HZ   LYS  87           HZ1      LYS  87  63.774   9.784  -9.726
  638   3HZ   LYS  87           HZ3      LYS  87  64.134  11.358  -9.206
  639    H    GLU  88           HN       GLU  88  68.092   5.838 -12.054
  640    HA   GLU  88           HA       GLU  88  68.446   7.694 -14.131
  641   1HB   GLU  88           HB2      GLU  88  68.944   4.846 -13.727
  642   2HB   GLU  88           HB1      GLU  88  68.542   5.212 -15.404
  643   1HG   GLU  88           HG2      GLU  88  70.570   6.826 -13.851
  644   2HG   GLU  88           HG1      GLU  88  71.018   5.392 -14.774
  645    H    ASP  89           HN       ASP  89  66.717   4.717 -14.949
  646    HA   ASP  89           HA       ASP  89  64.491   6.389 -16.033
  647   1HB   ASP  89           HB2      ASP  89  64.443   4.678 -17.952
  648   2HB   ASP  89           HB1      ASP  89  65.759   5.854 -17.973
  649    H    ALA  90           HN       ALA  90  62.669   5.754 -14.996
  650    HA   ALA  90           HA       ALA  90  61.660   3.104 -15.047
  651   1HB   ALA  90           HB3      ALA  90  63.700   3.295 -13.188
  652   2HB   ALA  90           HB2      ALA  90  62.256   3.552 -12.208
  653   3HB   ALA  90           HB1      ALA  90  62.419   2.082 -13.171
   
  No H/Q in entry =         653
  Start of MODEL   38
    1   1H    ALA   1           HT1      ALA   1  72.461  15.717   9.848
    2   2H    ALA   1           HT3      ALA   1  73.556  16.174   8.636
    3   3H    ALA   1           HT2      ALA   1  71.884  16.335   8.374
    4    HA   ALA   1           HA       ALA   1  72.724  14.416   7.191
    5   1HB   ALA   1           HB2      ALA   1  74.317  14.161   9.498
    6   2HB   ALA   1           HB1      ALA   1  73.240  12.764   9.517
    7   3HB   ALA   1           HB3      ALA   1  74.271  13.065   8.118
    8    H    SER   2           HN       SER   2  70.619  15.327   9.602
    9    HA   SER   2           HA       SER   2  69.140  12.847   9.926
   10   1HB   SER   2           HB2      SER   2  69.103  15.408  11.101
   11   2HB   SER   2           HB1      SER   2  67.527  15.214  10.339
   12    HG   SER   2           HG       SER   2  68.788  13.358  12.086
   13    H    MET   3           HN       MET   3  67.479  12.080   8.674
   14    HA   MET   3           HA       MET   3  66.307  11.817   6.638
   15   1HB   MET   3           HB2      MET   3  64.592  13.582   6.344
   16   2HB   MET   3           HB1      MET   3  64.720  13.073   8.028
   17   1HG   MET   3           HG2      MET   3  66.014  15.018   8.601
   18   2HG   MET   3           HG1      MET   3  66.199  15.466   6.906
   19   1HE   MET   3           HE1      MET   3  64.045  14.790   9.801
   20   2HE   MET   3           HE3      MET   3  64.243  16.534  10.031
   21   3HE   MET   3           HE2      MET   3  62.650  15.859   9.693
   22    H    THR   4           HN       THR   4  68.789  12.306   5.831
   23    HA   THR   4           HA       THR   4  69.543  14.621   4.516
   24    HB   THR   4           HB       THR   4  70.791  13.215   2.948
   25    HG1  THR   4           HG1      THR   4  70.255  11.159   2.605
   26   1HG2  THR   4          HG22      THR   4  70.854  12.996   5.773
   27   2HG2  THR   4          HG21      THR   4  71.113  11.373   5.132
   28   3HG2  THR   4          HG23      THR   4  72.172  12.695   4.640
   29    H    ASP   5           HN       ASP   5  69.256  15.379   2.305
   30    HA   ASP   5           HA       ASP   5  66.581  15.538   1.435
   31   1HB   ASP   5           HB2      ASP   5  69.221  16.230   0.333
   32   2HB   ASP   5           HB1      ASP   5  68.005  15.886  -0.898
   33    H    GLN   6           HN       GLN   6  69.041  13.126   0.724
   34    HA   GLN   6           HA       GLN   6  67.883  11.897  -1.544
   35   1HB   GLN   6           HB2      GLN   6  69.300  10.535   0.770
   36   2HB   GLN   6           HB1      GLN   6  69.076   9.865  -0.845
   37   1HG   GLN   6           HG2      GLN   6  70.237  12.515  -1.001
   38   2HG   GLN   6           HG1      GLN   6  71.215  11.469   0.029
   39   1HE2  GLN   6          HE22      GLN   6  72.025   9.193  -2.642
   40   2HE2  GLN   6          HE21      GLN   6  71.793   9.269  -0.962
   41    H    GLN   7           HN       GLN   7  67.184  11.409   1.915
   42    HA   GLN   7           HA       GLN   7  65.160   9.378   1.370
   43   1HB   GLN   7           HB2      GLN   7  65.684  10.991   3.886
   44   2HB   GLN   7           HB1      GLN   7  64.671   9.551   3.776
   45   1HG   GLN   7           HG2      GLN   7  66.596   8.202   3.114
   46   2HG   GLN   7           HG1      GLN   7  67.626   9.633   3.103
   47   1HE2  GLN   7          HE22      GLN   7  67.825   7.788   6.435
   48   2HE2  GLN   7          HE21      GLN   7  67.931   7.228   4.837
   49    H    ALA   8           HN       ALA   8  65.258  12.825   1.412
   50    HA   ALA   8           HA       ALA   8  62.477  13.288   2.061
   51   1HB   ALA   8           HB1      ALA   8  64.669  14.900   1.777
   52   2HB   ALA   8           HB3      ALA   8  63.809  15.230   0.274
   53   3HB   ALA   8           HB2      ALA   8  63.007  15.491   1.824
   54    H    GLU   9           HN       GLU   9  64.271  12.921  -0.995
   55    HA   GLU   9           HA       GLU   9  61.818  13.243  -2.576
   56   1HB   GLU   9           HB2      GLU   9  64.717  12.810  -3.153
   57   2HB   GLU   9           HB1      GLU   9  63.557  12.318  -4.385
   58   1HG   GLU   9           HG2      GLU   9  62.717  14.503  -4.644
   59   2HG   GLU   9           HG1      GLU   9  63.372  15.035  -3.095
   60    H    ALA  10           HN       ALA  10  63.719  10.630  -1.229
   61    HA   ALA  10           HA       ALA  10  62.701   8.512  -2.873
   62   1HB   ALA  10           HB2      ALA  10  64.675   8.260  -1.392
   63   2HB   ALA  10           HB1      ALA  10  63.623   8.402   0.016
   64   3HB   ALA  10           HB3      ALA  10  63.461   7.022  -1.071
   65    H    ARG  11           HN       ARG  11  61.757   9.418   0.469
   66    HA   ARG  11           HA       ARG  11  59.378   7.790   0.416
   67   1HB   ARG  11           HB2      ARG  11  60.631   9.731   2.248
   68   2HB   ARG  11           HB1      ARG  11  58.869   9.695   2.329
   69   1HG   ARG  11           HG2      ARG  11  58.852   7.343   2.803
   70   2HG   ARG  11           HG1      ARG  11  60.570   7.193   2.427
   71   1HD   ARG  11           HD2      ARG  11  60.899   7.448   4.655
   72   2HD   ARG  11           HD1      ARG  11  60.559   9.154   4.370
   73    HE   ARG  11           HE       ARG  11  58.175   8.645   4.976
   74   1HH1  ARG  11          HH11      ARG  11  59.821   5.742   5.048
   75   2HH1  ARG  11          HH12      ARG  11  59.329   5.290   6.647
   76   1HH2  ARG  11          HH21      ARG  11  57.903   8.368   7.364
   77   2HH2  ARG  11          HH22      ARG  11  58.244   6.777   7.958
   78    H    ALA  12           HN       ALA  12  60.124  10.941  -0.795
   79    HA   ALA  12           HA       ALA  12  57.407  11.961  -0.794
   80   1HB   ALA  12           HB1      ALA  12  59.864  12.764  -2.380
   81   2HB   ALA  12           HB3      ALA  12  58.338  13.649  -2.402
   82   3HB   ALA  12           HB2      ALA  12  59.264  13.525  -0.906
   83    H    PHE  13           HN       PHE  13  59.354  10.025  -2.990
   84    HA   PHE  13           HA       PHE  13  57.345  10.235  -5.138
   85   1HB   PHE  13           HB2      PHE  13  59.636  10.107  -5.869
   86   2HB   PHE  13           HB1      PHE  13  59.934   8.684  -4.869
   87    HD1  PHE  13           HD1      PHE  13  57.728   9.889  -7.649
   88    HD2  PHE  13           HD2      PHE  13  59.686   6.547  -5.792
   89    HE1  PHE  13           HE1      PHE  13  56.997   8.426  -9.513
   90    HE2  PHE  13           HE2      PHE  13  58.953   5.083  -7.655
   91    HZ   PHE  13           HZ       PHE  13  57.610   6.022  -9.516
   92    H    LEU  14           HN       LEU  14  58.231   8.066  -2.543
   93    HA   LEU  14           HA       LEU  14  56.504   5.913  -3.602
   94   1HB   LEU  14           HB2      LEU  14  57.921   6.017  -0.926
   95   2HB   LEU  14           HB1      LEU  14  57.316   4.589  -1.767
   96    HG   LEU  14           HG       LEU  14  59.366   6.372  -3.067
   97   1HD1  LEU  14          HD13      LEU  14  59.840   4.138  -1.075
   98   2HD1  LEU  14          HD12      LEU  14  61.083   4.755  -2.164
   99   3HD1  LEU  14          HD11      LEU  14  60.375   5.814  -0.944
  100   1HD2  LEU  14          HD22      LEU  14  57.998   3.893  -3.653
  101   2HD2  LEU  14          HD21      LEU  14  59.078   4.828  -4.686
  102   3HD2  LEU  14          HD23      LEU  14  59.739   3.617  -3.589
  103    H    SER  15           HN       SER  15  54.510   5.359  -2.696
  104    HA   SER  15           HA       SER  15  53.263   7.451  -1.020
  105   1HB   SER  15           HB2      SER  15  51.284   5.638  -1.437
  106   2HB   SER  15           HB1      SER  15  51.672   6.929  -2.573
  107    HG   SER  15           HG       SER  15  52.253   5.443  -3.925
  108    H    GLU  16           HN       GLU  16  52.055   6.843   0.931
  109    HA   GLU  16           HA       GLU  16  53.539   5.201   2.719
  110   1HB   GLU  16           HB2      GLU  16  50.726   6.299   2.803
  111   2HB   GLU  16           HB1      GLU  16  51.380   5.321   4.117
  112   1HG   GLU  16           HG2      GLU  16  52.871   7.721   3.062
  113   2HG   GLU  16           HG1      GLU  16  51.636   7.884   4.310
  114    H    GLU  17           HN       GLU  17  50.887   4.461   0.542
  115    HA   GLU  17           HA       GLU  17  50.165   1.932   1.700
  116   1HB   GLU  17           HB2      GLU  17  49.310   3.502  -0.472
  117   2HB   GLU  17           HB1      GLU  17  49.850   1.981  -1.182
  118   1HG   GLU  17           HG2      GLU  17  48.384   1.403   1.216
  119   2HG   GLU  17           HG1      GLU  17  47.420   2.484   0.208
  120    H    MET  18           HN       MET  18  52.736   2.937  -0.460
  121    HA   MET  18           HA       MET  18  53.437   0.151  -1.125
  122   1HB   MET  18           HB2      MET  18  54.429   2.865  -1.925
  123   2HB   MET  18           HB1      MET  18  55.498   1.478  -2.132
  124   1HG   MET  18           HG2      MET  18  53.955   0.374  -3.577
  125   2HG   MET  18           HG1      MET  18  52.648   1.474  -3.140
  126   1HE   MET  18           HE3      MET  18  55.873   0.799  -4.579
  127   2HE   MET  18           HE2      MET  18  55.129   0.883  -6.173
  128   3HE   MET  18           HE1      MET  18  56.313   2.099  -5.695
  129    H    ILE  19           HN       ILE  19  55.188   2.889   0.397
  130    HA   ILE  19           HA       ILE  19  57.389   1.516   1.388
  131    HB   ILE  19           HB       ILE  19  55.780   3.741   2.664
  132   1HG1  ILE  19          HG12      ILE  19  58.490   4.311   1.776
  133   2HG1  ILE  19          HG11      ILE  19  57.520   3.642   0.463
  134   1HG2  ILE  19          HG21      ILE  19  58.403   2.478   3.501
  135   2HG2  ILE  19          HG23      ILE  19  57.914   4.094   4.011
  136   3HG2  ILE  19          HG22      ILE  19  56.950   2.691   4.477
  137   1HD1  ILE  19          HD11      ILE  19  55.904   5.512   1.907
  138   2HD1  ILE  19          HD13      ILE  19  57.441   6.287   1.528
  139   3HD1  ILE  19          HD12      ILE  19  56.453   5.607   0.235
  140    H    ALA  20           HN       ALA  20  54.075   1.318   2.479
  141    HA   ALA  20           HA       ALA  20  54.594   0.129   5.046
  142   1HB   ALA  20           HB2      ALA  20  52.355   1.043   3.833
  143   2HB   ALA  20           HB1      ALA  20  52.148  -0.688   3.568
  144   3HB   ALA  20           HB3      ALA  20  52.314  -0.062   5.208
  145    H    GLU  21           HN       GLU  21  53.849  -1.300   1.854
  146    HA   GLU  21           HA       GLU  21  54.050  -4.023   2.743
  147   1HB   GLU  21           HB2      GLU  21  54.605  -2.972  -0.046
  148   2HB   GLU  21           HB1      GLU  21  54.096  -4.602   0.396
  149   1HG   GLU  21           HG2      GLU  21  51.950  -3.764   1.191
  150   2HG   GLU  21           HG1      GLU  21  52.456  -2.101   0.894
  151    H    PHE  22           HN       PHE  22  56.418  -1.694   1.532
  152    HA   PHE  22           HA       PHE  22  58.572  -3.563   1.183
  153   1HB   PHE  22           HB2      PHE  22  58.479  -0.580   1.668
  154   2HB   PHE  22           HB1      PHE  22  60.003  -1.449   1.485
  155    HD1  PHE  22           HD1      PHE  22  57.254  -2.908  -0.335
  156    HD2  PHE  22           HD2      PHE  22  60.305   0.111  -0.535
  157    HE1  PHE  22           HE1      PHE  22  57.007  -2.822  -2.800
  158    HE2  PHE  22           HE2      PHE  22  60.058   0.195  -3.000
  159    HZ   PHE  22           HZ       PHE  22  58.409  -1.271  -4.132
  160    H    LYS  23           HN       LYS  23  57.273  -1.875   3.974
  161    HA   LYS  23           HA       LYS  23  59.486  -2.223   5.745
  162   1HB   LYS  23           HB2      LYS  23  57.145  -0.949   5.984
  163   2HB   LYS  23           HB1      LYS  23  56.706  -2.445   6.811
  164   1HG   LYS  23           HG2      LYS  23  59.340  -1.463   7.614
  165   2HG   LYS  23           HG1      LYS  23  58.055  -0.300   7.952
  166   1HD   LYS  23           HD2      LYS  23  56.795  -1.975   9.184
  167   2HD   LYS  23           HD1      LYS  23  57.963  -3.224   8.748
  168   1HE   LYS  23           HE2      LYS  23  58.820  -2.680  10.809
  169   2HE   LYS  23           HE1      LYS  23  59.650  -1.450   9.858
  170   1HZ   LYS  23           HZ3      LYS  23  57.061  -1.074  11.263
  171   2HZ   LYS  23           HZ2      LYS  23  58.568  -0.511  11.811
  172   3HZ   LYS  23           HZ1      LYS  23  57.895   0.109  10.379
  173    H    ALA  24           HN       ALA  24  57.414  -4.513   4.315
  174    HA   ALA  24           HA       ALA  24  57.582  -6.474   6.492
  175   1HB   ALA  24           HB3      ALA  24  56.128  -6.191   4.002
  176   2HB   ALA  24           HB2      ALA  24  56.869  -7.788   4.106
  177   3HB   ALA  24           HB1      ALA  24  55.779  -7.237   5.378
  178    H    ALA  25           HN       ALA  25  59.352  -5.674   3.577
  179    HA   ALA  25           HA       ALA  25  60.819  -8.195   3.494
  180   1HB   ALA  25           HB3      ALA  25  60.832  -5.631   1.990
  181   2HB   ALA  25           HB2      ALA  25  62.354  -6.521   2.027
  182   3HB   ALA  25           HB1      ALA  25  60.900  -7.288   1.390
  183    H    PHE  26           HN       PHE  26  61.756  -4.827   4.300
  184    HA   PHE  26           HA       PHE  26  64.348  -5.466   5.271
  185   1HB   PHE  26           HB2      PHE  26  63.885  -3.171   4.869
  186   2HB   PHE  26           HB1      PHE  26  62.429  -3.207   5.862
  187    HD1  PHE  26           HD2      PHE  26  62.647  -3.528   8.357
  188    HD2  PHE  26           HD1      PHE  26  66.018  -2.725   5.824
  189    HE1  PHE  26           HE2      PHE  26  63.975  -2.850  10.340
  190    HE2  PHE  26           HE1      PHE  26  67.350  -2.048   7.805
  191    HZ   PHE  26           HZ       PHE  26  66.327  -2.111  10.065
  192    H    ASP  27           HN       ASP  27  61.229  -5.236   6.992
  193    HA   ASP  27           HA       ASP  27  62.173  -5.694   9.613
  194   1HB   ASP  27           HB2      ASP  27  59.797  -5.140   8.936
  195   2HB   ASP  27           HB1      ASP  27  59.607  -6.828   8.465
  196    H    MET  28           HN       MET  28  61.885  -7.888   6.914
  197    HA   MET  28           HA       MET  28  62.080 -10.303   8.531
  198   1HB   MET  28           HB2      MET  28  61.049 -10.786   6.515
  199   2HB   MET  28           HB1      MET  28  62.017  -9.617   5.621
  200   1HG   MET  28           HG2      MET  28  63.867 -11.073   5.494
  201   2HG   MET  28           HG1      MET  28  63.254 -12.110   6.781
  202   1HE   MET  28           HE3      MET  28  62.790 -10.647   3.377
  203   2HE   MET  28           HE2      MET  28  61.688 -11.703   2.499
  204   3HE   MET  28           HE1      MET  28  61.060 -10.627   3.745
  205    H    PHE  29           HN       PHE  29  64.303  -8.164   6.805
  206    HA   PHE  29           HA       PHE  29  66.592  -9.945   7.210
  207   1HB   PHE  29           HB2      PHE  29  66.220  -7.163   6.120
  208   2HB   PHE  29           HB1      PHE  29  67.835  -7.766   6.486
  209    HD1  PHE  29           HD2      PHE  29  64.741  -9.314   5.031
  210    HD2  PHE  29           HD1      PHE  29  68.929  -8.484   4.549
  211    HE1  PHE  29           HE2      PHE  29  64.751 -10.588   2.903
  212    HE2  PHE  29           HE1      PHE  29  68.937  -9.757   2.426
  213    HZ   PHE  29           HZ       PHE  29  66.847 -10.809   1.601
  214    H    ASP  30           HN       ASP  30  64.841  -8.309   9.383
  215    HA   ASP  30           HA       ASP  30  67.246  -7.514  10.978
  216   1HB   ASP  30           HB2      ASP  30  65.040  -5.949  10.272
  217   2HB   ASP  30           HB1      ASP  30  64.722  -6.421  11.941
  218    H    ALA  31           HN       ALA  31  66.629 -10.157  11.073
  219    HA   ALA  31           HA       ALA  31  64.655 -10.823  13.079
  220   1HB   ALA  31           HB1      ALA  31  65.877 -12.317  11.256
  221   2HB   ALA  31           HB3      ALA  31  67.025 -12.582  12.568
  222   3HB   ALA  31           HB2      ALA  31  65.330 -13.022  12.777
  223    H    ASP  32           HN       ASP  32  67.927  -9.687  13.194
  224    HA   ASP  32           HA       ASP  32  68.572 -10.690  15.829
  225   1HB   ASP  32           HB2      ASP  32  69.698  -8.558  14.028
  226   2HB   ASP  32           HB1      ASP  32  70.245  -8.676  15.700
  227    H    GLY  33           HN       GLY  33  66.819  -7.908  14.620
  228   1HA   GLY  33           HA2      GLY  33  65.298  -6.597  15.913
  229   2HA   GLY  33           HA1      GLY  33  66.005  -7.270  17.382
  230    H    GLY  34           HN       GLY  34  68.015  -5.958  14.834
  231   1HA   GLY  34           HA2      GLY  34  68.974  -3.901  16.743
  232   2HA   GLY  34           HA1      GLY  34  69.792  -4.385  15.257
  233    H    GLY  35           HN       GLY  35  66.773  -4.156  14.195
  234   1HA   GLY  35           HA2      GLY  35  65.487  -2.477  13.157
  235   2HA   GLY  35           HA1      GLY  35  66.337  -1.288  14.147
  236    H    ASP  36           HN       ASP  36  68.331  -3.448  12.361
  237    HA   ASP  36           HA       ASP  36  68.482  -1.840   9.938
  238   1HB   ASP  36           HB2      ASP  36  70.938  -1.229  10.408
  239   2HB   ASP  36           HB1      ASP  36  69.710  -0.278  11.245
  240    H    ILE  37           HN       ILE  37  69.512  -3.014   8.320
  241    HA   ILE  37           HA       ILE  37  70.715  -5.611   9.181
  242    HB   ILE  37           HB       ILE  37  69.830  -6.635   7.267
  243   1HG1  ILE  37          HG12      ILE  37  69.640  -3.833   6.122
  244   2HG1  ILE  37          HG11      ILE  37  70.635  -5.168   5.542
  245   1HG2  ILE  37          HG23      ILE  37  68.120  -5.078   8.860
  246   2HG2  ILE  37          HG22      ILE  37  67.579  -4.803   7.204
  247   3HG2  ILE  37          HG21      ILE  37  67.660  -6.444   7.844
  248   1HD1  ILE  37          HD13      ILE  37  67.945  -6.093   5.605
  249   2HD1  ILE  37          HD12      ILE  37  67.938  -4.514   4.817
  250   3HD1  ILE  37          HD11      ILE  37  68.958  -5.809   4.190
  251    H    SER  38           HN       SER  38  72.841  -5.934   8.680
  252    HA   SER  38           HA       SER  38  74.577  -3.953   7.788
  253   1HB   SER  38           HB2      SER  38  74.973  -6.845   7.005
  254   2HB   SER  38           HB1      SER  38  76.200  -5.652   7.421
  255    HG   SER  38           HG       SER  38  75.845  -6.008   9.474
  256    H    THR  39           HN       THR  39  75.248  -3.197   5.759
  257    HA   THR  39           HA       THR  39  73.407  -3.396   3.594
  258    HB   THR  39           HB       THR  39  74.830  -2.000   2.410
  259    HG1  THR  39           HG1      THR  39  76.549  -3.445   2.241
  260   1HG2  THR  39          HG22      THR  39  74.629  -1.553   5.155
  261   2HG2  THR  39          HG21      THR  39  76.336  -1.291   4.801
  262   3HG2  THR  39          HG23      THR  39  75.104  -0.369   3.940
  263    H    LYS  40           HN       LYS  40  75.853  -5.540   4.652
  264    HA   LYS  40           HA       LYS  40  76.588  -6.771   2.182
  265   1HB   LYS  40           HB2      LYS  40  76.371  -7.866   4.999
  266   2HB   LYS  40           HB1      LYS  40  77.002  -8.809   3.651
  267   1HG   LYS  40           HG2      LYS  40  78.945  -7.606   3.541
  268   2HG   LYS  40           HG1      LYS  40  78.153  -6.093   3.986
  269   1HD   LYS  40           HD2      LYS  40  78.617  -6.377   6.180
  270   2HD   LYS  40           HD1      LYS  40  78.105  -8.065   6.148
  271   1HE   LYS  40           HE2      LYS  40  80.244  -8.757   6.084
  272   2HE   LYS  40           HE1      LYS  40  80.551  -7.774   4.651
  273   1HZ   LYS  40           HZ1      LYS  40  80.343  -6.161   6.982
  274   2HZ   LYS  40           HZ3      LYS  40  81.534  -7.352   7.184
  275   3HZ   LYS  40           HZ2      LYS  40  81.619  -6.281   5.867
  276    H    ALA  41           HN       ALA  41  73.846  -7.249   4.370
  277    HA   ALA  41           HA       ALA  41  72.749  -9.379   2.647
  278   1HB   ALA  41           HB1      ALA  41  72.605  -9.045   5.316
  279   2HB   ALA  41           HB3      ALA  41  71.133  -8.191   4.851
  280   3HB   ALA  41           HB2      ALA  41  71.351  -9.883   4.403
  281    H    LEU  42           HN       LEU  42  72.783  -6.036   2.615
  282    HA   LEU  42           HA       LEU  42  70.069  -5.399   1.988
  283   1HB   LEU  42           HB2      LEU  42  72.664  -4.080   1.837
  284   2HB   LEU  42           HB1      LEU  42  71.664  -3.682   0.443
  285    HG   LEU  42           HG       LEU  42  71.125  -2.047   2.088
  286   1HD1  LEU  42          HD13      LEU  42  69.199  -3.472   1.002
  287   2HD1  LEU  42          HD12      LEU  42  68.958  -4.047   2.652
  288   3HD1  LEU  42          HD11      LEU  42  68.822  -2.326   2.288
  289   1HD2  LEU  42          HD21      LEU  42  71.536  -4.322   3.915
  290   2HD2  LEU  42          HD23      LEU  42  71.799  -2.600   4.184
  291   3HD2  LEU  42          HD22      LEU  42  70.180  -3.282   4.358
  292    H    GLY  43           HN       GLY  43  72.827  -6.203  -0.138
  293   1HA   GLY  43           HA2      GLY  43  71.365  -6.101  -2.585
  294   2HA   GLY  43           HA1      GLY  43  72.835  -7.046  -2.330
  295    H    THR  44           HN       THR  44  71.401  -8.390   0.006
  296    HA   THR  44           HA       THR  44  70.375 -10.643  -1.520
  297    HB   THR  44           HB       THR  44  70.575 -10.012   1.428
  298    HG1  THR  44           HG1      THR  44  71.781 -11.834  -0.365
  299   1HG2  THR  44          HG21      THR  44  69.119 -12.244   0.044
  300   2HG2  THR  44          HG23      THR  44  69.900 -12.535   1.598
  301   3HG2  THR  44          HG22      THR  44  68.637 -11.314   1.462
  302    H    VAL  45           HN       VAL  45  68.981  -7.921   0.227
  303    HA   VAL  45           HA       VAL  45  66.272  -8.940   0.256
  304    HB   VAL  45           HB       VAL  45  67.081  -6.021   0.242
  305   1HG1  VAL  45          HG11      VAL  45  64.612  -7.065   0.164
  306   2HG1  VAL  45          HG13      VAL  45  64.888  -7.178   1.904
  307   3HG1  VAL  45          HG12      VAL  45  64.980  -5.612   1.095
  308   1HG2  VAL  45          HG22      VAL  45  68.306  -7.614   1.928
  309   2HG2  VAL  45          HG21      VAL  45  67.587  -6.122   2.527
  310   3HG2  VAL  45          HG23      VAL  45  66.743  -7.654   2.744
  311    H    MET  46           HN       MET  46  68.105  -6.824  -1.933
  312    HA   MET  46           HA       MET  46  66.117  -5.981  -3.684
  313   1HB   MET  46           HB2      MET  46  68.733  -7.093  -4.708
  314   2HB   MET  46           HB1      MET  46  67.804  -5.731  -5.336
  315   1HG   MET  46           HG2      MET  46  68.205  -4.639  -3.029
  316   2HG   MET  46           HG1      MET  46  69.451  -5.869  -2.811
  317   1HE   MET  46           HE2      MET  46  68.317  -2.713  -4.075
  318   2HE   MET  46           HE1      MET  46  69.447  -2.118  -5.289
  319   3HE   MET  46           HE3      MET  46  68.214  -3.306  -5.731
  320    H    ARG  47           HN       ARG  47  67.962  -9.040  -4.052
  321    HA   ARG  47           HA       ARG  47  66.407 -10.069  -6.189
  322   1HB   ARG  47           HB2      ARG  47  67.629 -11.782  -4.017
  323   2HB   ARG  47           HB1      ARG  47  67.415 -12.177  -5.722
  324   1HG   ARG  47           HG2      ARG  47  68.936 -10.077  -6.122
  325   2HG   ARG  47           HG1      ARG  47  69.422 -10.341  -4.447
  326   1HD   ARG  47           HD2      ARG  47  69.393 -12.852  -5.879
  327   2HD   ARG  47           HD1      ARG  47  70.399 -11.678  -6.729
  328    HE   ARG  47           HE       ARG  47  71.806 -11.525  -4.757
  329   1HH1  ARG  47          HH21      ARG  47  69.415 -12.230  -2.894
  330   2HH1  ARG  47          HH22      ARG  47  69.961 -13.748  -2.265
  331   1HH2  ARG  47          HH11      ARG  47  72.435 -14.151  -4.660
  332   2HH2  ARG  47          HH12      ARG  47  71.672 -14.836  -3.265
  333    H    MET  48           HN       MET  48  65.941 -10.295  -2.674
  334    HA   MET  48           HA       MET  48  63.839 -12.162  -2.595
  335   1HB   MET  48           HB2      MET  48  64.338  -9.690  -0.919
  336   2HB   MET  48           HB1      MET  48  63.069 -10.859  -0.552
  337   1HG   MET  48           HG2      MET  48  65.964 -11.661  -0.914
  338   2HG   MET  48           HG1      MET  48  65.288 -11.225   0.654
  339   1HE   MET  48           HE1      MET  48  64.864 -12.459   2.044
  340   2HE   MET  48           HE3      MET  48  63.465 -13.542   2.048
  341   3HE   MET  48           HE2      MET  48  65.095 -14.204   1.946
  342    H    LEU  49           HN       LEU  49  63.636  -8.630  -3.093
  343    HA   LEU  49           HA       LEU  49  60.751  -8.717  -3.482
  344   1HB   LEU  49           HB2      LEU  49  62.411  -6.447  -4.506
  345   2HB   LEU  49           HB1      LEU  49  60.862  -6.410  -3.666
  346    HG   LEU  49           HG       LEU  49  63.607  -6.872  -2.485
  347   1HD1  LEU  49          HD12      LEU  49  61.984  -4.609  -2.793
  348   2HD1  LEU  49          HD11      LEU  49  61.768  -5.088  -1.109
  349   3HD1  LEU  49          HD13      LEU  49  63.385  -4.758  -1.733
  350   1HD2  LEU  49          HD22      LEU  49  61.061  -8.002  -1.667
  351   2HD2  LEU  49          HD21      LEU  49  62.665  -8.267  -0.981
  352   3HD2  LEU  49          HD23      LEU  49  61.683  -6.909  -0.430
  353    H    GLY  50           HN       GLY  50  63.532  -9.213  -5.469
  354   1HA   GLY  50           HA2      GLY  50  62.950 -10.416  -7.628
  355   2HA   GLY  50           HA1      GLY  50  61.786  -9.116  -7.900
  356    H    GLN  51           HN       GLN  51  63.917  -7.274  -6.596
  357    HA   GLN  51           HA       GLN  51  65.004  -6.255  -9.035
  358   1HB   GLN  51           HB2      GLN  51  65.026  -5.542  -6.254
  359   2HB   GLN  51           HB1      GLN  51  66.675  -5.457  -6.874
  360   1HG   GLN  51           HG2      GLN  51  65.695  -3.312  -7.291
  361   2HG   GLN  51           HG1      GLN  51  65.738  -4.145  -8.844
  362   1HE2  GLN  51          HE22      GLN  51  62.295  -2.723  -8.322
  363   2HE2  GLN  51          HE21      GLN  51  63.853  -2.048  -8.356
  364    H    ASN  52           HN       ASN  52  66.799  -6.864 -10.159
  365    HA   ASN  52           HA       ASN  52  68.829  -8.546  -8.756
  366   1HB   ASN  52           HB2      ASN  52  67.447 -10.065 -10.070
  367   2HB   ASN  52           HB1      ASN  52  67.623  -9.040 -11.495
  368   1HD2  ASN  52          HD22      ASN  52  71.082 -10.892 -10.245
  369   2HD2  ASN  52          HD21      ASN  52  70.057 -10.189  -9.088
  370    HA   PRO  53           HA       PRO  53  70.702  -5.033 -11.132
  371   1HB   PRO  53           HB2      PRO  53  71.937  -3.879  -8.964
  372   2HB   PRO  53           HB1      PRO  53  70.299  -3.461  -9.495
  373   1HG   PRO  53           HG2      PRO  53  71.152  -5.093  -7.149
  374   2HG   PRO  53           HG1      PRO  53  69.673  -4.146  -7.379
  375   1HD   PRO  53           HD2      PRO  53  69.900  -6.959  -7.623
  376   2HD   PRO  53           HD1      PRO  53  68.525  -5.970  -8.161
  377    H    THR  54           HN       THR  54  73.128  -4.553 -11.242
  378    HA   THR  54           HA       THR  54  74.613  -7.051 -11.117
  379    HB   THR  54           HB       THR  54  75.127  -5.592 -12.944
  380    HG1  THR  54           HG1      THR  54  76.921  -6.586 -11.775
  381   1HG2  THR  54          HG21      THR  54  75.280  -3.516 -10.779
  382   2HG2  THR  54          HG23      THR  54  76.158  -3.273 -12.289
  383   3HG2  THR  54          HG22      THR  54  74.404  -3.465 -12.308
  384    H    LYS  55           HN       LYS  55  76.066  -7.684  -9.558
  385    HA   LYS  55           HA       LYS  55  76.010  -6.615  -6.956
  386   1HB   LYS  55           HB2      LYS  55  77.111  -8.828  -8.033
  387   2HB   LYS  55           HB1      LYS  55  78.569  -7.851  -7.844
  388   1HG   LYS  55           HG2      LYS  55  76.663  -7.950  -5.546
  389   2HG   LYS  55           HG1      LYS  55  77.648  -9.382  -5.856
  390   1HD   LYS  55           HD2      LYS  55  79.254  -6.979  -6.069
  391   2HD   LYS  55           HD1      LYS  55  78.447  -7.047  -4.503
  392   1HE   LYS  55           HE2      LYS  55  79.377  -9.200  -4.014
  393   2HE   LYS  55           HE1      LYS  55  79.943  -9.402  -5.672
  394   1HZ   LYS  55           HZ3      LYS  55  81.124  -7.107  -4.986
  395   2HZ   LYS  55           HZ2      LYS  55  81.110  -7.905  -3.487
  396   3HZ   LYS  55           HZ1      LYS  55  81.856  -8.630  -4.831
  397    H    GLU  56           HN       GLU  56  77.937  -5.656  -9.726
  398    HA   GLU  56           HA       GLU  56  79.894  -4.109  -8.299
  399   1HB   GLU  56           HB2      GLU  56  78.960  -4.347 -11.107
  400   2HB   GLU  56           HB1      GLU  56  79.726  -2.817 -10.678
  401   1HG   GLU  56           HG2      GLU  56  80.975  -5.474  -9.971
  402   2HG   GLU  56           HG1      GLU  56  81.280  -4.683 -11.518
  403    H    GLU  57           HN       GLU  57  76.954  -3.047 -10.056
  404    HA   GLU  57           HA       GLU  57  77.061  -0.349  -9.149
  405   1HB   GLU  57           HB2      GLU  57  75.515  -1.603 -10.937
  406   2HB   GLU  57           HB1      GLU  57  74.400  -1.639  -9.572
  407   1HG   GLU  57           HG2      GLU  57  73.865   0.503  -9.999
  408   2HG   GLU  57           HG1      GLU  57  75.525   0.961  -9.622
  409    H    LEU  58           HN       LEU  58  76.186  -3.265  -7.525
  410    HA   LEU  58           HA       LEU  58  74.442  -2.120  -5.532
  411   1HB   LEU  58           HB2      LEU  58  75.203  -4.674  -6.193
  412   2HB   LEU  58           HB1      LEU  58  76.100  -4.414  -4.695
  413    HG   LEU  58           HG       LEU  58  73.271  -3.509  -4.697
  414   1HD1  LEU  58          HD11      LEU  58  74.109  -6.411  -4.854
  415   2HD1  LEU  58          HD13      LEU  58  72.587  -5.906  -4.120
  416   3HD1  LEU  58          HD12      LEU  58  72.895  -5.579  -5.825
  417   1HD2  LEU  58          HD23      LEU  58  75.355  -4.477  -2.845
  418   2HD2  LEU  58          HD22      LEU  58  74.048  -3.327  -2.564
  419   3HD2  LEU  58          HD21      LEU  58  73.733  -5.061  -2.480
  420    H    ASP  59           HN       ASP  59  77.871  -3.158  -5.277
  421    HA   ASP  59           HA       ASP  59  78.478  -2.174  -2.762
  422   1HB   ASP  59           HB2      ASP  59  80.131  -3.321  -4.177
  423   2HB   ASP  59           HB1      ASP  59  80.204  -1.919  -5.244
  424    H    ALA  60           HN       ALA  60  78.437  -0.287  -5.792
  425    HA   ALA  60           HA       ALA  60  79.155   2.209  -4.584
  426   1HB   ALA  60           HB3      ALA  60  77.765   1.427  -7.137
  427   2HB   ALA  60           HB2      ALA  60  77.871   3.125  -6.670
  428   3HB   ALA  60           HB1      ALA  60  79.342   2.186  -6.923
  429    H    ILE  61           HN       ILE  61  76.017   0.651  -5.178
  430    HA   ILE  61           HA       ILE  61  74.343   2.808  -4.402
  431    HB   ILE  61           HB       ILE  61  74.019  -0.194  -4.257
  432   1HG1  ILE  61          HG12      ILE  61  72.609   1.923  -5.909
  433   2HG1  ILE  61          HG11      ILE  61  74.015   1.015  -6.466
  434   1HG2  ILE  61          HG21      ILE  61  72.226   1.981  -3.218
  435   2HG2  ILE  61          HG23      ILE  61  71.508   0.538  -3.933
  436   3HG2  ILE  61          HG22      ILE  61  72.564   0.392  -2.530
  437   1HD1  ILE  61          HD12      ILE  61  72.700  -1.103  -5.970
  438   2HD1  ILE  61          HD11      ILE  61  71.287  -0.074  -5.737
  439   3HD1  ILE  61          HD13      ILE  61  72.084  -0.134  -7.308
  440    H    ILE  62           HN       ILE  62  75.192  -0.010  -2.360
  441    HA   ILE  62           HA       ILE  62  74.291   0.872   0.093
  442    HB   ILE  62           HB       ILE  62  76.862  -0.581  -0.573
  443   1HG1  ILE  62          HG12      ILE  62  74.301  -1.610   0.673
  444   2HG1  ILE  62          HG11      ILE  62  74.565  -1.593  -1.070
  445   1HG2  ILE  62          HG22      ILE  62  76.999   0.589   1.638
  446   2HG2  ILE  62          HG21      ILE  62  75.545  -0.271   2.140
  447   3HG2  ILE  62          HG23      ILE  62  77.020  -1.168   1.784
  448   1HD1  ILE  62          HD12      ILE  62  76.867  -2.704   0.297
  449   2HD1  ILE  62          HD11      ILE  62  75.400  -3.579   0.734
  450   3HD1  ILE  62          HD13      ILE  62  75.863  -3.429  -0.961
  451    H    GLU  63           HN       GLU  63  77.162   2.005  -1.627
  452    HA   GLU  63           HA       GLU  63  78.285   3.496   0.559
  453   1HB   GLU  63           HB2      GLU  63  78.837   3.086  -2.242
  454   2HB   GLU  63           HB1      GLU  63  78.951   4.805  -1.858
  455   1HG   GLU  63           HG2      GLU  63  80.436   4.248   0.062
  456   2HG   GLU  63           HG1      GLU  63  80.378   2.550  -0.415
  457    H    GLU  64           HN       GLU  64  76.275   4.548  -2.212
  458    HA   GLU  64           HA       GLU  64  75.990   7.240  -1.160
  459   1HB   GLU  64           HB2      GLU  64  74.119   7.317  -2.936
  460   2HB   GLU  64           HB1      GLU  64  75.767   7.058  -3.508
  461   1HG   GLU  64           HG2      GLU  64  75.406   4.753  -3.868
  462   2HG   GLU  64           HG1      GLU  64  73.964   4.732  -2.852
  463    H    VAL  65           HN       VAL  65  74.597   4.303  -0.293
  464    HA   VAL  65           HA       VAL  65  71.984   5.437   0.465
  465    HB   VAL  65           HB       VAL  65  73.220   2.694   0.822
  466   1HG1  VAL  65          HG11      VAL  65  70.626   3.874   1.803
  467   2HG1  VAL  65          HG13      VAL  65  70.741   2.155   1.425
  468   3HG1  VAL  65          HG12      VAL  65  71.775   2.855   2.671
  469   1HG2  VAL  65          HG23      VAL  65  71.177   3.925  -1.025
  470   2HG2  VAL  65          HG22      VAL  65  72.595   2.960  -1.437
  471   3HG2  VAL  65          HG21      VAL  65  71.184   2.188  -0.716
  472    H    ASP  66           HN       ASP  66  74.891   4.160   2.089
  473    HA   ASP  66           HA       ASP  66  73.823   5.000   4.709
  474   1HB   ASP  66           HB2      ASP  66  75.456   2.932   3.970
  475   2HB   ASP  66           HB1      ASP  66  76.638   4.118   4.527
  476    H    GLU  67           HN       GLU  67  73.788   7.322   4.054
  477    HA   GLU  67           HA       GLU  67  76.197   8.741   3.403
  478   1HB   GLU  67           HB2      GLU  67  73.513   9.555   4.504
  479   2HB   GLU  67           HB1      GLU  67  74.819  10.733   4.353
  480   1HG   GLU  67           HG2      GLU  67  74.441   9.058   1.961
  481   2HG   GLU  67           HG1      GLU  67  73.056  10.085   2.342
  482    H    ASP  68           HN       ASP  68  74.879   7.550   6.391
  483    HA   ASP  68           HA       ASP  68  76.697   9.243   8.003
  484   1HB   ASP  68           HB2      ASP  68  75.625   7.908   9.916
  485   2HB   ASP  68           HB1      ASP  68  74.552   8.975   9.008
  486    H    GLY  69           HN       GLY  69  76.741   6.247   6.413
  487   1HA   GLY  69           HA2      GLY  69  78.165   4.381   6.567
  488   2HA   GLY  69           HA1      GLY  69  79.370   5.571   7.065
  489    H    SER  70           HN       SER  70  76.393   4.547   8.734
  490    HA   SER  70           HA       SER  70  77.788   4.362  11.268
  491   1HB   SER  70           HB2      SER  70  75.577   3.318  12.012
  492   2HB   SER  70           HB1      SER  70  75.475   4.950  11.359
  493    HG   SER  70           HG       SER  70  74.583   2.533  10.325
  494    H    GLY  71           HN       GLY  71  77.688   2.304   8.622
  495   1HA   GLY  71           HA2      GLY  71  78.933   0.228   8.585
  496   2HA   GLY  71           HA1      GLY  71  78.629   0.049  10.315
  497    H    THR  72           HN       THR  72  75.726   0.895   9.684
  498    HA   THR  72           HA       THR  72  74.804  -1.601   8.351
  499    HB   THR  72           HB       THR  72  73.017  -1.677  10.248
  500    HG1  THR  72           HG1      THR  72  73.466   0.153  11.346
  501   1HG2  THR  72          HG23      THR  72  75.883  -2.544  10.359
  502   2HG2  THR  72          HG22      THR  72  74.851  -2.831  11.760
  503   3HG2  THR  72          HG21      THR  72  74.425  -3.523  10.194
  504    H    ILE  73           HN       ILE  73  72.602  -1.425   7.549
  505    HA   ILE  73           HA       ILE  73  71.797   1.416   7.132
  506    HB   ILE  73           HB       ILE  73  71.249  -1.116   5.577
  507   1HG1  ILE  73          HG12      ILE  73  72.782   1.449   5.150
  508   2HG1  ILE  73          HG11      ILE  73  73.338  -0.213   4.952
  509   1HG2  ILE  73          HG21      ILE  73  70.065   1.655   5.189
  510   2HG2  ILE  73          HG23      ILE  73  69.877   0.302   4.074
  511   3HG2  ILE  73          HG22      ILE  73  69.176   0.216   5.689
  512   1HD1  ILE  73          HD12      ILE  73  71.262   1.135   3.207
  513   2HD1  ILE  73          HD11      ILE  73  72.956   0.917   2.770
  514   3HD1  ILE  73          HD13      ILE  73  71.912  -0.489   2.985
  515    H    ASP  74           HN       ASP  74  69.461   1.892   7.205
  516    HA   ASP  74           HA       ASP  74  67.945  -0.006   8.950
  517   1HB   ASP  74           HB2      ASP  74  67.946   3.023   9.128
  518   2HB   ASP  74           HB1      ASP  74  67.000   1.928  10.137
  519    H    PHE  75           HN       PHE  75  65.506   0.594   8.876
  520    HA   PHE  75           HA       PHE  75  64.519   0.302   6.264
  521   1HB   PHE  75           HB2      PHE  75  63.301   0.033   8.537
  522   2HB   PHE  75           HB1      PHE  75  62.958   1.759   8.395
  523    HD1  PHE  75           HD2      PHE  75  63.143  -0.955   5.823
  524    HD2  PHE  75           HD1      PHE  75  60.711   1.996   7.776
  525    HE1  PHE  75           HE2      PHE  75  61.282  -1.453   4.259
  526    HE2  PHE  75           HE1      PHE  75  58.850   1.498   6.213
  527    HZ   PHE  75           HZ       PHE  75  59.137  -0.226   4.454
  528    H    GLU  76           HN       GLU  76  65.112   3.272   8.114
  529    HA   GLU  76           HA       GLU  76  63.878   5.125   6.373
  530   1HB   GLU  76           HB2      GLU  76  66.189   5.266   8.281
  531   2HB   GLU  76           HB1      GLU  76  65.875   6.635   7.215
  532   1HG   GLU  76           HG2      GLU  76  63.584   5.436   8.728
  533   2HG   GLU  76           HG1      GLU  76  64.706   6.494   9.586
  534    H    GLU  77           HN       GLU  77  67.379   4.342   6.437
  535    HA   GLU  77           HA       GLU  77  67.843   5.547   3.857
  536   1HB   GLU  77           HB2      GLU  77  69.558   3.479   5.258
  537   2HB   GLU  77           HB1      GLU  77  70.078   4.647   4.044
  538   1HG   GLU  77           HG2      GLU  77  69.648   6.497   5.541
  539   2HG   GLU  77           HG1      GLU  77  68.907   5.421   6.728
  540    H    PHE  78           HN       PHE  78  66.376   2.627   4.730
  541    HA   PHE  78           HA       PHE  78  67.330   0.940   2.600
  542   1HB   PHE  78           HB2      PHE  78  66.260  -0.388   4.128
  543   2HB   PHE  78           HB1      PHE  78  65.154   0.892   4.614
  544    HD1  PHE  78           HD2      PHE  78  63.072   1.281   3.420
  545    HD2  PHE  78           HD1      PHE  78  65.739  -1.871   2.250
  546    HE1  PHE  78           HE2      PHE  78  61.272   0.274   2.037
  547    HE2  PHE  78           HE1      PHE  78  63.942  -2.881   0.866
  548    HZ   PHE  78           HZ       PHE  78  61.709  -1.807   0.760
  549    H    LEU  79           HN       LEU  79  64.306   2.839   2.940
  550    HA   LEU  79           HA       LEU  79  63.190   2.415   0.430
  551   1HB   LEU  79           HB2      LEU  79  63.362   5.073   1.888
  552   2HB   LEU  79           HB1      LEU  79  62.208   4.673   0.616
  553    HG   LEU  79           HG       LEU  79  62.439   3.007   3.122
  554   1HD1  LEU  79          HD13      LEU  79  61.956   5.383   3.723
  555   2HD1  LEU  79          HD12      LEU  79  60.556   5.336   2.650
  556   3HD1  LEU  79          HD11      LEU  79  60.608   4.303   4.078
  557   1HD2  LEU  79          HD22      LEU  79  60.290   3.437   1.024
  558   2HD2  LEU  79          HD21      LEU  79  61.254   1.979   1.260
  559   3HD2  LEU  79          HD23      LEU  79  60.074   2.464   2.478
  560    H    VAL  80           HN       VAL  80  65.812   4.675   1.264
  561    HA   VAL  80           HA       VAL  80  66.102   5.943  -1.239
  562    HB   VAL  80           HB       VAL  80  68.139   5.186   0.866
  563   1HG1  VAL  80          HG13      VAL  80  68.478   6.543  -1.794
  564   2HG1  VAL  80          HG12      VAL  80  69.473   7.051  -0.429
  565   3HG1  VAL  80          HG11      VAL  80  69.538   5.381  -0.993
  566   1HG2  VAL  80          HG23      VAL  80  66.358   6.900   1.368
  567   2HG2  VAL  80          HG22      VAL  80  68.001   7.536   1.449
  568   3HG2  VAL  80          HG21      VAL  80  66.994   7.872   0.039
  569    H    MET  81           HN       MET  81  67.888   3.056  -0.079
  570    HA   MET  81           HA       MET  81  69.245   2.447  -2.448
  571   1HB   MET  81           HB2      MET  81  69.600   1.241  -0.327
  572   2HB   MET  81           HB1      MET  81  68.007   0.498  -0.481
  573   1HG   MET  81           HG2      MET  81  68.654  -0.690  -2.455
  574   2HG   MET  81           HG1      MET  81  70.154   0.229  -2.589
  575   1HE   MET  81           HE2      MET  81  71.806   0.420  -0.712
  576   2HE   MET  81           HE1      MET  81  70.820   0.275   0.741
  577   3HE   MET  81           HE3      MET  81  72.180  -0.825   0.478
  578    H    MET  82           HN       MET  82  65.854   2.001  -1.673
  579    HA   MET  82           HA       MET  82  65.287   0.181  -3.854
  580   1HB   MET  82           HB2      MET  82  63.256   2.070  -2.672
  581   2HB   MET  82           HB1      MET  82  63.020   0.426  -3.267
  582   1HG   MET  82           HG2      MET  82  64.419   1.281  -0.723
  583   2HG   MET  82           HG1      MET  82  62.963   0.302  -0.871
  584   1HE   MET  82           HE2      MET  82  62.922  -1.564  -2.562
  585   2HE   MET  82           HE1      MET  82  64.313  -1.528  -3.644
  586   3HE   MET  82           HE3      MET  82  64.081  -2.890  -2.540
  587    H    VAL  83           HN       VAL  83  64.556   3.671  -3.436
  588    HA   VAL  83           HA       VAL  83  63.758   4.052  -6.161
  589    HB   VAL  83           HB       VAL  83  64.993   6.246  -4.513
  590   1HG1  VAL  83          HG11      VAL  83  63.727   6.201  -6.942
  591   2HG1  VAL  83          HG13      VAL  83  62.382   6.552  -5.857
  592   3HG1  VAL  83          HG12      VAL  83  63.794   7.610  -5.884
  593   1HG2  VAL  83          HG21      VAL  83  62.465   4.702  -3.979
  594   2HG2  VAL  83          HG23      VAL  83  63.667   5.294  -2.830
  595   3HG2  VAL  83          HG22      VAL  83  62.541   6.420  -3.592
  596    H    ARG  84           HN       ARG  84  66.810   3.482  -4.810
  597    HA   ARG  84           HA       ARG  84  68.552   5.093  -6.326
  598   1HB   ARG  84           HB2      ARG  84  68.803   2.867  -4.640
  599   2HB   ARG  84           HB1      ARG  84  69.516   2.356  -6.170
  600   1HG   ARG  84           HG2      ARG  84  71.349   3.388  -5.207
  601   2HG   ARG  84           HG1      ARG  84  70.639   4.761  -6.055
  602   1HD   ARG  84           HD2      ARG  84  69.946   4.081  -3.190
  603   2HD   ARG  84           HD1      ARG  84  71.257   5.179  -3.618
  604    HE   ARG  84           HE       ARG  84  68.371   5.715  -3.957
  605   1HH1  ARG  84          HH21      ARG  84  69.271   6.834  -6.385
  606   2HH1  ARG  84          HH22      ARG  84  69.964   8.364  -5.962
  607   1HH2  ARG  84          HH11      ARG  84  70.299   7.582  -2.601
  608   2HH2  ARG  84          HH12      ARG  84  70.547   8.788  -3.820
  609    H    GLN  85           HN       GLN  85  66.566   2.397  -7.328
  610    HA   GLN  85           HA       GLN  85  67.655   2.740 -10.091
  611   1HB   GLN  85           HB2      GLN  85  67.082   0.251 -10.373
  612   2HB   GLN  85           HB1      GLN  85  68.508   0.630  -9.406
  613   1HG   GLN  85           HG2      GLN  85  66.104   0.622  -7.773
  614   2HG   GLN  85           HG1      GLN  85  66.321  -0.921  -8.600
  615   1HE2  GLN  85          HE22      GLN  85  68.881   0.155  -5.621
  616   2HE2  GLN  85          HE21      GLN  85  67.660   1.213  -6.143
  617    H    MET  86           HN       MET  86  64.956   2.918  -8.090
  618    HA   MET  86           HA       MET  86  63.005   2.086 -10.130
  619   1HB   MET  86           HB2      MET  86  62.570   3.483  -7.474
  620   2HB   MET  86           HB1      MET  86  61.320   2.750  -8.477
  621   1HG   MET  86           HG2      MET  86  63.282   0.759  -8.147
  622   2HG   MET  86           HG1      MET  86  63.078   1.489  -6.556
  623   1HE   MET  86           HE3      MET  86  61.324   1.736  -5.308
  624   2HE   MET  86           HE2      MET  86  59.772   0.902  -5.341
  625   3HE   MET  86           HE1      MET  86  61.237   0.000  -4.969
  626    H    LYS  87           HN       LYS  87  64.980   4.553 -10.198
  627    HA   LYS  87           HA       LYS  87  62.906   6.419 -11.263
  628   1HB   LYS  87           HB2      LYS  87  64.847   6.876  -9.117
  629   2HB   LYS  87           HB1      LYS  87  64.967   8.071 -10.411
  630   1HG   LYS  87           HG2      LYS  87  62.193   7.472  -9.724
  631   2HG   LYS  87           HG1      LYS  87  63.102   8.092  -8.344
  632   1HD   LYS  87           HD2      LYS  87  62.006   9.864  -9.803
  633   2HD   LYS  87           HD1      LYS  87  63.738  10.071  -9.542
  634   1HE   LYS  87           HE2      LYS  87  64.242   9.671 -11.726
  635   2HE   LYS  87           HE1      LYS  87  63.032   8.395 -11.871
  636   1HZ   LYS  87           HZ1      LYS  87  61.368  10.327 -11.725
  637   2HZ   LYS  87           HZ3      LYS  87  62.687  11.310 -12.134
  638   3HZ   LYS  87           HZ2      LYS  87  62.190  10.074 -13.190
  639    H    GLU  88           HN       GLU  88  65.405   4.485 -12.050
  640    HA   GLU  88           HA       GLU  88  66.039   6.112 -14.437
  641   1HB   GLU  88           HB2      GLU  88  68.440   5.889 -14.166
  642   2HB   GLU  88           HB1      GLU  88  67.788   6.637 -12.706
  643   1HG   GLU  88           HG2      GLU  88  67.736   4.395 -11.619
  644   2HG   GLU  88           HG1      GLU  88  68.487   3.707 -13.060
  645    H    ASP  89           HN       ASP  89  66.540   3.046 -12.690
  646    HA   ASP  89           HA       ASP  89  67.217   1.565 -15.089
  647   1HB   ASP  89           HB2      ASP  89  67.546   1.043 -12.467
  648   2HB   ASP  89           HB1      ASP  89  66.053   0.144 -12.746
  649    H    ALA  90           HN       ALA  90  64.323   2.862 -13.972
  650    HA   ALA  90           HA       ALA  90  62.809   1.278 -15.941
  651   1HB   ALA  90           HB2      ALA  90  62.723   0.630 -13.168
  652   2HB   ALA  90           HB1      ALA  90  61.185   1.390 -13.579
  653   3HB   ALA  90           HB3      ALA  90  61.729  -0.034 -14.465
   
  No H/Q in entry =         653
  Start of MODEL   39
    1   1H    ALA   1           HT1      ALA   1  71.836  13.735  13.638
    2   2H    ALA   1           HT3      ALA   1  73.002  14.237  12.514
    3   3H    ALA   1           HT2      ALA   1  73.226  14.554  14.168
    4    HA   ALA   1           HA       ALA   1  71.492  16.131  14.219
    5   1HB   ALA   1           HB3      ALA   1  73.780  16.456  12.713
    6   2HB   ALA   1           HB2      ALA   1  72.515  16.936  11.582
    7   3HB   ALA   1           HB1      ALA   1  72.660  17.751  13.140
    8    H    SER   2           HN       SER   2  69.442  15.078  13.874
    9    HA   SER   2           HA       SER   2  67.441  14.702  12.702
   10   1HB   SER   2           HB2      SER   2  68.654  17.075  11.573
   11   2HB   SER   2           HB1      SER   2  67.786  16.179  10.328
   12    HG   SER   2           HG       SER   2  66.279  17.441  11.303
   13    H    MET   3           HN       MET   3  66.951  14.548   9.949
   14    HA   MET   3           HA       MET   3  68.704  12.250   9.188
   15   1HB   MET   3           HB2      MET   3  66.741  11.519   7.801
   16   2HB   MET   3           HB1      MET   3  66.399  11.553   9.531
   17   1HG   MET   3           HG2      MET   3  65.879  14.097   8.126
   18   2HG   MET   3           HG1      MET   3  64.837  12.760   7.639
   19   1HE   MET   3           HE3      MET   3  64.373  11.034   9.280
   20   2HE   MET   3           HE2      MET   3  64.606  11.192  11.020
   21   3HE   MET   3           HE1      MET   3  63.020  11.498  10.319
   22    H    THR   4           HN       THR   4  68.920  11.996   6.763
   23    HA   THR   4           HA       THR   4  69.740  14.542   5.605
   24    HB   THR   4           HB       THR   4  70.501  13.193   3.712
   25    HG1  THR   4           HG1      THR   4  69.903  11.109   3.495
   26   1HG2  THR   4          HG21      THR   4  71.102  12.472   6.511
   27   2HG2  THR   4          HG23      THR   4  71.595  11.273   5.315
   28   3HG2  THR   4          HG22      THR   4  72.195  12.928   5.204
   29    H    ASP   5           HN       ASP   5  68.819  15.539   3.748
   30    HA   ASP   5           HA       ASP   5  65.951  15.361   3.547
   31   1HB   ASP   5           HB2      ASP   5  67.725  16.591   1.438
   32   2HB   ASP   5           HB1      ASP   5  66.115  17.099   1.954
   33    H    GLN   6           HN       GLN   6  68.456  13.501   2.182
   34    HA   GLN   6           HA       GLN   6  67.357  12.853  -0.369
   35   1HB   GLN   6           HB2      GLN   6  69.504  11.933   1.297
   36   2HB   GLN   6           HB1      GLN   6  68.605  10.533   0.712
   37   1HG   GLN   6           HG2      GLN   6  68.808  12.295  -1.485
   38   2HG   GLN   6           HG1      GLN   6  70.408  12.256  -0.743
   39   1HE2  GLN   6          HE22      GLN   6  70.671   8.624  -1.206
   40   2HE2  GLN   6          HE21      GLN   6  70.925   9.771   0.020
   41    H    GLN   7           HN       GLN   7  66.795  11.476   2.858
   42    HA   GLN   7           HA       GLN   7  65.001   9.411   1.855
   43   1HB   GLN   7           HB2      GLN   7  65.361  10.484   4.670
   44   2HB   GLN   7           HB1      GLN   7  64.521   8.996   4.231
   45   1HG   GLN   7           HG2      GLN   7  66.456   7.848   3.966
   46   2HG   GLN   7           HG1      GLN   7  67.227   9.182   3.105
   47   1HE2  GLN   7          HE22      GLN   7  69.066   8.893   6.300
   48   2HE2  GLN   7          HE21      GLN   7  68.892   7.980   4.880
   49    H    ALA   8           HN       ALA   8  64.692  12.738   2.828
   50    HA   ALA   8           HA       ALA   8  61.864  12.692   3.403
   51   1HB   ALA   8           HB2      ALA   8  63.547  14.527   4.015
   52   2HB   ALA   8           HB1      ALA   8  63.411  15.064   2.341
   53   3HB   ALA   8           HB3      ALA   8  61.992  15.075   3.389
   54    H    GLU   9           HN       GLU   9  63.720  13.613   0.485
   55    HA   GLU   9           HA       GLU   9  61.297  13.970  -1.092
   56   1HB   GLU   9           HB2      GLU   9  63.604  15.078  -1.469
   57   2HB   GLU   9           HB1      GLU   9  64.067  13.549  -2.218
   58   1HG   GLU   9           HG2      GLU   9  61.813  13.864  -3.552
   59   2HG   GLU   9           HG1      GLU   9  62.034  15.561  -3.124
   60    H    ALA  10           HN       ALA  10  63.251  11.288  -0.182
   61    HA   ALA  10           HA       ALA  10  62.825   9.587  -2.448
   62   1HB   ALA  10           HB3      ALA  10  64.414   9.249  -0.431
   63   2HB   ALA  10           HB2      ALA  10  63.003   8.586   0.393
   64   3HB   ALA  10           HB1      ALA  10  63.604   7.823  -1.079
   65    H    ARG  11           HN       ARG  11  61.121   9.624   0.709
   66    HA   ARG  11           HA       ARG  11  59.050   7.845  -0.082
   67   1HB   ARG  11           HB2      ARG  11  57.754   8.939   1.808
   68   2HB   ARG  11           HB1      ARG  11  59.337   8.295   2.254
   69   1HG   ARG  11           HG2      ARG  11  59.893  10.865   1.366
   70   2HG   ARG  11           HG1      ARG  11  58.394  11.053   2.274
   71   1HD   ARG  11           HD2      ARG  11  60.636   9.418   3.427
   72   2HD   ARG  11           HD1      ARG  11  60.687  11.177   3.548
   73    HE   ARG  11           HE       ARG  11  59.035  11.016   5.211
   74   1HH1  ARG  11          HH11      ARG  11  56.720  10.083   3.886
   75   2HH1  ARG  11          HH12      ARG  11  56.489   8.462   4.449
   76   1HH2  ARG  11          HH21      ARG  11  59.731   8.128   5.634
   77   2HH2  ARG  11          HH22      ARG  11  58.192   7.354   5.440
   78    H    ALA  12           HN       ALA  12  59.441  11.311  -0.523
   79    HA   ALA  12           HA       ALA  12  56.772  11.993  -1.199
   80   1HB   ALA  12           HB3      ALA  12  59.283  13.266  -1.252
   81   2HB   ALA  12           HB2      ALA  12  58.676  13.360  -2.904
   82   3HB   ALA  12           HB1      ALA  12  57.715  14.006  -1.574
   83    H    PHE  13           HN       PHE  13  59.265  10.333  -3.029
   84    HA   PHE  13           HA       PHE  13  57.683  10.453  -5.517
   85   1HB   PHE  13           HB2      PHE  13  60.070  10.576  -5.803
   86   2HB   PHE  13           HB1      PHE  13  60.321   9.145  -4.801
   87    HD1  PHE  13           HD2      PHE  13  59.740   6.902  -5.630
   88    HD2  PHE  13           HD1      PHE  13  59.288  10.390  -8.096
   89    HE1  PHE  13           HE2      PHE  13  59.520   5.457  -7.633
   90    HE2  PHE  13           HE1      PHE  13  59.068   8.945 -10.101
   91    HZ   PHE  13           HZ       PHE  13  59.185   6.478  -9.869
   92    H    LEU  14           HN       LEU  14  58.154   8.358  -2.798
   93    HA   LEU  14           HA       LEU  14  56.947   6.048  -4.211
   94   1HB   LEU  14           HB2      LEU  14  57.742   6.208  -1.295
   95   2HB   LEU  14           HB1      LEU  14  57.523   4.760  -2.280
   96    HG   LEU  14           HG       LEU  14  59.543   6.796  -3.147
   97   1HD1  LEU  14          HD11      LEU  14  59.659   5.116  -0.698
   98   2HD1  LEU  14          HD13      LEU  14  61.094   5.095  -1.724
   99   3HD1  LEU  14          HD12      LEU  14  60.500   6.622  -1.072
  100   1HD2  LEU  14          HD21      LEU  14  59.093   3.825  -3.396
  101   2HD2  LEU  14          HD23      LEU  14  59.285   5.021  -4.677
  102   3HD2  LEU  14          HD22      LEU  14  60.680   4.524  -3.719
  103    H    SER  15           HN       SER  15  55.116   4.914  -3.005
  104    HA   SER  15           HA       SER  15  53.202   6.983  -2.018
  105   1HB   SER  15           HB2      SER  15  52.154   4.312  -2.689
  106   2HB   SER  15           HB1      SER  15  51.556   5.904  -3.153
  107    HG   SER  15           HG       SER  15  52.572   5.683  -4.970
  108    H    GLU  16           HN       GLU  16  51.887   6.445  -0.159
  109    HA   GLU  16           HA       GLU  16  53.205   5.355   2.043
  110   1HB   GLU  16           HB2      GLU  16  50.285   5.663   1.380
  111   2HB   GLU  16           HB1      GLU  16  50.771   4.870   2.880
  112   1HG   GLU  16           HG2      GLU  16  52.371   7.027   3.015
  113   2HG   GLU  16           HG1      GLU  16  51.058   7.720   2.063
  114    H    GLU  17           HN       GLU  17  51.124   3.673  -0.297
  115    HA   GLU  17           HA       GLU  17  51.218   1.125   1.055
  116   1HB   GLU  17           HB2      GLU  17  50.469   2.049  -1.704
  117   2HB   GLU  17           HB1      GLU  17  50.657   0.325  -1.391
  118   1HG   GLU  17           HG2      GLU  17  49.134   1.583   0.730
  119   2HG   GLU  17           HG1      GLU  17  48.391   1.893  -0.841
  120    H    MET  18           HN       MET  18  53.234   2.668  -1.416
  121    HA   MET  18           HA       MET  18  54.782   0.355  -2.092
  122   1HB   MET  18           HB2      MET  18  54.739   3.086  -2.811
  123   2HB   MET  18           HB1      MET  18  56.361   2.772  -2.194
  124   1HG   MET  18           HG2      MET  18  56.564   0.833  -3.708
  125   2HG   MET  18           HG1      MET  18  54.945   1.152  -4.331
  126   1HE   MET  18           HE1      MET  18  55.213   1.364  -6.500
  127   2HE   MET  18           HE3      MET  18  56.160   2.524  -7.442
  128   3HE   MET  18           HE2      MET  18  56.940   1.108  -6.739
  129    H    ILE  19           HN       ILE  19  55.031   2.721   0.512
  130    HA   ILE  19           HA       ILE  19  57.619   1.704   1.420
  131    HB   ILE  19           HB       ILE  19  55.614   3.676   2.527
  132   1HG1  ILE  19          HG12      ILE  19  58.375   4.522   2.261
  133   2HG1  ILE  19          HG11      ILE  19  57.788   3.839   0.744
  134   1HG2  ILE  19          HG23      ILE  19  56.581   2.434   4.431
  135   2HG2  ILE  19          HG22      ILE  19  58.203   2.755   3.816
  136   3HG2  ILE  19          HG21      ILE  19  57.194   4.087   4.379
  137   1HD1  ILE  19          HD13      ILE  19  55.643   5.354   1.492
  138   2HD1  ILE  19          HD12      ILE  19  56.972   6.316   2.138
  139   3HD1  ILE  19          HD11      ILE  19  56.924   5.922   0.419
  140    H    ALA  20           HN       ALA  20  54.228   1.128   2.127
  141    HA   ALA  20           HA       ALA  20  54.641  -0.287   4.609
  142   1HB   ALA  20           HB3      ALA  20  52.433   0.606   3.254
  143   2HB   ALA  20           HB2      ALA  20  52.354  -1.126   2.935
  144   3HB   ALA  20           HB1      ALA  20  52.374  -0.536   4.596
  145    H    GLU  21           HN       GLU  21  54.967  -1.101   1.259
  146    HA   GLU  21           HA       GLU  21  54.873  -3.988   1.651
  147   1HB   GLU  21           HB2      GLU  21  54.334  -3.486  -0.541
  148   2HB   GLU  21           HB1      GLU  21  55.422  -2.103  -0.602
  149   1HG   GLU  21           HG2      GLU  21  57.220  -3.370  -1.233
  150   2HG   GLU  21           HG1      GLU  21  56.696  -4.771  -0.299
  151    H    PHE  22           HN       PHE  22  57.473  -1.589   1.109
  152    HA   PHE  22           HA       PHE  22  59.616  -3.489   1.290
  153   1HB   PHE  22           HB2      PHE  22  59.674  -0.529   1.952
  154   2HB   PHE  22           HB1      PHE  22  61.065  -1.540   1.558
  155    HD1  PHE  22           HD1      PHE  22  59.659  -3.218  -0.595
  156    HD2  PHE  22           HD2      PHE  22  59.856   1.015   0.105
  157    HE1  PHE  22           HE1      PHE  22  59.281  -2.800  -3.011
  158    HE2  PHE  22           HE2      PHE  22  59.479   1.433  -2.310
  159    HZ   PHE  22           HZ       PHE  22  59.191  -0.475  -3.868
  160    H    LYS  23           HN       LYS  23  57.823  -1.662   3.716
  161    HA   LYS  23           HA       LYS  23  59.564  -1.967   5.922
  162   1HB   LYS  23           HB2      LYS  23  57.593  -0.586   6.129
  163   2HB   LYS  23           HB1      LYS  23  56.538  -1.961   5.801
  164   1HG   LYS  23           HG2      LYS  23  56.663  -1.429   8.230
  165   2HG   LYS  23           HG1      LYS  23  57.262  -3.049   7.870
  166   1HD   LYS  23           HD2      LYS  23  59.311  -2.543   8.655
  167   2HD   LYS  23           HD1      LYS  23  59.394  -1.092   7.654
  168   1HE   LYS  23           HE2      LYS  23  59.392  -0.071   9.715
  169   2HE   LYS  23           HE1      LYS  23  57.646  -0.219   9.501
  170   1HZ   LYS  23           HZ3      LYS  23  58.121  -2.567  10.553
  171   2HZ   LYS  23           HZ2      LYS  23  59.449  -1.746  11.223
  172   3HZ   LYS  23           HZ1      LYS  23  57.869  -1.198  11.521
  173    H    ALA  24           HN       ALA  24  57.264  -4.250   4.505
  174    HA   ALA  24           HA       ALA  24  57.398  -6.216   6.578
  175   1HB   ALA  24           HB1      ALA  24  55.850  -6.024   4.453
  176   2HB   ALA  24           HB3      ALA  24  57.110  -6.999   3.697
  177   3HB   ALA  24           HB2      ALA  24  56.250  -7.611   5.109
  178    H    ALA  25           HN       ALA  25  59.426  -5.627   3.729
  179    HA   ALA  25           HA       ALA  25  60.991  -8.036   4.017
  180   1HB   ALA  25           HB3      ALA  25  61.693  -5.404   2.680
  181   2HB   ALA  25           HB2      ALA  25  62.572  -6.919   2.477
  182   3HB   ALA  25           HB1      ALA  25  60.912  -6.779   1.899
  183    H    PHE  26           HN       PHE  26  61.531  -4.652   5.033
  184    HA   PHE  26           HA       PHE  26  64.086  -4.947   6.157
  185   1HB   PHE  26           HB2      PHE  26  62.700  -2.813   5.946
  186   2HB   PHE  26           HB1      PHE  26  61.888  -3.308   7.431
  187    HD1  PHE  26           HD1      PHE  26  65.316  -2.803   6.010
  188    HD2  PHE  26           HD2      PHE  26  62.818  -2.748   9.504
  189    HE1  PHE  26           HE1      PHE  26  67.205  -1.906   7.346
  190    HE2  PHE  26           HE2      PHE  26  64.706  -1.851  10.839
  191    HZ   PHE  26           HZ       PHE  26  66.899  -1.432   9.762
  192    H    ASP  27           HN       ASP  27  61.034  -5.071   8.038
  193    HA   ASP  27           HA       ASP  27  62.124  -6.051  10.428
  194   1HB   ASP  27           HB2      ASP  27  59.696  -5.340   9.897
  195   2HB   ASP  27           HB1      ASP  27  59.459  -7.012   9.387
  196    H    MET  28           HN       MET  28  61.704  -7.708   7.409
  197    HA   MET  28           HA       MET  28  61.791 -10.386   8.553
  198   1HB   MET  28           HB2      MET  28  60.763 -10.477   6.490
  199   2HB   MET  28           HB1      MET  28  61.743  -9.174   5.826
  200   1HG   MET  28           HG2      MET  28  63.567 -10.608   5.398
  201   2HG   MET  28           HG1      MET  28  62.948 -11.862   6.471
  202   1HE   MET  28           HE2      MET  28  63.046 -10.051   3.395
  203   2HE   MET  28           HE1      MET  28  62.199 -10.984   2.164
  204   3HE   MET  28           HE3      MET  28  61.310  -9.841   3.178
  205    H    PHE  29           HN       PHE  29  64.127  -8.147   7.076
  206    HA   PHE  29           HA       PHE  29  66.317 -10.072   7.283
  207   1HB   PHE  29           HB2      PHE  29  66.095  -7.173   6.506
  208   2HB   PHE  29           HB1      PHE  29  67.675  -7.903   6.785
  209    HD1  PHE  29           HD2      PHE  29  64.550  -8.191   4.785
  210    HD2  PHE  29           HD1      PHE  29  68.658  -9.374   5.190
  211    HE1  PHE  29           HE2      PHE  29  64.483  -9.202   2.521
  212    HE2  PHE  29           HE1      PHE  29  68.592 -10.384   2.931
  213    HZ   PHE  29           HZ       PHE  29  66.507 -10.299   1.595
  214    H    ASP  30           HN       ASP  30  64.813  -7.799   9.380
  215    HA   ASP  30           HA       ASP  30  67.192  -7.499  11.094
  216   1HB   ASP  30           HB2      ASP  30  65.674  -5.590  10.875
  217   2HB   ASP  30           HB1      ASP  30  64.327  -6.571  11.454
  218    H    ALA  31           HN       ALA  31  66.935 -10.097  11.047
  219    HA   ALA  31           HA       ALA  31  64.994 -11.146  12.955
  220   1HB   ALA  31           HB3      ALA  31  66.260 -12.332  10.945
  221   2HB   ALA  31           HB2      ALA  31  67.462 -12.661  12.194
  222   3HB   ALA  31           HB1      ALA  31  65.809 -13.243  12.387
  223    H    ASP  32           HN       ASP  32  68.142  -9.740  13.142
  224    HA   ASP  32           HA       ASP  32  68.985 -11.004  15.604
  225   1HB   ASP  32           HB2      ASP  32  70.158  -9.305  13.749
  226   2HB   ASP  32           HB1      ASP  32  69.982  -8.283  15.176
  227    H    GLY  33           HN       GLY  33  67.183  -8.047  14.827
  228   1HA   GLY  33           HA2      GLY  33  65.476  -7.188  16.329
  229   2HA   GLY  33           HA1      GLY  33  66.329  -7.945  17.676
  230    H    GLY  34           HN       GLY  34  68.367  -6.356  15.435
  231   1HA   GLY  34           HA2      GLY  34  68.955  -4.282  17.456
  232   2HA   GLY  34           HA1      GLY  34  69.921  -4.631  16.021
  233    H    GLY  35           HN       GLY  35  66.986  -4.609  14.734
  234   1HA   GLY  35           HA2      GLY  35  65.611  -2.988  13.708
  235   2HA   GLY  35           HA1      GLY  35  66.351  -1.767  14.745
  236    H    ASP  36           HN       ASP  36  68.355  -3.885  12.828
  237    HA   ASP  36           HA       ASP  36  68.583  -2.058  10.570
  238   1HB   ASP  36           HB2      ASP  36  70.815  -1.256  10.984
  239   2HB   ASP  36           HB1      ASP  36  69.867  -0.902  12.430
  240    H    ILE  37           HN       ILE  37  69.534  -3.115   8.839
  241    HA   ILE  37           HA       ILE  37  70.519  -5.876   9.399
  242    HB   ILE  37           HB       ILE  37  68.764  -6.177   7.923
  243   1HG1  ILE  37          HG12      ILE  37  71.113  -5.572   6.102
  244   2HG1  ILE  37          HG11      ILE  37  70.716  -7.133   6.822
  245   1HG2  ILE  37          HG21      ILE  37  69.535  -3.477   6.822
  246   2HG2  ILE  37          HG23      ILE  37  68.394  -4.527   5.982
  247   3HG2  ILE  37          HG22      ILE  37  68.028  -3.951   7.608
  248   1HD1  ILE  37          HD11      ILE  37  68.657  -5.742   5.142
  249   2HD1  ILE  37          HD13      ILE  37  69.976  -6.598   4.348
  250   3HD1  ILE  37          HD12      ILE  37  68.886  -7.465   5.428
  251    H    SER  38           HN       SER  38  72.222  -6.618   7.778
  252    HA   SER  38           HA       SER  38  74.340  -4.556   7.687
  253   1HB   SER  38           HB2      SER  38  75.671  -6.631   6.819
  254   2HB   SER  38           HB1      SER  38  75.198  -6.578   8.514
  255    HG   SER  38           HG       SER  38  74.457  -8.504   7.897
  256    H    THR  39           HN       THR  39  75.234  -3.778   5.769
  257    HA   THR  39           HA       THR  39  73.612  -3.698   3.437
  258    HB   THR  39           HB       THR  39  75.587  -2.726   2.324
  259    HG1  THR  39           HG1      THR  39  77.547  -2.966   3.137
  260   1HG2  THR  39          HG22      THR  39  74.766  -1.913   5.070
  261   2HG2  THR  39          HG21      THR  39  76.183  -1.118   4.384
  262   3HG2  THR  39          HG23      THR  39  74.632  -1.031   3.548
  263    H    LYS  40           HN       LYS  40  75.917  -6.055   4.537
  264    HA   LYS  40           HA       LYS  40  76.478  -7.260   1.974
  265   1HB   LYS  40           HB2      LYS  40  77.180  -9.235   3.361
  266   2HB   LYS  40           HB1      LYS  40  77.937  -7.723   3.860
  267   1HG   LYS  40           HG2      LYS  40  77.168  -8.157   5.936
  268   2HG   LYS  40           HG1      LYS  40  75.559  -7.796   5.314
  269   1HD   LYS  40           HD2      LYS  40  75.505  -9.987   6.364
  270   2HD   LYS  40           HD1      LYS  40  75.352 -10.199   4.619
  271   1HE   LYS  40           HE2      LYS  40  78.107 -10.207   5.063
  272   2HE   LYS  40           HE1      LYS  40  77.452 -11.132   6.414
  273   1HZ   LYS  40           HZ1      LYS  40  76.367 -11.677   3.759
  274   2HZ   LYS  40           HZ3      LYS  40  77.941 -12.222   4.076
  275   3HZ   LYS  40           HZ2      LYS  40  76.651 -12.738   5.056
  276    H    ALA  41           HN       ALA  41  73.941  -7.683   4.392
  277    HA   ALA  41           HA       ALA  41  72.803 -10.015   3.037
  278   1HB   ALA  41           HB2      ALA  41  72.640  -9.415   5.557
  279   2HB   ALA  41           HB1      ALA  41  71.367  -8.299   5.059
  280   3HB   ALA  41           HB3      ALA  41  71.190 -10.029   4.762
  281    H    LEU  42           HN       LEU  42  72.804  -6.710   2.435
  282    HA   LEU  42           HA       LEU  42  70.105  -6.242   1.627
  283   1HB   LEU  42           HB2      LEU  42  72.612  -4.859   1.507
  284   2HB   LEU  42           HB1      LEU  42  71.858  -4.795  -0.087
  285    HG   LEU  42           HG       LEU  42  69.856  -3.829   0.797
  286   1HD1  LEU  42          HD11      LEU  42  70.985  -4.796   3.394
  287   2HD1  LEU  42          HD13      LEU  42  69.952  -3.367   3.415
  288   3HD1  LEU  42          HD12      LEU  42  69.333  -4.894   2.787
  289   1HD2  LEU  42          HD21      LEU  42  72.246  -2.597   2.198
  290   2HD2  LEU  42          HD23      LEU  42  71.745  -2.266   0.540
  291   3HD2  LEU  42          HD22      LEU  42  70.711  -1.785   1.886
  292    H    GLY  43           HN       GLY  43  72.912  -7.541  -0.137
  293   1HA   GLY  43           HA2      GLY  43  71.806  -7.651  -2.725
  294   2HA   GLY  43           HA1      GLY  43  72.946  -8.846  -2.097
  295    H    THR  44           HN       THR  44  71.125  -9.570   0.121
  296    HA   THR  44           HA       THR  44  69.612 -11.620  -1.282
  297    HB   THR  44           HB       THR  44  69.852 -10.816   1.624
  298    HG1  THR  44           HG1      THR  44  70.451 -13.316   0.532
  299   1HG2  THR  44          HG22      THR  44  67.720 -12.283   0.357
  300   2HG2  THR  44          HG21      THR  44  68.640 -13.363   1.404
  301   3HG2  THR  44          HG23      THR  44  67.926 -11.891   2.063
  302    H    VAL  45           HN       VAL  45  68.846  -8.565   0.361
  303    HA   VAL  45           HA       VAL  45  66.002  -8.865   0.347
  304    HB   VAL  45           HB       VAL  45  67.539  -6.272   0.032
  305   1HG1  VAL  45          HG11      VAL  45  64.780  -6.889   0.183
  306   2HG1  VAL  45          HG13      VAL  45  65.224  -6.215   1.750
  307   3HG1  VAL  45          HG12      VAL  45  65.525  -5.294   0.277
  308   1HG2  VAL  45          HG21      VAL  45  68.099  -8.018   1.987
  309   2HG2  VAL  45          HG23      VAL  45  68.036  -6.281   2.288
  310   3HG2  VAL  45          HG22      VAL  45  66.654  -7.297   2.694
  311    H    MET  46           HN       MET  46  68.216  -7.401  -2.040
  312    HA   MET  46           HA       MET  46  66.348  -6.478  -3.910
  313   1HB   MET  46           HB2      MET  46  68.969  -7.888  -4.507
  314   2HB   MET  46           HB1      MET  46  68.094  -6.828  -5.612
  315   1HG   MET  46           HG2      MET  46  69.332  -6.056  -2.955
  316   2HG   MET  46           HG1      MET  46  69.849  -5.530  -4.557
  317   1HE   MET  46           HE1      MET  46  69.364  -3.463  -5.443
  318   2HE   MET  46           HE3      MET  46  68.401  -2.227  -4.619
  319   3HE   MET  46           HE2      MET  46  69.747  -3.000  -3.786
  320    H    ARG  47           HN       ARG  47  67.732  -9.770  -3.681
  321    HA   ARG  47           HA       ARG  47  66.233 -10.869  -5.849
  322   1HB   ARG  47           HB2      ARG  47  68.101 -11.809  -3.952
  323   2HB   ARG  47           HB1      ARG  47  66.665 -12.815  -3.754
  324   1HG   ARG  47           HG2      ARG  47  66.660 -13.378  -6.111
  325   2HG   ARG  47           HG1      ARG  47  67.965 -12.233  -6.430
  326   1HD   ARG  47           HD2      ARG  47  68.608 -14.169  -4.318
  327   2HD   ARG  47           HD1      ARG  47  68.310 -14.919  -5.887
  328    HE   ARG  47           HE       ARG  47  70.319 -12.732  -5.502
  329   1HH1  ARG  47          HH21      ARG  47  70.276 -12.997  -8.232
  330   2HH1  ARG  47          HH22      ARG  47  71.195 -14.412  -8.624
  331   1HH2  ARG  47          HH11      ARG  47  71.037 -15.723  -5.417
  332   2HH2  ARG  47          HH12      ARG  47  71.626 -15.956  -7.031
  333    H    MET  48           HN       MET  48  65.497 -10.527  -2.394
  334    HA   MET  48           HA       MET  48  63.136 -12.099  -2.321
  335   1HB   MET  48           HB2      MET  48  63.781  -9.560  -0.788
  336   2HB   MET  48           HB1      MET  48  62.498 -10.698  -0.374
  337   1HG   MET  48           HG2      MET  48  65.206 -11.858  -0.751
  338   2HG   MET  48           HG1      MET  48  64.981 -10.852   0.677
  339   1HE   MET  48           HE2      MET  48  64.535 -11.723   2.683
  340   2HE   MET  48           HE1      MET  48  64.009 -13.362   3.059
  341   3HE   MET  48           HE3      MET  48  65.520 -13.094   2.181
  342    H    LEU  49           HN       LEU  49  63.615  -8.694  -3.238
  343    HA   LEU  49           HA       LEU  49  60.750  -8.323  -3.748
  344   1HB   LEU  49           HB2      LEU  49  62.770  -6.422  -4.849
  345   2HB   LEU  49           HB1      LEU  49  61.241  -6.089  -4.036
  346    HG   LEU  49           HG       LEU  49  63.874  -6.889  -2.783
  347   1HD1  LEU  49          HD11      LEU  49  62.352  -4.442  -3.119
  348   2HD1  LEU  49          HD13      LEU  49  62.613  -4.789  -1.410
  349   3HD1  LEU  49          HD12      LEU  49  63.991  -4.657  -2.503
  350   1HD2  LEU  49          HD21      LEU  49  61.138  -7.453  -1.905
  351   2HD2  LEU  49          HD23      LEU  49  62.666  -8.062  -1.269
  352   3HD2  LEU  49          HD22      LEU  49  62.045  -6.504  -0.726
  353    H    GLY  50           HN       GLY  50  63.399  -9.627  -5.446
  354   1HA   GLY  50           HA2      GLY  50  62.949 -10.798  -7.561
  355   2HA   GLY  50           HA1      GLY  50  61.810  -9.514  -7.971
  356    H    GLN  51           HN       GLN  51  63.974  -7.623  -6.755
  357    HA   GLN  51           HA       GLN  51  65.118  -6.819  -9.258
  358   1HB   GLN  51           HB2      GLN  51  64.840  -5.621  -6.836
  359   2HB   GLN  51           HB1      GLN  51  66.550  -6.048  -6.777
  360   1HG   GLN  51           HG2      GLN  51  67.108  -4.562  -8.410
  361   2HG   GLN  51           HG1      GLN  51  65.649  -4.892  -9.343
  362   1HE2  GLN  51          HE22      GLN  51  65.454  -2.066  -6.352
  363   2HE2  GLN  51          HE21      GLN  51  66.606  -3.307  -6.240
  364    H    ASN  52           HN       ASN  52  67.022  -7.417 -10.234
  365    HA   ASN  52           HA       ASN  52  68.906  -9.118  -8.659
  366   1HB   ASN  52           HB2      ASN  52  67.449 -10.504 -10.171
  367   2HB   ASN  52           HB1      ASN  52  68.120  -9.622 -11.543
  368   1HD2  ASN  52          HD22      ASN  52  70.426 -12.384 -11.501
  369   2HD2  ASN  52          HD21      ASN  52  68.968 -11.853 -12.189
  370    HA   PRO  53           HA       PRO  53  71.035  -5.674 -10.915
  371   1HB   PRO  53           HB2      PRO  53  72.134  -4.531  -8.669
  372   2HB   PRO  53           HB1      PRO  53  70.552  -4.077  -9.325
  373   1HG   PRO  53           HG2      PRO  53  71.183  -5.709  -6.911
  374   2HG   PRO  53           HG1      PRO  53  69.752  -4.727  -7.257
  375   1HD   PRO  53           HD2      PRO  53  69.917  -7.545  -7.463
  376   2HD   PRO  53           HD1      PRO  53  68.617  -6.525  -8.115
  377    H    THR  54           HN       THR  54  73.398  -5.441 -11.127
  378    HA   THR  54           HA       THR  54  74.812  -7.926 -10.632
  379    HB   THR  54           HB       THR  54  75.435  -6.793 -12.619
  380    HG1  THR  54           HG1      THR  54  77.225  -7.550 -11.413
  381   1HG2  THR  54          HG23      THR  54  75.092  -4.431 -10.919
  382   2HG2  THR  54          HG22      THR  54  76.500  -4.327 -11.976
  383   3HG2  THR  54          HG21      THR  54  74.899  -4.597 -12.664
  384    H    LYS  55           HN       LYS  55  76.548  -8.269  -9.183
  385    HA   LYS  55           HA       LYS  55  76.401  -7.135  -6.622
  386   1HB   LYS  55           HB2      LYS  55  77.656  -9.224  -7.235
  387   2HB   LYS  55           HB1      LYS  55  78.924  -8.205  -7.917
  388   1HG   LYS  55           HG2      LYS  55  78.199  -7.328  -5.242
  389   2HG   LYS  55           HG1      LYS  55  78.705  -9.017  -5.246
  390   1HD   LYS  55           HD2      LYS  55  80.603  -7.983  -6.866
  391   2HD   LYS  55           HD1      LYS  55  80.274  -6.569  -5.864
  392   1HE   LYS  55           HE2      LYS  55  82.001  -7.778  -4.738
  393   2HE   LYS  55           HE1      LYS  55  80.519  -8.110  -3.844
  394   1HZ   LYS  55           HZ3      LYS  55  80.574 -10.021  -5.787
  395   2HZ   LYS  55           HZ2      LYS  55  82.198  -9.903  -5.305
  396   3HZ   LYS  55           HZ1      LYS  55  80.991 -10.243  -4.158
  397    H    GLU  56           HN       GLU  56  78.036  -5.943  -9.481
  398    HA   GLU  56           HA       GLU  56  79.770  -4.062  -8.174
  399   1HB   GLU  56           HB2      GLU  56  79.014  -4.734 -10.877
  400   2HB   GLU  56           HB1      GLU  56  78.989  -2.982 -10.673
  401   1HG   GLU  56           HG2      GLU  56  81.298  -3.942  -9.322
  402   2HG   GLU  56           HG1      GLU  56  81.266  -4.717 -10.906
  403    H    GLU  57           HN       GLU  57  76.715  -3.417  -9.940
  404    HA   GLU  57           HA       GLU  57  76.362  -0.763  -9.111
  405   1HB   GLU  57           HB2      GLU  57  74.487  -2.957  -9.909
  406   2HB   GLU  57           HB1      GLU  57  73.806  -1.477  -9.229
  407   1HG   GLU  57           HG2      GLU  57  75.895  -1.185 -11.341
  408   2HG   GLU  57           HG1      GLU  57  74.294  -1.721 -11.850
  409    H    LEU  58           HN       LEU  58  75.780  -3.737  -7.329
  410    HA   LEU  58           HA       LEU  58  74.187  -2.640  -5.224
  411   1HB   LEU  58           HB2      LEU  58  74.858  -5.130  -5.791
  412   2HB   LEU  58           HB1      LEU  58  76.194  -4.806  -4.685
  413    HG   LEU  58           HG       LEU  58  73.693  -3.817  -3.597
  414   1HD1  LEU  58          HD12      LEU  58  72.982  -5.825  -5.099
  415   2HD1  LEU  58          HD11      LEU  58  73.786  -6.813  -3.882
  416   3HD1  LEU  58          HD13      LEU  58  72.426  -5.789  -3.427
  417   1HD2  LEU  58          HD23      LEU  58  75.771  -4.253  -2.325
  418   2HD2  LEU  58          HD22      LEU  58  74.424  -5.193  -1.683
  419   3HD2  LEU  58          HD21      LEU  58  75.638  -5.970  -2.700
  420    H    ASP  59           HN       ASP  59  77.727  -3.052  -5.509
  421    HA   ASP  59           HA       ASP  59  78.403  -1.994  -2.959
  422   1HB   ASP  59           HB2      ASP  59  79.782  -2.730  -5.371
  423   2HB   ASP  59           HB1      ASP  59  80.391  -1.168  -4.820
  424    H    ALA  60           HN       ALA  60  78.044  -0.331  -6.106
  425    HA   ALA  60           HA       ALA  60  78.665   2.282  -5.122
  426   1HB   ALA  60           HB2      ALA  60  76.874   1.457  -7.431
  427   2HB   ALA  60           HB1      ALA  60  77.485   3.088  -7.155
  428   3HB   ALA  60           HB3      ALA  60  78.606   1.778  -7.526
  429    H    ILE  61           HN       ILE  61  75.764   0.334  -5.004
  430    HA   ILE  61           HA       ILE  61  73.930   2.471  -4.369
  431    HB   ILE  61           HB       ILE  61  73.879  -0.525  -3.958
  432   1HG1  ILE  61          HG12      ILE  61  72.171   1.313  -5.661
  433   2HG1  ILE  61          HG11      ILE  61  73.608   0.478  -6.253
  434   1HG2  ILE  61          HG22      ILE  61  72.626   0.564  -2.112
  435   2HG2  ILE  61          HG21      ILE  61  71.683   1.462  -3.302
  436   3HG2  ILE  61          HG23      ILE  61  71.551  -0.294  -3.217
  437   1HD1  ILE  61          HD11      ILE  61  72.414  -1.654  -5.263
  438   2HD1  ILE  61          HD13      ILE  61  70.962  -0.667  -5.424
  439   3HD1  ILE  61          HD12      ILE  61  71.939  -1.034  -6.845
  440    H    ILE  62           HN       ILE  62  75.727   0.126  -2.363
  441    HA   ILE  62           HA       ILE  62  74.790   1.096   0.156
  442    HB   ILE  62           HB       ILE  62  77.354  -0.319  -0.620
  443   1HG1  ILE  62          HG12      ILE  62  75.114  -1.506   0.979
  444   2HG1  ILE  62          HG11      ILE  62  74.902  -1.336  -0.764
  445   1HG2  ILE  62          HG23      ILE  62  77.470   1.050   1.530
  446   2HG2  ILE  62          HG22      ILE  62  76.213  -0.013   2.165
  447   3HG2  ILE  62          HG21      ILE  62  77.782  -0.677   1.705
  448   1HD1  ILE  62          HD13      ILE  62  77.128  -2.503  -1.054
  449   2HD1  ILE  62          HD12      ILE  62  77.099  -2.842   0.676
  450   3HD1  ILE  62          HD11      ILE  62  75.853  -3.514  -0.375
  451    H    GLU  63           HN       GLU  63  77.569   2.016  -1.857
  452    HA   GLU  63           HA       GLU  63  78.725   3.828   0.051
  453   1HB   GLU  63           HB2      GLU  63  78.911   3.710  -2.972
  454   2HB   GLU  63           HB1      GLU  63  79.883   4.786  -1.967
  455   1HG   GLU  63           HG2      GLU  63  80.908   2.917  -0.834
  456   2HG   GLU  63           HG1      GLU  63  79.809   1.779  -1.611
  457    H    GLU  64           HN       GLU  64  75.934   4.036  -1.945
  458    HA   GLU  64           HA       GLU  64  75.889   7.006  -1.664
  459   1HB   GLU  64           HB2      GLU  64  74.521   5.075  -3.526
  460   2HB   GLU  64           HB1      GLU  64  73.858   6.689  -3.270
  461   1HG   GLU  64           HG2      GLU  64  76.782   6.432  -3.860
  462   2HG   GLU  64           HG1      GLU  64  75.637   6.246  -5.190
  463    H    VAL  65           HN       VAL  65  74.632   4.169  -0.288
  464    HA   VAL  65           HA       VAL  65  72.136   5.505   0.607
  465    HB   VAL  65           HB       VAL  65  73.173   2.675   0.906
  466   1HG1  VAL  65          HG13      VAL  65  70.732   4.028   2.075
  467   2HG1  VAL  65          HG12      VAL  65  70.844   2.279   1.877
  468   3HG1  VAL  65          HG11      VAL  65  71.981   3.121   2.931
  469   1HG2  VAL  65          HG22      VAL  65  71.484   4.101  -0.989
  470   2HG2  VAL  65          HG21      VAL  65  72.147   2.470  -1.097
  471   3HG2  VAL  65          HG23      VAL  65  70.622   2.750  -0.254
  472    H    ASP  66           HN       ASP  66  75.317   4.671   1.730
  473    HA   ASP  66           HA       ASP  66  74.595   5.022   4.566
  474   1HB   ASP  66           HB2      ASP  66  76.813   3.901   3.088
  475   2HB   ASP  66           HB1      ASP  66  77.402   5.072   4.267
  476    H    GLU  67           HN       GLU  67  73.762   7.291   3.805
  477    HA   GLU  67           HA       GLU  67  75.684   9.344   3.197
  478   1HB   GLU  67           HB2      GLU  67  72.948   9.563   4.489
  479   2HB   GLU  67           HB1      GLU  67  73.871  10.911   3.824
  480   1HG   GLU  67           HG2      GLU  67  72.797   8.519   2.307
  481   2HG   GLU  67           HG1      GLU  67  72.278  10.196   2.146
  482    H    ASP  68           HN       ASP  68  74.819   7.726   6.123
  483    HA   ASP  68           HA       ASP  68  76.081   9.864   7.766
  484   1HB   ASP  68           HB2      ASP  68  75.304   8.252   9.662
  485   2HB   ASP  68           HB1      ASP  68  74.082   9.193   8.807
  486    H    GLY  69           HN       GLY  69  76.742   6.821   6.334
  487   1HA   GLY  69           HA2      GLY  69  78.715   5.544   6.353
  488   2HA   GLY  69           HA1      GLY  69  79.466   6.838   7.288
  489    H    SER  70           HN       SER  70  76.513   5.321   8.392
  490    HA   SER  70           HA       SER  70  77.612   4.686  10.954
  491   1HB   SER  70           HB2      SER  70  75.521   3.464  11.333
  492   2HB   SER  70           HB1      SER  70  75.184   4.992  10.527
  493    HG   SER  70           HG       SER  70  74.266   2.846   9.702
  494    H    GLY  71           HN       GLY  71  77.339   2.840   7.967
  495   1HA   GLY  71           HA2      GLY  71  78.946   1.049   7.513
  496   2HA   GLY  71           HA1      GLY  71  78.998   0.719   9.246
  497    H    THR  72           HN       THR  72  75.827   1.291   8.590
  498    HA   THR  72           HA       THR  72  75.245  -1.480   7.683
  499    HB   THR  72           HB       THR  72  73.418  -1.434   9.568
  500    HG1  THR  72           HG1      THR  72  75.393   0.078  10.869
  501   1HG2  THR  72          HG21      THR  72  76.146  -2.355   9.435
  502   2HG2  THR  72          HG23      THR  72  75.740  -1.937  11.100
  503   3HG2  THR  72          HG22      THR  72  74.761  -3.113  10.222
  504    H    ILE  73           HN       ILE  73  72.552  -1.514   7.820
  505    HA   ILE  73           HA       ILE  73  71.643   1.015   6.515
  506    HB   ILE  73           HB       ILE  73  71.211  -1.831   5.568
  507   1HG1  ILE  73          HG12      ILE  73  73.321  -0.537   4.938
  508   2HG1  ILE  73          HG11      ILE  73  72.349  -1.116   3.586
  509   1HG2  ILE  73          HG21      ILE  73  69.755   0.727   4.955
  510   2HG2  ILE  73          HG23      ILE  73  69.921  -0.511   3.709
  511   3HG2  ILE  73          HG22      ILE  73  69.098  -0.887   5.223
  512   1HD1  ILE  73          HD11      ILE  73  71.665   1.578   4.638
  513   2HD1  ILE  73          HD13      ILE  73  73.200   1.440   3.779
  514   3HD1  ILE  73          HD12      ILE  73  71.695   0.993   2.974
  515    H    ASP  74           HN       ASP  74  69.424   1.511   6.874
  516    HA   ASP  74           HA       ASP  74  67.952  -0.326   8.702
  517   1HB   ASP  74           HB2      ASP  74  67.273   1.577  10.102
  518   2HB   ASP  74           HB1      ASP  74  69.032   1.435  10.074
  519    H    PHE  75           HN       PHE  75  65.574   0.513   8.893
  520    HA   PHE  75           HA       PHE  75  64.329   0.451   6.393
  521   1HB   PHE  75           HB2      PHE  75  63.286   0.260   8.751
  522   2HB   PHE  75           HB1      PHE  75  63.163   2.020   8.692
  523    HD1  PHE  75           HD2      PHE  75  62.778  -0.554   6.006
  524    HD2  PHE  75           HD1      PHE  75  60.904   2.540   8.320
  525    HE1  PHE  75           HE2      PHE  75  60.739  -0.741   4.604
  526    HE2  PHE  75           HE1      PHE  75  58.865   2.354   6.919
  527    HZ   PHE  75           HZ       PHE  75  58.783   0.713   5.061
  528    H    GLU  76           HN       GLU  76  65.205   3.338   8.306
  529    HA   GLU  76           HA       GLU  76  64.141   5.308   6.600
  530   1HB   GLU  76           HB2      GLU  76  66.594   5.276   8.361
  531   2HB   GLU  76           HB1      GLU  76  66.134   6.712   7.445
  532   1HG   GLU  76           HG2      GLU  76  65.089   7.008   9.549
  533   2HG   GLU  76           HG1      GLU  76  63.799   6.412   8.504
  534    H    GLU  77           HN       GLU  77  67.552   4.194   6.580
  535    HA   GLU  77           HA       GLU  77  68.161   5.431   4.071
  536   1HB   GLU  77           HB2      GLU  77  69.493   2.995   5.289
  537   2HB   GLU  77           HB1      GLU  77  70.197   4.106   4.114
  538   1HG   GLU  77           HG2      GLU  77  70.261   5.895   5.690
  539   2HG   GLU  77           HG1      GLU  77  69.216   5.032   6.819
  540    H    PHE  78           HN       PHE  78  66.286   2.693   4.805
  541    HA   PHE  78           HA       PHE  78  66.847   1.050   2.517
  542   1HB   PHE  78           HB2      PHE  78  65.236   0.830   4.753
  543   2HB   PHE  78           HB1      PHE  78  64.061   1.019   3.449
  544    HD1  PHE  78           HD1      PHE  78  66.991  -0.977   4.579
  545    HD2  PHE  78           HD2      PHE  78  63.663  -0.725   1.876
  546    HE1  PHE  78           HE1      PHE  78  67.367  -3.332   3.897
  547    HE2  PHE  78           HE2      PHE  78  64.038  -3.079   1.193
  548    HZ   PHE  78           HZ       PHE  78  65.891  -4.383   2.204
  549    H    LEU  79           HN       LEU  79  64.071   3.234   3.111
  550    HA   LEU  79           HA       LEU  79  62.900   3.197   0.599
  551   1HB   LEU  79           HB2      LEU  79  63.358   5.679   2.287
  552   2HB   LEU  79           HB1      LEU  79  62.121   5.484   1.044
  553    HG   LEU  79           HG       LEU  79  62.351   3.791   3.549
  554   1HD1  LEU  79          HD13      LEU  79  60.464   6.040   2.795
  555   2HD1  LEU  79          HD12      LEU  79  60.235   4.975   4.182
  556   3HD1  LEU  79          HD11      LEU  79  61.636   6.045   4.114
  557   1HD2  LEU  79          HD22      LEU  79  60.331   3.892   1.290
  558   2HD2  LEU  79          HD21      LEU  79  61.357   2.529   1.738
  559   3HD2  LEU  79          HD23      LEU  79  60.056   3.042   2.811
  560    H    VAL  80           HN       VAL  80  65.878   4.819   1.562
  561    HA   VAL  80           HA       VAL  80  66.197   6.338  -0.875
  562    HB   VAL  80           HB       VAL  80  68.265   5.388   1.131
  563   1HG1  VAL  80          HG12      VAL  80  68.365   7.164  -1.281
  564   2HG1  VAL  80          HG11      VAL  80  69.369   7.573   0.111
  565   3HG1  VAL  80          HG13      VAL  80  69.563   6.013  -0.690
  566   1HG2  VAL  80          HG22      VAL  80  66.514   7.835   0.908
  567   2HG2  VAL  80          HG21      VAL  80  66.776   6.794   2.307
  568   3HG2  VAL  80          HG23      VAL  80  68.047   7.896   1.777
  569    H    MET  81           HN       MET  81  67.460   3.190   0.231
  570    HA   MET  81           HA       MET  81  69.114   2.593  -1.962
  571   1HB   MET  81           HB2      MET  81  69.064   1.158  -0.005
  572   2HB   MET  81           HB1      MET  81  67.369   0.757  -0.296
  573   1HG   MET  81           HG2      MET  81  67.866  -0.717  -1.959
  574   2HG   MET  81           HG1      MET  81  69.193   0.269  -2.571
  575   1HE   MET  81           HE3      MET  81  70.948   0.956  -1.017
  576   2HE   MET  81           HE2      MET  81  70.966   0.379   0.647
  577   3HE   MET  81           HE1      MET  81  72.112  -0.279  -0.518
  578    H    MET  82           HN       MET  82  65.600   2.288  -1.634
  579    HA   MET  82           HA       MET  82  65.166   0.864  -4.087
  580   1HB   MET  82           HB2      MET  82  63.353   2.751  -2.553
  581   2HB   MET  82           HB1      MET  82  62.827   1.719  -3.885
  582   1HG   MET  82           HG2      MET  82  64.261   0.548  -1.507
  583   2HG   MET  82           HG1      MET  82  62.521   0.832  -1.462
  584   1HE   MET  82           HE2      MET  82  65.445  -0.702  -2.607
  585   2HE   MET  82           HE1      MET  82  64.955  -2.374  -2.861
  586   3HE   MET  82           HE3      MET  82  65.130  -1.281  -4.241
  587    H    VAL  83           HN       VAL  83  64.741   4.350  -3.359
  588    HA   VAL  83           HA       VAL  83  64.293   5.153  -6.051
  589    HB   VAL  83           HB       VAL  83  65.733   6.888  -4.048
  590   1HG1  VAL  83          HG11      VAL  83  64.530   7.278  -6.577
  591   2HG1  VAL  83          HG13      VAL  83  63.442   8.015  -5.399
  592   3HG1  VAL  83          HG12      VAL  83  65.131   8.519  -5.476
  593   1HG2  VAL  83          HG21      VAL  83  62.994   5.702  -3.892
  594   2HG2  VAL  83          HG23      VAL  83  64.098   6.149  -2.590
  595   3HG2  VAL  83          HG22      VAL  83  63.177   7.395  -3.432
  596    H    ARG  84           HN       ARG  84  67.188   4.191  -4.432
  597    HA   ARG  84           HA       ARG  84  69.090   5.594  -6.070
  598   1HB   ARG  84           HB2      ARG  84  69.244   3.081  -4.400
  599   2HB   ARG  84           HB1      ARG  84  70.632   3.689  -5.304
  600   1HG   ARG  84           HG2      ARG  84  69.503   5.906  -3.937
  601   2HG   ARG  84           HG1      ARG  84  69.621   4.589  -2.771
  602   1HD   ARG  84           HD2      ARG  84  71.744   5.547  -2.610
  603   2HD   ARG  84           HD1      ARG  84  72.020   4.269  -3.795
  604    HE   ARG  84           HE       ARG  84  72.247   7.092  -4.306
  605   1HH1  ARG  84          HH21      ARG  84  70.672   7.502  -6.307
  606   2HH1  ARG  84          HH22      ARG  84  71.109   6.501  -7.651
  607   1HH2  ARG  84          HH11      ARG  84  73.025   4.324  -5.752
  608   2HH2  ARG  84          HH12      ARG  84  72.439   4.702  -7.337
  609    H    GLN  85           HN       GLN  85  67.327   2.566  -6.465
  610    HA   GLN  85           HA       GLN  85  68.895   1.822  -8.832
  611   1HB   GLN  85           HB2      GLN  85  68.218  -0.061  -7.612
  612   2HB   GLN  85           HB1      GLN  85  66.626   0.612  -7.269
  613   1HG   GLN  85           HG2      GLN  85  65.749  -0.212  -9.175
  614   2HG   GLN  85           HG1      GLN  85  67.140   0.296 -10.132
  615   1HE2  GLN  85          HE22      GLN  85  67.784  -3.196 -10.429
  616   2HE2  GLN  85          HE21      GLN  85  67.208  -1.816 -11.234
  617    H    MET  86           HN       MET  86  65.875   3.430  -8.065
  618    HA   MET  86           HA       MET  86  65.013   3.318 -10.898
  619   1HB   MET  86           HB2      MET  86  62.932   4.230 -10.150
  620   2HB   MET  86           HB1      MET  86  63.402   3.034  -8.941
  621   1HG   MET  86           HG2      MET  86  63.108   4.693  -7.428
  622   2HG   MET  86           HG1      MET  86  64.637   5.333  -8.028
  623   1HE   MET  86           HE3      MET  86  65.102   7.051  -8.798
  624   2HE   MET  86           HE2      MET  86  64.295   8.010 -10.036
  625   3HE   MET  86           HE1      MET  86  64.100   8.433  -8.337
  626    H    LYS  87           HN       LYS  87  67.228   5.078  -9.336
  627    HA   LYS  87           HA       LYS  87  66.389   7.720 -10.397
  628   1HB   LYS  87           HB2      LYS  87  68.047   6.824  -8.220
  629   2HB   LYS  87           HB1      LYS  87  68.999   7.854  -9.292
  630   1HG   LYS  87           HG2      LYS  87  66.226   8.702  -8.507
  631   2HG   LYS  87           HG1      LYS  87  67.564   8.953  -7.384
  632   1HD   LYS  87           HD2      LYS  87  68.157  10.789  -8.535
  633   2HD   LYS  87           HD1      LYS  87  68.465   9.781  -9.949
  634   1HE   LYS  87           HE2      LYS  87  66.831  11.151 -10.831
  635   2HE   LYS  87           HE1      LYS  87  65.802   9.895 -10.140
  636   1HZ   LYS  87           HZ2      LYS  87  66.328  11.649  -8.083
  637   2HZ   LYS  87           HZ1      LYS  87  66.005  12.634  -9.429
  638   3HZ   LYS  87           HZ3      LYS  87  64.866  11.480  -8.930
  639    H    GLU  88           HN       GLU  88  67.583   5.130 -11.818
  640    HA   GLU  88           HA       GLU  88  68.940   4.759 -13.696
  641   1HB   GLU  88           HB2      GLU  88  68.405   7.727 -13.872
  642   2HB   GLU  88           HB1      GLU  88  69.381   6.889 -15.079
  643   1HG   GLU  88           HG2      GLU  88  67.476   5.278 -15.403
  644   2HG   GLU  88           HG1      GLU  88  66.504   6.294 -14.337
  645    H    ASP  89           HN       ASP  89  71.169   5.065 -14.490
  646    HA   ASP  89           HA       ASP  89  72.924   6.485 -12.530
  647   1HB   ASP  89           HB2      ASP  89  73.042   3.646 -13.497
  648   2HB   ASP  89           HB1      ASP  89  74.547   4.486 -13.125
  649    H    ALA  90           HN       ALA  90  71.892   7.012 -15.366
  650    HA   ALA  90           HA       ALA  90  74.274   8.203 -16.401
  651   1HB   ALA  90           HB3      ALA  90  73.445   5.570 -17.649
  652   2HB   ALA  90           HB2      ALA  90  74.499   6.735 -18.450
  653   3HB   ALA  90           HB1      ALA  90  75.012   5.971 -16.945
   
  No H/Q in entry =         653
  Start of MODEL   40
    1   1H    ALA   1           HT3      ALA   1  63.149  11.539  12.434
    2   2H    ALA   1           HT2      ALA   1  64.370  10.557  13.091
    3   3H    ALA   1           HT1      ALA   1  62.962  10.879  13.986
    4    HA   ALA   1           HA       ALA   1  63.677  12.870  14.688
    5   1HB   ALA   1           HB1      ALA   1  65.810  11.023  14.357
    6   2HB   ALA   1           HB3      ALA   1  66.439  12.614  13.929
    7   3HB   ALA   1           HB2      ALA   1  65.706  12.351  15.512
    8    H    SER   2           HN       SER   2  65.373  12.255  11.593
    9    HA   SER   2           HA       SER   2  64.536  14.956  10.699
   10   1HB   SER   2           HB2      SER   2  66.648  15.805  10.435
   11   2HB   SER   2           HB1      SER   2  67.015  14.690  11.748
   12    HG   SER   2           HG       SER   2  67.514  14.475   8.994
   13    H    MET   3           HN       MET   3  64.897  15.204   8.310
   14    HA   MET   3           HA       MET   3  64.909  12.541   6.945
   15   1HB   MET   3           HB2      MET   3  63.048  14.870   6.699
   16   2HB   MET   3           HB1      MET   3  63.416  13.947   5.241
   17   1HG   MET   3           HG2      MET   3  62.417  12.017   6.041
   18   2HG   MET   3           HG1      MET   3  62.714  12.439   7.729
   19   1HE   MET   3           HE2      MET   3  60.849  12.554   9.083
   20   2HE   MET   3           HE1      MET   3  59.182  12.793   8.560
   21   3HE   MET   3           HE3      MET   3  60.126  11.438   7.926
   22    H    THR   4           HN       THR   4  66.946  12.542   6.040
   23    HA   THR   4           HA       THR   4  68.319  14.869   5.100
   24    HB   THR   4           HB       THR   4  69.605  13.052   3.717
   25    HG1  THR   4           HG1      THR   4  69.226  10.969   4.607
   26   1HG2  THR   4          HG22      THR   4  69.712  13.951   6.390
   27   2HG2  THR   4          HG21      THR   4  69.955  12.206   6.452
   28   3HG2  THR   4          HG23      THR   4  71.013  13.209   5.459
   29    H    ASP   5           HN       ASP   5  68.879  15.260   2.758
   30    HA   ASP   5           HA       ASP   5  66.532  15.637   1.191
   31   1HB   ASP   5           HB2      ASP   5  69.425  16.009   0.847
   32   2HB   ASP   5           HB1      ASP   5  68.587  15.620  -0.655
   33    H    GLN   6           HN       GLN   6  69.004  13.078   1.124
   34    HA   GLN   6           HA       GLN   6  68.142  11.723  -1.205
   35   1HB   GLN   6           HB2      GLN   6  69.121   9.688  -0.151
   36   2HB   GLN   6           HB1      GLN   6  70.190  11.084  -0.021
   37   1HG   GLN   6           HG2      GLN   6  69.178  11.505   2.272
   38   2HG   GLN   6           HG1      GLN   6  68.400   9.928   2.130
   39   1HE2  GLN   6          HE22      GLN   6  71.944   8.536   1.772
   40   2HE2  GLN   6          HE21      GLN   6  70.721   8.767   0.617
   41    H    GLN   7           HN       GLN   7  67.062  11.299   2.173
   42    HA   GLN   7           HA       GLN   7  64.986   9.402   1.392
   43   1HB   GLN   7           HB2      GLN   7  65.673  10.832   3.963
   44   2HB   GLN   7           HB1      GLN   7  64.226   9.834   3.816
   45   1HG   GLN   7           HG2      GLN   7  65.440   7.867   3.563
   46   2HG   GLN   7           HG1      GLN   7  66.858   8.704   2.932
   47   1HE2  GLN   7          HE22      GLN   7  68.150   8.101   6.212
   48   2HE2  GLN   7          HE21      GLN   7  68.167   7.551   4.606
   49    H    ALA   8           HN       ALA   8  65.298  12.790   1.335
   50    HA   ALA   8           HA       ALA   8  62.549  13.502   1.894
   51   1HB   ALA   8           HB1      ALA   8  64.558  15.072   1.914
   52   2HB   ALA   8           HB3      ALA   8  64.489  15.042   0.152
   53   3HB   ALA   8           HB2      ALA   8  63.129  15.679   1.077
   54    H    GLU   9           HN       GLU   9  64.374  12.890  -1.108
   55    HA   GLU   9           HA       GLU   9  61.944  13.221  -2.729
   56   1HB   GLU   9           HB2      GLU   9  64.836  12.644  -3.291
   57   2HB   GLU   9           HB1      GLU   9  63.630  12.283  -4.527
   58   1HG   GLU   9           HG2      GLU   9  62.811  14.757  -3.827
   59   2HG   GLU   9           HG1      GLU   9  64.533  14.913  -3.475
   60    H    ALA  10           HN       ALA  10  63.672  10.663  -1.149
   61    HA   ALA  10           HA       ALA  10  62.727   8.477  -2.773
   62   1HB   ALA  10           HB3      ALA  10  64.629   8.297  -1.168
   63   2HB   ALA  10           HB2      ALA  10  63.486   8.462   0.165
   64   3HB   ALA  10           HB1      ALA  10  63.403   7.058  -0.899
   65    H    ARG  11           HN       ARG  11  61.518   9.965   0.237
   66    HA   ARG  11           HA       ARG  11  59.250   8.199   0.474
   67   1HB   ARG  11           HB2      ARG  11  60.405  10.245   2.014
   68   2HB   ARG  11           HB1      ARG  11  58.788  10.826   1.617
   69   1HG   ARG  11           HG2      ARG  11  57.752   8.901   2.566
   70   2HG   ARG  11           HG1      ARG  11  59.284   8.033   2.655
   71   1HD   ARG  11           HD2      ARG  11  60.104   9.500   4.381
   72   2HD   ARG  11           HD1      ARG  11  58.731  10.590   4.179
   73    HE   ARG  11           HE       ARG  11  57.321   8.942   5.266
   74   1HH1  ARG  11          HH11      ARG  11  59.777   7.016   4.240
   75   2HH1  ARG  11          HH12      ARG  11  60.088   6.244   5.760
   76   1HH2  ARG  11          HH21      ARG  11  58.090   8.421   7.576
   77   2HH2  ARG  11          HH22      ARG  11  59.135   7.040   7.648
   78    H    ALA  12           HN       ALA  12  59.782  11.303  -1.135
   79    HA   ALA  12           HA       ALA  12  57.030  11.859  -1.717
   80   1HB   ALA  12           HB1      ALA  12  59.637  12.707  -2.977
   81   2HB   ALA  12           HB3      ALA  12  58.089  13.206  -3.659
   82   3HB   ALA  12           HB2      ALA  12  58.518  13.673  -2.013
   83    H    PHE  13           HN       PHE  13  59.445   9.832  -3.290
   84    HA   PHE  13           HA       PHE  13  57.788   9.405  -5.666
   85   1HB   PHE  13           HB2      PHE  13  60.215   9.278  -5.880
   86   2HB   PHE  13           HB1      PHE  13  60.283   7.999  -4.668
   87    HD1  PHE  13           HD1      PHE  13  58.429   8.768  -7.845
   88    HD2  PHE  13           HD2      PHE  13  60.423   5.815  -5.448
   89    HE1  PHE  13           HE1      PHE  13  58.039   7.072  -9.612
   90    HE2  PHE  13           HE2      PHE  13  60.031   4.117  -7.213
   91    HZ   PHE  13           HZ       PHE  13  58.839   4.745  -9.295
   92    H    LEU  14           HN       LEU  14  58.498   7.685  -2.651
   93    HA   LEU  14           HA       LEU  14  56.749   5.444  -3.486
   94   1HB   LEU  14           HB2      LEU  14  58.149   5.784  -0.826
   95   2HB   LEU  14           HB1      LEU  14  57.560   4.290  -1.558
   96    HG   LEU  14           HG       LEU  14  59.701   6.003  -2.836
   97   1HD1  LEU  14          HD11      LEU  14  59.900   3.766  -0.823
   98   2HD1  LEU  14          HD13      LEU  14  61.204   4.082  -1.967
   99   3HD1  LEU  14          HD12      LEU  14  60.722   5.326  -0.816
  100   1HD2  LEU  14          HD22      LEU  14  58.479   3.299  -3.314
  101   2HD2  LEU  14          HD21      LEU  14  58.847   4.572  -4.476
  102   3HD2  LEU  14          HD23      LEU  14  60.149   3.593  -3.801
  103    H    SER  15           HN       SER  15  54.745   5.045  -2.546
  104    HA   SER  15           HA       SER  15  53.616   7.287  -0.952
  105   1HB   SER  15           HB2      SER  15  52.597   5.535  -3.001
  106   2HB   SER  15           HB1      SER  15  51.620   5.361  -1.545
  107    HG   SER  15           HG       SER  15  50.743   7.109  -2.411
  108    H    GLU  16           HN       GLU  16  52.196   6.690   0.907
  109    HA   GLU  16           HA       GLU  16  53.467   5.142   2.851
  110   1HB   GLU  16           HB2      GLU  16  51.233   5.027   3.984
  111   2HB   GLU  16           HB1      GLU  16  51.650   6.650   3.434
  112   1HG   GLU  16           HG2      GLU  16  50.199   6.494   1.549
  113   2HG   GLU  16           HG1      GLU  16  50.009   4.752   1.748
  114    H    GLU  17           HN       GLU  17  51.191   4.093   0.363
  115    HA   GLU  17           HA       GLU  17  50.804   1.433   1.408
  116   1HB   GLU  17           HB2      GLU  17  50.021   2.949  -0.940
  117   2HB   GLU  17           HB1      GLU  17  50.511   1.314  -1.385
  118   1HG   GLU  17           HG2      GLU  17  48.165   1.220  -0.871
  119   2HG   GLU  17           HG1      GLU  17  49.015   0.469   0.479
  120    H    MET  18           HN       MET  18  53.100   2.831  -0.919
  121    HA   MET  18           HA       MET  18  54.298   0.311  -1.645
  122   1HB   MET  18           HB2      MET  18  54.483   2.455  -2.962
  123   2HB   MET  18           HB1      MET  18  55.593   3.048  -1.726
  124   1HG   MET  18           HG2      MET  18  57.286   1.954  -2.723
  125   2HG   MET  18           HG1      MET  18  56.442   0.427  -2.469
  126   1HE   MET  18           HE2      MET  18  54.844  -0.638  -3.926
  127   2HE   MET  18           HE1      MET  18  55.153  -0.694  -5.659
  128   3HE   MET  18           HE3      MET  18  56.450  -1.061  -4.513
  129    H    ILE  19           HN       ILE  19  54.828   2.585   0.980
  130    HA   ILE  19           HA       ILE  19  57.339   1.288   1.787
  131    HB   ILE  19           HB       ILE  19  55.646   3.493   2.981
  132   1HG1  ILE  19          HG12      ILE  19  58.444   4.042   2.450
  133   2HG1  ILE  19          HG11      ILE  19  57.651   3.411   1.005
  134   1HG2  ILE  19          HG23      ILE  19  58.048   2.043   4.092
  135   2HG2  ILE  19          HG22      ILE  19  57.714   3.719   4.527
  136   3HG2  ILE  19          HG21      ILE  19  56.541   2.459   4.908
  137   1HD1  ILE  19          HD11      ILE  19  55.796   5.201   2.097
  138   2HD1  ILE  19          HD13      ILE  19  57.352   6.010   2.276
  139   3HD1  ILE  19          HD12      ILE  19  56.814   5.480   0.684
  140    H    ALA  20           HN       ALA  20  53.948   0.970   2.452
  141    HA   ALA  20           HA       ALA  20  54.166  -0.257   5.048
  142   1HB   ALA  20           HB3      ALA  20  52.081   0.210   3.058
  143   2HB   ALA  20           HB2      ALA  20  51.911  -1.363   3.836
  144   3HB   ALA  20           HB1      ALA  20  51.947   0.104   4.813
  145    H    GLU  21           HN       GLU  21  54.366  -1.493   1.746
  146    HA   GLU  21           HA       GLU  21  54.367  -4.288   2.588
  147   1HB   GLU  21           HB2      GLU  21  54.614  -2.791   0.039
  148   2HB   GLU  21           HB1      GLU  21  55.451  -4.343   0.094
  149   1HG   GLU  21           HG2      GLU  21  53.021  -4.931   1.273
  150   2HG   GLU  21           HG1      GLU  21  52.571  -3.777   0.016
  151    H    PHE  22           HN       PHE  22  56.854  -1.989   1.446
  152    HA   PHE  22           HA       PHE  22  59.074  -3.740   1.601
  153   1HB   PHE  22           HB2      PHE  22  58.910  -0.750   2.072
  154   2HB   PHE  22           HB1      PHE  22  60.422  -1.639   1.915
  155    HD1  PHE  22           HD1      PHE  22  58.313  -3.440  -0.108
  156    HD2  PHE  22           HD2      PHE  22  60.219   0.409   0.022
  157    HE1  PHE  22           HE1      PHE  22  58.152  -3.274  -2.577
  158    HE2  PHE  22           HE2      PHE  22  60.056   0.573  -2.446
  159    HZ   PHE  22           HZ       PHE  22  59.022  -1.269  -3.746
  160    H    LYS  23           HN       LYS  23  57.504  -1.805   4.128
  161    HA   LYS  23           HA       LYS  23  59.433  -2.137   6.174
  162   1HB   LYS  23           HB2      LYS  23  57.568  -0.631   6.498
  163   2HB   LYS  23           HB1      LYS  23  56.413  -1.956   6.346
  164   1HG   LYS  23           HG2      LYS  23  56.814  -1.330   8.722
  165   2HG   LYS  23           HG1      LYS  23  57.291  -2.994   8.382
  166   1HD   LYS  23           HD2      LYS  23  59.545  -2.538   8.575
  167   2HD   LYS  23           HD1      LYS  23  59.358  -0.867   8.043
  168   1HE   LYS  23           HE2      LYS  23  59.914  -1.147  10.502
  169   2HE   LYS  23           HE1      LYS  23  58.462  -0.201  10.171
  170   1HZ   LYS  23           HZ3      LYS  23  58.503  -3.095  10.839
  171   2HZ   LYS  23           HZ2      LYS  23  58.107  -1.846  11.922
  172   3HZ   LYS  23           HZ1      LYS  23  57.119  -2.151  10.573
  173    H    ALA  24           HN       ALA  24  57.016  -4.371   4.935
  174    HA   ALA  24           HA       ALA  24  57.197  -6.254   7.117
  175   1HB   ALA  24           HB3      ALA  24  55.788  -6.036   4.622
  176   2HB   ALA  24           HB2      ALA  24  56.538  -7.629   4.721
  177   3HB   ALA  24           HB1      ALA  24  55.439  -7.091   5.992
  178    H    ALA  25           HN       ALA  25  58.916  -5.896   4.033
  179    HA   ALA  25           HA       ALA  25  60.405  -8.380   4.372
  180   1HB   ALA  25           HB3      ALA  25  59.879  -6.876   2.207
  181   2HB   ALA  25           HB2      ALA  25  61.459  -6.208   2.624
  182   3HB   ALA  25           HB1      ALA  25  61.289  -7.932   2.295
  183    H    PHE  26           HN       PHE  26  60.764  -5.092   5.429
  184    HA   PHE  26           HA       PHE  26  63.571  -4.951   5.790
  185   1HB   PHE  26           HB2      PHE  26  61.764  -3.130   6.159
  186   2HB   PHE  26           HB1      PHE  26  61.615  -3.808   7.780
  187    HD1  PHE  26           HD1      PHE  26  64.489  -3.108   5.462
  188    HD2  PHE  26           HD2      PHE  26  62.781  -2.570   9.367
  189    HE1  PHE  26           HE1      PHE  26  66.508  -1.857   6.173
  190    HE2  PHE  26           HE2      PHE  26  64.802  -1.319  10.078
  191    HZ   PHE  26           HZ       PHE  26  66.666  -0.962   8.480
  192    H    ASP  27           HN       ASP  27  61.209  -5.642   8.395
  193    HA   ASP  27           HA       ASP  27  63.086  -6.629  10.255
  194   1HB   ASP  27           HB2      ASP  27  60.354  -6.283  10.229
  195   2HB   ASP  27           HB1      ASP  27  60.502  -8.039  10.287
  196    H    MET  28           HN       MET  28  61.942  -8.073   7.342
  197    HA   MET  28           HA       MET  28  62.285 -10.836   8.028
  198   1HB   MET  28           HB2      MET  28  61.589  -9.355   5.719
  199   2HB   MET  28           HB1      MET  28  62.991 -10.333   5.276
  200   1HG   MET  28           HG2      MET  28  61.892 -12.337   5.671
  201   2HG   MET  28           HG1      MET  28  60.794 -11.621   6.851
  202   1HE   MET  28           HE2      MET  28  62.148 -11.291   3.472
  203   2HE   MET  28           HE1      MET  28  60.803 -11.311   2.335
  204   3HE   MET  28           HE3      MET  28  61.262  -9.806   3.142
  205    H    PHE  29           HN       PHE  29  64.526  -8.401   6.717
  206    HA   PHE  29           HA       PHE  29  66.726 -10.372   6.737
  207   1HB   PHE  29           HB2      PHE  29  67.335  -7.503   6.286
  208   2HB   PHE  29           HB1      PHE  29  67.863  -8.921   5.381
  209    HD1  PHE  29           HD1      PHE  29  65.724 -10.240   4.273
  210    HD2  PHE  29           HD2      PHE  29  65.973  -6.033   5.113
  211    HE1  PHE  29           HE1      PHE  29  63.981  -9.795   2.566
  212    HE2  PHE  29           HE2      PHE  29  64.230  -5.589   3.406
  213    HZ   PHE  29           HZ       PHE  29  63.231  -7.470   2.133
  214    H    ASP  30           HN       ASP  30  65.224  -8.749   9.104
  215    HA   ASP  30           HA       ASP  30  67.645  -7.758  10.485
  216   1HB   ASP  30           HB2      ASP  30  64.768  -7.829  11.444
  217   2HB   ASP  30           HB1      ASP  30  66.098  -6.934  12.181
  218    H    ALA  31           HN       ALA  31  68.848  -9.418  11.324
  219    HA   ALA  31           HA       ALA  31  67.834 -11.955  12.128
  220   1HB   ALA  31           HB1      ALA  31  70.330 -10.485  13.027
  221   2HB   ALA  31           HB3      ALA  31  70.008 -12.192  13.331
  222   3HB   ALA  31           HB2      ALA  31  70.213 -11.615  11.678
  223    H    ASP  32           HN       ASP  32  68.971  -9.297  14.251
  224    HA   ASP  32           HA       ASP  32  67.639 -10.481  16.560
  225   1HB   ASP  32           HB2      ASP  32  69.584  -8.425  16.083
  226   2HB   ASP  32           HB1      ASP  32  68.272  -7.746  17.048
  227    H    GLY  33           HN       GLY  33  66.866  -8.058  14.152
  228   1HA   GLY  33           HA2      GLY  33  64.653  -7.303  13.651
  229   2HA   GLY  33           HA1      GLY  33  64.108  -7.954  15.198
  230    H    GLY  34           HN       GLY  34  66.747  -5.668  14.444
  231   1HA   GLY  34           HA2      GLY  34  65.602  -3.848  16.502
  232   2HA   GLY  34           HA1      GLY  34  67.261  -3.795  15.906
  233    H    GLY  35           HN       GLY  35  65.858  -4.215  13.116
  234   1HA   GLY  35           HA2      GLY  35  64.669  -2.778  11.580
  235   2HA   GLY  35           HA1      GLY  35  64.791  -1.467  12.756
  236    H    ASP  36           HN       ASP  36  67.468  -3.541  11.744
  237    HA   ASP  36           HA       ASP  36  68.574  -1.383  10.053
  238   1HB   ASP  36           HB2      ASP  36  70.279  -2.494  12.278
  239   2HB   ASP  36           HB1      ASP  36  70.535  -1.038  11.318
  240    H    ILE  37           HN       ILE  37  68.990  -2.561   8.234
  241    HA   ILE  37           HA       ILE  37  70.120  -5.302   8.562
  242    HB   ILE  37           HB       ILE  37  69.529  -5.527   6.116
  243   1HG1  ILE  37          HG12      ILE  37  67.952  -2.986   6.563
  244   2HG1  ILE  37          HG11      ILE  37  69.534  -2.987   5.783
  245   1HG2  ILE  37          HG21      ILE  37  67.391  -4.858   8.145
  246   2HG2  ILE  37          HG23      ILE  37  67.027  -5.531   6.558
  247   3HG2  ILE  37          HG22      ILE  37  67.999  -6.455   7.704
  248   1HD1  ILE  37          HD13      ILE  37  68.651  -4.672   4.143
  249   2HD1  ILE  37          HD12      ILE  37  67.055  -4.465   4.865
  250   3HD1  ILE  37          HD11      ILE  37  67.839  -3.108   4.054
  251    H    SER  38           HN       SER  38  72.249  -5.596   8.131
  252    HA   SER  38           HA       SER  38  73.962  -3.436   7.363
  253   1HB   SER  38           HB2      SER  38  74.510  -6.413   7.155
  254   2HB   SER  38           HB1      SER  38  75.717  -5.130   7.196
  255    HG   SER  38           HG       SER  38  75.407  -4.896   9.286
  256    H    THR  39           HN       THR  39  74.987  -3.039   5.322
  257    HA   THR  39           HA       THR  39  73.356  -3.450   3.026
  258    HB   THR  39           HB       THR  39  74.988  -2.323   1.815
  259    HG1  THR  39           HG1      THR  39  76.927  -3.261   3.660
  260   1HG2  THR  39          HG22      THR  39  74.477  -1.469   4.431
  261   2HG2  THR  39          HG21      THR  39  76.219  -1.278   4.230
  262   3HG2  THR  39          HG23      THR  39  75.109  -0.486   3.110
  263    H    LYS  40           HN       LYS  40  75.470  -5.601   4.618
  264    HA   LYS  40           HA       LYS  40  76.356  -7.147   2.365
  265   1HB   LYS  40           HB2      LYS  40  77.564  -7.861   4.166
  266   2HB   LYS  40           HB1      LYS  40  76.304  -7.401   5.306
  267   1HG   LYS  40           HG2      LYS  40  75.071  -9.436   4.850
  268   2HG   LYS  40           HG1      LYS  40  76.192  -9.877   3.563
  269   1HD   LYS  40           HD2      LYS  40  76.807 -11.139   5.533
  270   2HD   LYS  40           HD1      LYS  40  78.036  -9.898   5.284
  271   1HE   LYS  40           HE2      LYS  40  77.509  -8.826   7.212
  272   2HE   LYS  40           HE1      LYS  40  75.776  -8.996   6.933
  273   1HZ   LYS  40           HZ1      LYS  40  76.737 -11.540   7.421
  274   2HZ   LYS  40           HZ3      LYS  40  77.474 -10.546   8.582
  275   3HZ   LYS  40           HZ2      LYS  40  75.780 -10.587   8.452
  276    H    ALA  41           HN       ALA  41  73.459  -7.191   4.397
  277    HA   ALA  41           HA       ALA  41  72.334  -9.470   2.891
  278   1HB   ALA  41           HB3      ALA  41  71.567  -7.915   5.331
  279   2HB   ALA  41           HB2      ALA  41  70.287  -8.730   4.433
  280   3HB   ALA  41           HB1      ALA  41  71.632  -9.661   5.092
  281    H    LEU  42           HN       LEU  42  72.410  -6.054   2.716
  282    HA   LEU  42           HA       LEU  42  69.873  -5.376   1.715
  283   1HB   LEU  42           HB2      LEU  42  72.605  -4.286   1.485
  284   2HB   LEU  42           HB1      LEU  42  71.548  -3.869   0.138
  285    HG   LEU  42           HG       LEU  42  71.299  -2.153   1.815
  286   1HD1  LEU  42          HD13      LEU  42  69.202  -3.592   0.798
  287   2HD1  LEU  42          HD12      LEU  42  68.863  -3.647   2.529
  288   3HD1  LEU  42          HD11      LEU  42  69.035  -2.094   1.711
  289   1HD2  LEU  42          HD22      LEU  42  71.451  -4.465   3.615
  290   2HD2  LEU  42          HD21      LEU  42  71.855  -2.775   3.919
  291   3HD2  LEU  42          HD23      LEU  42  70.182  -3.322   4.058
  292    H    GLY  43           HN       GLY  43  72.721  -6.424  -0.192
  293   1HA   GLY  43           HA2      GLY  43  71.550  -6.489  -2.728
  294   2HA   GLY  43           HA1      GLY  43  72.798  -7.626  -2.213
  295    H    THR  44           HN       THR  44  71.118  -8.730  -0.052
  296    HA   THR  44           HA       THR  44  69.794 -10.794  -1.579
  297    HB   THR  44           HB       THR  44  69.583 -10.115   1.369
  298    HG1  THR  44           HG1      THR  44  71.551 -10.818   1.336
  299   1HG2  THR  44          HG23      THR  44  68.455 -12.251  -0.342
  300   2HG2  THR  44          HG22      THR  44  69.186 -12.793   1.170
  301   3HG2  THR  44          HG21      THR  44  67.873 -11.614   1.197
  302    H    VAL  45           HN       VAL  45  68.583  -8.170   0.519
  303    HA   VAL  45           HA       VAL  45  65.830  -8.603   0.224
  304    HB   VAL  45           HB       VAL  45  67.250  -5.923   0.272
  305   1HG1  VAL  45          HG13      VAL  45  64.410  -6.814   0.578
  306   2HG1  VAL  45          HG12      VAL  45  64.977  -5.475   1.576
  307   3HG1  VAL  45          HG11      VAL  45  65.052  -5.358  -0.182
  308   1HG2  VAL  45          HG23      VAL  45  66.309  -7.768   2.487
  309   2HG2  VAL  45          HG22      VAL  45  67.969  -7.276   2.152
  310   3HG2  VAL  45          HG21      VAL  45  66.801  -6.094   2.742
  311    H    MET  46           HN       MET  46  67.649  -6.188  -1.685
  312    HA   MET  46           HA       MET  46  65.741  -5.638  -3.620
  313   1HB   MET  46           HB2      MET  46  68.744  -5.825  -3.797
  314   2HB   MET  46           HB1      MET  46  67.777  -5.371  -5.201
  315   1HG   MET  46           HG2      MET  46  67.474  -3.989  -2.532
  316   2HG   MET  46           HG1      MET  46  68.634  -3.444  -3.744
  317   1HE   MET  46           HE3      MET  46  68.436  -2.169  -5.265
  318   2HE   MET  46           HE2      MET  46  67.423  -2.739  -6.590
  319   3HE   MET  46           HE1      MET  46  67.045  -1.214  -5.793
  320    H    ARG  47           HN       ARG  47  67.559  -8.585  -3.234
  321    HA   ARG  47           HA       ARG  47  67.073  -9.571  -5.924
  322   1HB   ARG  47           HB2      ARG  47  68.890 -10.330  -4.236
  323   2HB   ARG  47           HB1      ARG  47  67.611 -11.319  -3.529
  324   1HG   ARG  47           HG2      ARG  47  67.216 -12.391  -5.709
  325   2HG   ARG  47           HG1      ARG  47  68.478 -11.392  -6.434
  326   1HD   ARG  47           HD2      ARG  47  69.838 -13.143  -5.926
  327   2HD   ARG  47           HD1      ARG  47  69.812 -12.460  -4.300
  328    HE   ARG  47           HE       ARG  47  67.779 -14.501  -5.069
  329   1HH1  ARG  47          HH21      ARG  47  70.844 -14.044  -3.693
  330   2HH1  ARG  47          HH22      ARG  47  70.534 -15.009  -2.288
  331   1HH2  ARG  47          HH11      ARG  47  67.175 -15.469  -3.021
  332   2HH2  ARG  47          HH12      ARG  47  68.455 -15.816  -1.909
  333    H    MET  48           HN       MET  48  65.609 -10.256  -2.732
  334    HA   MET  48           HA       MET  48  63.590 -12.006  -3.846
  335   1HB   MET  48           HB2      MET  48  62.563 -11.881  -1.611
  336   2HB   MET  48           HB1      MET  48  64.301 -12.152  -1.485
  337   1HG   MET  48           HG2      MET  48  64.707 -10.058  -0.630
  338   2HG   MET  48           HG1      MET  48  63.385  -9.320  -1.534
  339   1HE   MET  48           HE3      MET  48  63.316 -12.568   0.287
  340   2HE   MET  48           HE2      MET  48  64.176 -11.757   1.593
  341   3HE   MET  48           HE1      MET  48  62.514 -12.286   1.839
  342    H    LEU  49           HN       LEU  49  63.904  -8.580  -3.670
  343    HA   LEU  49           HA       LEU  49  61.042  -8.013  -3.677
  344   1HB   LEU  49           HB2      LEU  49  63.372  -6.239  -4.472
  345   2HB   LEU  49           HB1      LEU  49  61.721  -5.701  -4.171
  346    HG   LEU  49           HG       LEU  49  63.729  -6.781  -2.196
  347   1HD1  LEU  49          HD13      LEU  49  62.347  -4.233  -2.761
  348   2HD1  LEU  49          HD12      LEU  49  62.402  -4.680  -1.056
  349   3HD1  LEU  49          HD11      LEU  49  63.898  -4.522  -1.976
  350   1HD2  LEU  49          HD21      LEU  49  61.603  -8.018  -1.871
  351   2HD2  LEU  49          HD23      LEU  49  61.916  -6.908  -0.535
  352   3HD2  LEU  49          HD22      LEU  49  60.737  -6.483  -1.776
  353    H    GLY  50           HN       GLY  50  63.397  -7.054  -6.181
  354   1HA   GLY  50           HA2      GLY  50  62.194  -8.581  -8.290
  355   2HA   GLY  50           HA1      GLY  50  61.522  -6.949  -8.288
  356    H    GLN  51           HN       GLN  51  63.558  -5.308  -7.761
  357    HA   GLN  51           HA       GLN  51  65.087  -5.270 -10.173
  358   1HB   GLN  51           HB2      GLN  51  65.569  -3.850  -7.537
  359   2HB   GLN  51           HB1      GLN  51  66.395  -3.468  -9.048
  360   1HG   GLN  51           HG2      GLN  51  64.087  -3.135 -10.076
  361   2HG   GLN  51           HG1      GLN  51  63.445  -3.203  -8.434
  362   1HE2  GLN  51          HE22      GLN  51  65.380  -0.168  -7.523
  363   2HE2  GLN  51          HE21      GLN  51  65.248  -1.757  -6.940
  364    H    ASN  52           HN       ASN  52  66.906  -6.387 -10.694
  365    HA   ASN  52           HA       ASN  52  68.567  -7.469  -8.455
  366   1HB   ASN  52           HB2      ASN  52  67.320  -9.326  -9.399
  367   2HB   ASN  52           HB1      ASN  52  67.768  -8.846 -11.036
  368   1HD2  ASN  52          HD22      ASN  52  70.421 -11.179 -10.716
  369   2HD2  ASN  52          HD21      ASN  52  68.957 -10.814 -11.492
  370    HA   PRO  53           HA       PRO  53  71.205  -5.011 -11.299
  371   1HB   PRO  53           HB2      PRO  53  72.459  -3.631  -9.280
  372   2HB   PRO  53           HB1      PRO  53  70.951  -3.096 -10.040
  373   1HG   PRO  53           HG2      PRO  53  71.365  -4.326  -7.354
  374   2HG   PRO  53           HG1      PRO  53  70.081  -3.236  -7.903
  375   1HD   PRO  53           HD2      PRO  53  69.848  -6.039  -7.586
  376   2HD   PRO  53           HD1      PRO  53  68.702  -4.986  -8.444
  377    H    THR  54           HN       THR  54  73.687  -4.922 -11.243
  378    HA   THR  54           HA       THR  54  74.713  -7.540 -10.465
  379    HB   THR  54           HB       THR  54  75.414  -6.298 -12.549
  380    HG1  THR  54           HG1      THR  54  76.683  -7.960 -11.495
  381   1HG2  THR  54          HG23      THR  54  75.719  -4.168 -10.869
  382   2HG2  THR  54          HG22      THR  54  77.386  -4.724 -11.018
  383   3HG2  THR  54          HG21      THR  54  76.471  -4.286 -12.460
  384    H    LYS  55           HN       LYS  55  76.320  -7.941  -8.878
  385    HA   LYS  55           HA       LYS  55  76.144  -6.570  -6.439
  386   1HB   LYS  55           HB2      LYS  55  77.893  -8.595  -7.606
  387   2HB   LYS  55           HB1      LYS  55  78.753  -7.555  -6.470
  388   1HG   LYS  55           HG2      LYS  55  76.478  -7.973  -5.067
  389   2HG   LYS  55           HG1      LYS  55  76.550  -9.486  -5.974
  390   1HD   LYS  55           HD2      LYS  55  79.024  -9.588  -5.231
  391   2HD   LYS  55           HD1      LYS  55  78.580  -8.357  -4.048
  392   1HE   LYS  55           HE2      LYS  55  78.372 -10.575  -3.037
  393   2HE   LYS  55           HE1      LYS  55  76.772  -9.852  -3.213
  394   1HZ   LYS  55           HZ3      LYS  55  77.469 -11.259  -5.562
  395   2HZ   LYS  55           HZ2      LYS  55  77.639 -12.281  -4.216
  396   3HZ   LYS  55           HZ1      LYS  55  76.154 -11.511  -4.519
  397    H    GLU  56           HN       GLU  56  77.902  -5.708  -9.298
  398    HA   GLU  56           HA       GLU  56  79.870  -3.995  -8.085
  399   1HB   GLU  56           HB2      GLU  56  79.264  -4.836 -10.673
  400   2HB   GLU  56           HB1      GLU  56  78.943  -3.102 -10.708
  401   1HG   GLU  56           HG2      GLU  56  81.433  -3.942  -9.321
  402   2HG   GLU  56           HG1      GLU  56  81.413  -4.142 -11.073
  403    H    GLU  57           HN       GLU  57  76.956  -3.009  -9.929
  404    HA   GLU  57           HA       GLU  57  76.946  -0.323  -9.070
  405   1HB   GLU  57           HB2      GLU  57  75.295  -1.941 -10.638
  406   2HB   GLU  57           HB1      GLU  57  74.249  -1.396  -9.328
  407   1HG   GLU  57           HG2      GLU  57  74.510   0.858  -9.876
  408   2HG   GLU  57           HG1      GLU  57  76.039   0.581 -10.709
  409    H    LEU  58           HN       LEU  58  75.645  -3.212  -7.500
  410    HA   LEU  58           HA       LEU  58  74.165  -1.869  -5.447
  411   1HB   LEU  58           HB2      LEU  58  74.363  -4.442  -6.157
  412   2HB   LEU  58           HB1      LEU  58  75.537  -4.452  -4.839
  413    HG   LEU  58           HG       LEU  58  72.903  -3.114  -4.368
  414   1HD1  LEU  58          HD11      LEU  58  72.833  -5.601  -5.447
  415   2HD1  LEU  58          HD13      LEU  58  73.051  -6.013  -3.746
  416   3HD1  LEU  58          HD12      LEU  58  71.669  -5.038  -4.247
  417   1HD2  LEU  58          HD21      LEU  58  74.845  -4.766  -2.720
  418   2HD2  LEU  58          HD23      LEU  58  74.596  -3.021  -2.628
  419   3HD2  LEU  58          HD22      LEU  58  73.324  -4.122  -2.098
  420    H    ASP  59           HN       ASP  59  77.559  -2.904  -5.653
  421    HA   ASP  59           HA       ASP  59  78.295  -2.346  -2.966
  422   1HB   ASP  59           HB2      ASP  59  79.832  -2.305  -5.566
  423   2HB   ASP  59           HB1      ASP  59  80.608  -1.914  -4.030
  424    H    ALA  60           HN       ALA  60  78.196  -0.228  -5.828
  425    HA   ALA  60           HA       ALA  60  79.236   2.085  -4.444
  426   1HB   ALA  60           HB1      ALA  60  77.859   1.581  -7.055
  427   2HB   ALA  60           HB3      ALA  60  77.937   3.238  -6.455
  428   3HB   ALA  60           HB2      ALA  60  79.423   2.333  -6.742
  429    H    ILE  61           HN       ILE  61  75.996   0.790  -5.005
  430    HA   ILE  61           HA       ILE  61  74.518   3.061  -4.093
  431    HB   ILE  61           HB       ILE  61  73.904   0.098  -4.132
  432   1HG1  ILE  61          HG12      ILE  61  73.062   2.490  -5.793
  433   2HG1  ILE  61          HG11      ILE  61  74.006   1.097  -6.325
  434   1HG2  ILE  61          HG21      ILE  61  72.122   2.417  -3.331
  435   2HG2  ILE  61          HG23      ILE  61  71.541   0.791  -3.690
  436   3HG2  ILE  61          HG22      ILE  61  72.609   1.062  -2.313
  437   1HD1  ILE  61          HD13      ILE  61  71.904  -0.268  -5.512
  438   2HD1  ILE  61          HD12      ILE  61  71.072   1.275  -5.720
  439   3HD1  ILE  61          HD11      ILE  61  71.883   0.519  -7.091
  440    H    ILE  62           HN       ILE  62  76.009   0.345  -2.392
  441    HA   ILE  62           HA       ILE  62  74.872   0.687   0.170
  442    HB   ILE  62           HB       ILE  62  77.684  -0.132  -0.616
  443   1HG1  ILE  62          HG12      ILE  62  75.171  -1.688   0.068
  444   2HG1  ILE  62          HG11      ILE  62  75.956  -1.604  -1.510
  445   1HG2  ILE  62          HG22      ILE  62  76.437   0.322   1.992
  446   2HG2  ILE  62          HG21      ILE  62  77.058  -1.318   1.810
  447   3HG2  ILE  62          HG23      ILE  62  78.135   0.061   1.591
  448   1HD1  ILE  62          HD13      ILE  62  77.906  -2.381   0.446
  449   2HD1  ILE  62          HD12      ILE  62  76.497  -3.426   0.608
  450   3HD1  ILE  62          HD11      ILE  62  77.323  -3.296  -0.944
  451    H    GLU  63           HN       GLU  63  77.799   2.236  -1.192
  452    HA   GLU  63           HA       GLU  63  78.304   3.851   1.135
  453   1HB   GLU  63           HB2      GLU  63  79.444   3.486  -1.493
  454   2HB   GLU  63           HB1      GLU  63  79.310   5.207  -1.132
  455   1HG   GLU  63           HG2      GLU  63  80.287   4.505   1.207
  456   2HG   GLU  63           HG1      GLU  63  80.852   3.083   0.328
  457    H    GLU  64           HN       GLU  64  76.255   4.267  -1.691
  458    HA   GLU  64           HA       GLU  64  75.793   7.108  -1.212
  459   1HB   GLU  64           HB2      GLU  64  74.849   5.053  -3.127
  460   2HB   GLU  64           HB1      GLU  64  73.704   6.351  -2.780
  461   1HG   GLU  64           HG2      GLU  64  75.229   8.030  -3.495
  462   2HG   GLU  64           HG1      GLU  64  76.592   6.910  -3.476
  463    H    VAL  65           HN       VAL  65  74.529   4.166   0.062
  464    HA   VAL  65           HA       VAL  65  72.037   5.479   0.988
  465    HB   VAL  65           HB       VAL  65  73.019   2.646   1.447
  466   1HG1  VAL  65          HG11      VAL  65  70.796   4.189   2.462
  467   2HG1  VAL  65          HG13      VAL  65  70.202   2.849   1.481
  468   3HG1  VAL  65          HG12      VAL  65  71.264   2.535   2.853
  469   1HG2  VAL  65          HG22      VAL  65  71.894   3.963  -0.888
  470   2HG2  VAL  65          HG21      VAL  65  72.516   2.320  -0.730
  471   3HG2  VAL  65          HG23      VAL  65  70.837   2.670  -0.319
  472    H    ASP  66           HN       ASP  66  75.145   4.366   2.176
  473    HA   ASP  66           HA       ASP  66  74.373   4.828   4.986
  474   1HB   ASP  66           HB2      ASP  66  76.444   3.379   3.611
  475   2HB   ASP  66           HB1      ASP  66  77.187   4.515   4.738
  476    H    GLU  67           HN       GLU  67  73.860   7.166   4.431
  477    HA   GLU  67           HA       GLU  67  75.922   9.002   3.674
  478   1HB   GLU  67           HB2      GLU  67  74.416  10.735   4.639
  479   2HB   GLU  67           HB1      GLU  67  73.554   9.623   3.575
  480   1HG   GLU  67           HG2      GLU  67  72.553   8.481   5.380
  481   2HG   GLU  67           HG1      GLU  67  73.716   9.118   6.543
  482    H    ASP  68           HN       ASP  68  75.044   7.550   6.745
  483    HA   ASP  68           HA       ASP  68  76.859   9.364   8.219
  484   1HB   ASP  68           HB2      ASP  68  76.125   7.945  10.195
  485   2HB   ASP  68           HB1      ASP  68  74.827   8.824   9.385
  486    H    GLY  69           HN       GLY  69  76.895   6.274   6.690
  487   1HA   GLY  69           HA2      GLY  69  78.641   4.724   6.444
  488   2HA   GLY  69           HA1      GLY  69  79.710   5.928   7.163
  489    H    SER  70           HN       SER  70  76.812   4.524   8.649
  490    HA   SER  70           HA       SER  70  78.331   3.895  11.061
  491   1HB   SER  70           HB2      SER  70  75.983   2.725  11.555
  492   2HB   SER  70           HB1      SER  70  76.174   4.475  11.646
  493    HG   SER  70           HG       SER  70  74.755   4.571  10.112
  494    H    GLY  71           HN       GLY  71  77.728   2.291   8.128
  495   1HA   GLY  71           HA2      GLY  71  78.719   0.180   7.546
  496   2HA   GLY  71           HA1      GLY  71  78.842  -0.206   9.262
  497    H    THR  72           HN       THR  72  75.812   1.092   8.491
  498    HA   THR  72           HA       THR  72  74.587  -1.484   7.749
  499    HB   THR  72           HB       THR  72  72.988  -0.782   9.890
  500    HG1  THR  72           HG1      THR  72  74.374  -0.383  11.582
  501   1HG2  THR  72          HG22      THR  72  75.202  -2.781   9.503
  502   2HG2  THR  72          HG21      THR  72  74.324  -2.708  11.031
  503   3HG2  THR  72          HG23      THR  72  73.459  -3.051   9.533
  504    H    ILE  73           HN       ILE  73  72.136  -1.161   7.523
  505    HA   ILE  73           HA       ILE  73  71.582   1.667   6.710
  506    HB   ILE  73           HB       ILE  73  70.390  -0.818   5.455
  507   1HG1  ILE  73          HG12      ILE  73  72.926  -0.576   5.193
  508   2HG1  ILE  73          HG11      ILE  73  71.998  -0.646   3.695
  509   1HG2  ILE  73          HG22      ILE  73  69.120   1.314   5.247
  510   2HG2  ILE  73          HG21      ILE  73  70.541   2.060   4.514
  511   3HG2  ILE  73          HG23      ILE  73  69.717   0.736   3.692
  512   1HD1  ILE  73          HD12      ILE  73  72.161   2.086   4.613
  513   2HD1  ILE  73          HD11      ILE  73  73.780   1.394   4.508
  514   3HD1  ILE  73          HD13      ILE  73  72.728   1.396   3.091
  515    H    ASP  74           HN       ASP  74  69.746   2.562   7.563
  516    HA   ASP  74           HA       ASP  74  68.123   0.859   9.375
  517   1HB   ASP  74           HB2      ASP  74  67.998   3.864   8.993
  518   2HB   ASP  74           HB1      ASP  74  67.321   2.931  10.327
  519    H    PHE  75           HN       PHE  75  65.732   1.073   9.269
  520    HA   PHE  75           HA       PHE  75  64.569   0.444   6.862
  521   1HB   PHE  75           HB2      PHE  75  63.458   0.540   9.155
  522   2HB   PHE  75           HB1      PHE  75  63.182   2.255   8.848
  523    HD1  PHE  75           HD2      PHE  75  63.081  -0.678   6.541
  524    HD2  PHE  75           HD1      PHE  75  60.891   2.506   8.407
  525    HE1  PHE  75           HE2      PHE  75  61.089  -1.244   5.169
  526    HE2  PHE  75           HE1      PHE  75  58.900   1.944   7.037
  527    HZ   PHE  75           HZ       PHE  75  58.998   0.068   5.418
  528    H    GLU  76           HN       GLU  76  65.162   3.740   8.066
  529    HA   GLU  76           HA       GLU  76  63.823   5.093   5.921
  530   1HB   GLU  76           HB2      GLU  76  65.706   5.806   8.082
  531   2HB   GLU  76           HB1      GLU  76  65.790   6.845   6.658
  532   1HG   GLU  76           HG2      GLU  76  63.670   7.669   6.965
  533   2HG   GLU  76           HG1      GLU  76  63.070   6.158   7.650
  534    H    GLU  77           HN       GLU  77  67.276   4.274   6.381
  535    HA   GLU  77           HA       GLU  77  68.109   5.341   3.847
  536   1HB   GLU  77           HB2      GLU  77  69.382   3.193   5.568
  537   2HB   GLU  77           HB1      GLU  77  70.176   4.035   4.237
  538   1HG   GLU  77           HG2      GLU  77  69.803   6.195   5.409
  539   2HG   GLU  77           HG1      GLU  77  69.087   5.315   6.761
  540    H    PHE  78           HN       PHE  78  66.487   2.411   4.701
  541    HA   PHE  78           HA       PHE  78  67.382   0.795   2.494
  542   1HB   PHE  78           HB2      PHE  78  66.372  -0.553   4.062
  543   2HB   PHE  78           HB1      PHE  78  65.222   0.690   4.542
  544    HD1  PHE  78           HD2      PHE  78  63.306   1.240   2.947
  545    HD2  PHE  78           HD1      PHE  78  65.744  -2.272   2.562
  546    HE1  PHE  78           HE2      PHE  78  61.561   0.186   1.532
  547    HE2  PHE  78           HE1      PHE  78  64.001  -3.331   1.150
  548    HZ   PHE  78           HZ       PHE  78  61.909  -2.100   0.634
  549    H    LEU  79           HN       LEU  79  64.526   2.877   2.988
  550    HA   LEU  79           HA       LEU  79  63.250   2.449   0.517
  551   1HB   LEU  79           HB2      LEU  79  63.477   5.068   2.032
  552   2HB   LEU  79           HB1      LEU  79  62.249   4.672   0.829
  553    HG   LEU  79           HG       LEU  79  62.686   3.062   3.357
  554   1HD1  LEU  79          HD12      LEU  79  60.765   5.328   2.761
  555   2HD1  LEU  79          HD11      LEU  79  60.546   4.198   4.098
  556   3HD1  LEU  79          HD13      LEU  79  61.961   5.250   4.055
  557   1HD2  LEU  79          HD23      LEU  79  61.411   2.366   1.043
  558   2HD2  LEU  79          HD22      LEU  79  60.964   1.750   2.636
  559   3HD2  LEU  79          HD21      LEU  79  60.088   3.114   1.939
  560    H    VAL  80           HN       VAL  80  65.952   4.618   1.302
  561    HA   VAL  80           HA       VAL  80  66.099   5.946  -1.214
  562    HB   VAL  80           HB       VAL  80  68.235   5.245   0.817
  563   1HG1  VAL  80          HG13      VAL  80  68.405   6.538  -1.864
  564   2HG1  VAL  80          HG12      VAL  80  69.333   7.272  -0.557
  565   3HG1  VAL  80          HG11      VAL  80  69.610   5.587  -0.996
  566   1HG2  VAL  80          HG23      VAL  80  66.202   7.004   1.053
  567   2HG2  VAL  80          HG22      VAL  80  67.796   7.302   1.747
  568   3HG2  VAL  80          HG21      VAL  80  67.360   8.025   0.200
  569    H    MET  81           HN       MET  81  67.735   2.993  -0.053
  570    HA   MET  81           HA       MET  81  69.207   2.401  -2.384
  571   1HB   MET  81           HB2      MET  81  69.173   1.202  -0.083
  572   2HB   MET  81           HB1      MET  81  67.846   0.256  -0.758
  573   1HG   MET  81           HG2      MET  81  69.224  -0.573  -2.535
  574   2HG   MET  81           HG1      MET  81  70.508   0.575  -2.158
  575   1HE   MET  81           HE1      MET  81  71.765   0.719  -0.115
  576   2HE   MET  81           HE3      MET  81  70.533   0.444   1.124
  577   3HE   MET  81           HE2      MET  81  72.003  -0.530   1.104
  578    H    MET  82           HN       MET  82  65.786   2.037  -1.721
  579    HA   MET  82           HA       MET  82  65.230   0.257  -3.936
  580   1HB   MET  82           HB2      MET  82  63.235   2.192  -2.761
  581   2HB   MET  82           HB1      MET  82  62.949   0.580  -3.416
  582   1HG   MET  82           HG2      MET  82  64.334   1.289  -0.819
  583   2HG   MET  82           HG1      MET  82  62.834   0.385  -1.024
  584   1HE   MET  82           HE3      MET  82  63.041  -1.290  -3.210
  585   2HE   MET  82           HE2      MET  82  63.970  -2.760  -2.929
  586   3HE   MET  82           HE1      MET  82  62.751  -2.261  -1.761
  587    H    VAL  83           HN       VAL  83  64.232   3.680  -3.549
  588    HA   VAL  83           HA       VAL  83  63.652   4.132  -6.270
  589    HB   VAL  83           HB       VAL  83  64.878   6.255  -4.509
  590   1HG1  VAL  83          HG13      VAL  83  63.534   6.181  -7.027
  591   2HG1  VAL  83          HG12      VAL  83  62.473   6.991  -5.876
  592   3HG1  VAL  83          HG11      VAL  83  64.109   7.595  -6.144
  593   1HG2  VAL  83          HG23      VAL  83  62.501   4.613  -4.014
  594   2HG2  VAL  83          HG22      VAL  83  63.336   5.730  -2.934
  595   3HG2  VAL  83          HG21      VAL  83  62.137   6.338  -4.075
  596    H    ARG  84           HN       ARG  84  66.710   3.728  -4.731
  597    HA   ARG  84           HA       ARG  84  68.470   5.235  -6.279
  598   1HB   ARG  84           HB2      ARG  84  68.744   3.196  -4.458
  599   2HB   ARG  84           HB1      ARG  84  69.326   2.437  -5.941
  600   1HG   ARG  84           HG2      ARG  84  71.289   3.452  -5.358
  601   2HG   ARG  84           HG1      ARG  84  70.546   4.847  -6.140
  602   1HD   ARG  84           HD2      ARG  84  69.787   4.461  -3.312
  603   2HD   ARG  84           HD1      ARG  84  71.482   4.865  -3.577
  604    HE   ARG  84           HE       ARG  84  69.393   6.547  -4.866
  605   1HH1  ARG  84          HH11      ARG  84  71.234   6.138  -2.044
  606   2HH1  ARG  84          HH12      ARG  84  71.771   7.783  -1.966
  607   1HH2  ARG  84          HH21      ARG  84  70.387   8.656  -5.022
  608   2HH2  ARG  84          HH22      ARG  84  71.291   9.209  -3.654
  609    H    GLN  85           HN       GLN  85  66.945   2.128  -7.140
  610    HA   GLN  85           HA       GLN  85  67.802   2.652  -9.959
  611   1HB   GLN  85           HB2      GLN  85  67.926   0.182  -8.301
  612   2HB   GLN  85           HB1      GLN  85  67.464  -0.016  -9.992
  613   1HG   GLN  85           HG2      GLN  85  69.589   1.766 -10.116
  614   2HG   GLN  85           HG1      GLN  85  70.075   0.642  -8.846
  615   1HE2  GLN  85          HE22      GLN  85  70.624  -0.574 -12.535
  616   2HE2  GLN  85          HE21      GLN  85  70.646   1.032 -11.984
  617    H    MET  86           HN       MET  86  65.200   2.445  -7.877
  618    HA   MET  86           HA       MET  86  63.307   1.079  -9.603
  619   1HB   MET  86           HB2      MET  86  63.304   2.231  -6.977
  620   2HB   MET  86           HB1      MET  86  61.951   2.906  -7.887
  621   1HG   MET  86           HG2      MET  86  61.877   0.233  -8.587
  622   2HG   MET  86           HG1      MET  86  62.351   0.176  -6.889
  623   1HE   MET  86           HE1      MET  86  61.360   2.436  -5.538
  624   2HE   MET  86           HE3      MET  86  59.662   2.222  -5.091
  625   3HE   MET  86           HE2      MET  86  60.809   0.904  -4.866
  626    H    LYS  87           HN       LYS  87  64.026   4.511  -8.925
  627    HA   LYS  87           HA       LYS  87  62.057   5.731 -10.488
  628   1HB   LYS  87           HB2      LYS  87  64.445   6.540  -9.249
  629   2HB   LYS  87           HB1      LYS  87  64.620   7.013 -10.939
  630   1HG   LYS  87           HG2      LYS  87  61.985   7.685 -10.334
  631   2HG   LYS  87           HG1      LYS  87  62.880   8.133  -8.880
  632   1HD   LYS  87           HD2      LYS  87  63.921   8.886 -11.604
  633   2HD   LYS  87           HD1      LYS  87  62.699   9.876 -10.808
  634   1HE   LYS  87           HE2      LYS  87  64.397  10.884  -9.715
  635   2HE   LYS  87           HE1      LYS  87  64.573   9.385  -8.803
  636   1HZ   LYS  87           HZ2      LYS  87  65.881   9.879 -11.418
  637   2HZ   LYS  87           HZ1      LYS  87  66.634  10.169  -9.923
  638   3HZ   LYS  87           HZ3      LYS  87  66.171   8.594 -10.345
  639    H    GLU  88           HN       GLU  88  64.975   4.058 -11.538
  640    HA   GLU  88           HA       GLU  88  65.689   3.433 -13.685
  641   1HB   GLU  88           HB2      GLU  88  63.044   2.825 -13.548
  642   2HB   GLU  88           HB1      GLU  88  63.036   3.955 -14.902
  643   1HG   GLU  88           HG2      GLU  88  64.141   2.515 -16.268
  644   2HG   GLU  88           HG1      GLU  88  65.232   1.993 -14.984
  645    H    ASP  89           HN       ASP  89  65.971   4.321 -15.940
  646    HA   ASP  89           HA       ASP  89  65.720   7.301 -15.889
  647   1HB   ASP  89           HB2      ASP  89  67.870   5.448 -16.760
  648   2HB   ASP  89           HB1      ASP  89  67.590   6.846 -17.799
  649    H    ALA  90           HN       ALA  90  63.895   5.031 -16.968
  650    HA   ALA  90           HA       ALA  90  63.196   6.454 -19.437
  651   1HB   ALA  90           HB1      ALA  90  64.670   3.927 -19.466
  652   2HB   ALA  90           HB3      ALA  90  63.145   3.829 -20.347
  653   3HB   ALA  90           HB2      ALA  90  64.342   5.047 -20.787
   
  No H/Q in entry =         653