*HEADER   MUSCLE PROTEIN                          14-MAY-97   1AJ4    
*TITLE    STRUCTURE OF CALCIUM-SATURATED CARDIAC TROPONIN C, NMR,     
*TITLE   2 1 STRUCTURE                                                
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: TROPONIN C;                                      
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 SYNONYM: CTNC;                                             
*COMPND  5 ENGINEERED: YES;                                           
*COMPND  6 MUTATION: C35S, C84S;                                      
*COMPND  7 BIOLOGICAL_UNIT: MONOMER;                                  
*COMPND  8 OTHER_DETAILS: CARDIAC TROPONIN C, CALCIUM IONS BOUND AT   
*COMPND  9 SITES II, III AND IV                                       
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: GALLUS GALLUS;                        
*SOURCE  3 ORGANISM_COMMON: CHICKEN;                                  
*SOURCE  4 ORGAN: HEART;                                              
*SOURCE  5 TISSUE: MUSCLE;                                            
*SOURCE  6 CELLULAR_LOCATION: THIN FILAMENT;                          
*SOURCE  7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  8 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3) PLYSS;                
*SOURCE  9 EXPRESSION_SYSTEM_PLASMID: PET-23D;                        
*SOURCE 10 EXPRESSION_SYSTEM_GENE: CTNC(A-CYS)                        
*KEYWDS   CARDIAC, MUSCLE PROTEIN, REGULATORY, CALCIUM BINDING        
*EXPDTA   NMR, 1 STRUCTURE                                            
*AUTHOR   S.K.SIA,M.X.LI,L.SPYRACOPOULOS,S.M.GAGNE,W.LIU,J.A.PUTKEY,  
*AUTHOR  2 B.D.SYKES                                                  
*REVDAT  1   20-MAY-98 1AJ4    0                                      
 
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assign (resid  26 and name   HB) (resid  26 and name HG1*)  2.75  1.05  1.04
assign (resid  26 and name   HB) (resid  26 and name HG2*)  2.81  1.11  1.10
assign (resid  26 and name HD1*) (resid  23 and name   HN)  3.85  2.15  2.15
assign (resid  26 and name HD1*) (resid  25 and name  HB*)  3.60  1.90  1.90
assign (resid  26 and name HD1*) (resid  25 and name   HN)  3.85  2.15  2.15
assign (resid  26 and name HD1*) (resid  26 and name   HB)  2.63  0.93  0.94
assign (resid  26 and name HD1*) (resid  26 and name HG1*)  2.46  0.76  0.76
assign (resid  26 and name HD1*) (resid  26 and name HG2*)  3.47  1.77  1.77
assign (resid  26 and name HD1*) (resid  47 and name  HE*)  3.83  2.12  2.12
assign (resid  26 and name HG1*) (resid  26 and name HG2*)  3.36  1.66  1.66
assign (resid  26 and name HG1*) (resid  23 and name   HA)  2.85  1.15  1.15
assign (resid  26 and name HG2*) (resid  23 and name   HA)  3.85  2.15  2.15
assign (resid  26 and name HG2*) (resid  47 and name  HE*)  3.85  2.15  2.15
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assign (resid  36 and name   HA) (resid  36 and name HG1*)  2.83  1.13  1.12
assign (resid  36 and name   HA) (resid  36 and name HG2*)  2.69  0.99  1.00
assign (resid  36 and name   HA) (resid  36 and name   HN)  2.77  1.07  1.08
assign (resid  36 and name   HB) (resid  36 and name HG1*)  2.72  1.02  1.02
assign (resid  36 and name HD1*) (resid  36 and name   HB)  2.79  1.09  1.08
assign (resid  36 and name HD1*) (resid  36 and name HG1*)  2.52  0.82  0.82
assign (resid  36 and name HD1*) (resid  36 and name HG2*)  2.77  1.07  1.06
assign (resid  36 and name HD1*) (resid  41 and name   HA)  3.55  1.85  1.85
assign (resid  36 and name HD1*) (resid  28 and name   HB)  3.46  1.76  1.76
assign (resid  36 and name HD1*) (resid  72 and name   HB)  3.83  2.13  2.13
assign (resid  36 and name HD1*) (resid  72 and name HG1*)  3.85  2.15  2.15
assign (resid  36 and name HG1*) (resid  36 and name HG2*)  3.11  1.41  1.41
assign (resid  36 and name HG2*) (resid  27 and name  HB1)  3.49  1.79  1.79
assign (resid  36 and name HG2*) (resid  36 and name   HB)  2.45  0.75  0.75
assign (resid  36 and name HG2*) (resid  41 and name   HA)  3.18  1.48  1.48
assign (resid  36 and name HG2*) (resid  28 and name   HA)  2.97  1.27  1.27
assign (resid  36 and name HG2*) (resid  28 and name   HN)  3.65  1.95  1.94
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assign (resid   4 and name   HB) (resid   4 and name HG1*)  2.85  1.15  1.15
assign (resid   4 and name   HB) (resid   6 and name   HN)  3.21  1.51  1.50
assign (resid   4 and name HD1*) (resid   4 and name   HA)  3.85  2.15  2.15
assign (resid   4 and name HD1*) (resid   4 and name   HB)  3.67  1.97  1.97
assign (resid   4 and name HD1*) (resid   4 and name HG1*)  2.79  1.09  1.09
assign (resid   4 and name HD1*) (resid   4 and name   HN)  3.85  2.15  2.15
assign (resid   4 and name HG2*) (resid   4 and name   HB)  2.45  0.75  0.75
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assign (resid  61 and name   HA) (resid  64 and name HG1*)  2.98  1.28  1.27
assign (resid  61 and name   HB) (resid  58 and name   HA)  2.72  1.02  1.02
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assign (resid  61 and name HD1*) (resid  61 and name   HB)  2.52  0.82  0.81
assign (resid  61 and name HD1*) (resid  61 and name HG1*)  2.42  0.72  0.73
assign (resid  61 and name HD1*) (resid  61 and name   HN)  2.83  1.13  1.12
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assign (resid  61 and name HD1*) (resid  58 and name   HA)  3.05  1.35  1.35
assign (resid  61 and name HD1*) (resid  58 and name HE21)  3.85  2.15  2.15
assign (resid  61 and name HD1*) (resid  58 and name HE22)  3.85  2.15  2.15
assign (resid  61 and name HD1*) (resid  38 and name   HA)  2.98  1.28  1.27
assign (resid  61 and name HD1*) (resid  38 and name   HB)  2.77  1.07  1.08
assign (resid  61 and name HD1*) (resid  38 and name HG2*)  3.19  1.49  1.48
assign (resid  61 and name HD1*) (resid  71 and name   HA)  3.85  2.15  2.15
assign (resid  61 and name HG1*) (resid  61 and name   HA)  3.64  1.94  1.94
assign (resid  61 and name HG2*) (resid  61 and name   HA)  3.53  1.83  1.83
assign (resid  61 and name HG2*) (resid  58 and name   HA)  3.85  2.15  2.15
assign (resid  61 and name HG2*) (resid  58 and name HE21)  3.77  2.08  2.07
assign (resid  61 and name HG2*) (resid  58 and name HE22)  3.85  2.15  2.15
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assign (resid  17 and name   HA) (resid  17 and name  HG*)  3.71  2.00  2.00
assign (resid  17 and name   HA) (resid  78 and name HD2*)  3.85  2.15  2.15
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assign (resid  17 and name  HG*) (resid  17 and name  HB*)  3.85  2.15  2.15
assign (resid  21 and name   HA) (resid  21 and name  HD*)  3.54  1.84  1.84
assign (resid  21 and name   HA) (resid  21 and name  HG*)  3.63  1.93  1.93
assign (resid  21 and name  HB*) (resid  21 and name  HD*)  3.43  1.73  1.73
assign (resid  21 and name  HB*) (resid  18 and name   HA)  3.45  1.75  1.75
assign (resid  21 and name  HD*) (resid  21 and name  HE*)  3.64  1.94  1.94
assign (resid  21 and name  HD*) (resid  21 and name  HG*)  2.96  1.26  1.26
assign (resid  21 and name  HE*) (resid  21 and name   HA)  3.85  2.15  2.15
assign (resid  21 and name  HE*) (resid  21 and name  HB*)  3.85  2.15  2.15
assign (resid  21 and name  HE*) (resid  21 and name  HG*)  3.27  1.57  1.57
assign (resid  21 and name  HE*) (resid  78 and name HD2*)  3.85  2.15  2.15
assign (resid  21 and name  HG*) (resid  21 and name  HB*)  3.64  1.94  1.94
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assign (resid  39 and name  HG*) (resid  39 and name   HN)  3.85  2.15  2.15
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assign (resid   6 and name  HD*) (resid   8 and name   HN)  3.85  2.15  2.15
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assign (resid  86 and name  HD*) (resid  86 and name   HA)  3.79  2.09  2.09
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assign (resid  12 and name   HA) (resid  12 and name HD2*)  2.54  0.84  0.84
assign (resid  12 and name   HA) (resid  12 and name HD1*)  3.77  2.07  2.06
assign (resid  12 and name  HB1) (resid  12 and name  HB2)  2.29  0.59  0.58
assign (resid  12 and name  HB1) (resid  13 and name   HN)  2.99  1.29  1.29
assign (resid  12 and name  HB2) (resid  12 and name   HA)  2.82  1.12  1.12
assign (resid  12 and name HD2*) (resid  17 and name  HE*)  3.85  2.15  2.15
assign (resid  12 and name HD2*) (resid  12 and name  HB1)  2.52  0.82  0.83
assign (resid  12 and name HD2*) (resid  12 and name  HB2)  2.79  1.09  1.08
assign (resid  12 and name HD2*) (resid  12 and name   HG)  2.44  0.74  0.73
assign (resid  12 and name HD2*) (resid  16 and name HE21)  3.41  1.71  1.71
assign (resid  12 and name HD2*) (resid  16 and name HE22)  3.74  2.04  2.04
assign (resid  12 and name HD2*) (resid   9 and name   HA)  3.10  1.40  1.40
assign (resid  12 and name HD1*) (resid  17 and name   HA)  3.85  2.15  2.15
assign (resid  12 and name HD1*) (resid  12 and name  HB1)  2.44  0.74  0.73
assign (resid  12 and name HD1*) (resid  12 and name  HB2)  2.44  0.74  0.73
assign (resid  12 and name HD1*) (resid  12 and name   HG)  2.49  0.79  0.79
assign (resid  12 and name HD1*) (resid   9 and name   HA)  2.53  0.83  0.83
assign (resid  12 and name   HG) (resid  12 and name   HA)  3.85  2.15  2.15
assign (resid  12 and name   HG) (resid  12 and name   HN)  3.46  1.76  1.76
assign (resid  12 and name   HG) (resid   9 and name   HA)  3.04  1.34  1.34
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assign (resid  29 and name  HB*) (resid  26 and name   HA)  3.31  1.61  1.60
assign (resid  29 and name HD2*) (resid  26 and name   HN)  3.85  2.15  2.15
assign (resid  29 and name HD2*) (resid  29 and name   HN)  3.85  2.15  2.15
assign (resid  29 and name HD1*) (resid  30 and name   HN)  3.85  2.15  2.15
assign (resid  29 and name HD1*) (resid  29 and name   HA)  3.85  2.15  2.15
assign (resid  29 and name HD1*) (resid  29 and name  HB*)  3.45  1.75  1.75
assign (resid  29 and name HD1*) (resid  29 and name   HN)  3.85  2.15  2.15
assign (resid  29 and name   HG) (resid  29 and name   HN)  3.58  1.88  1.88
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assign (resid  41 and name   HA) (resid  42 and name   HN)  3.85  2.15  2.15
assign (resid  41 and name   HA) (resid  41 and name  HB*)  3.34  1.64  1.64
assign (resid  41 and name   HA) (resid  41 and name HD2*)  3.64  1.94  1.94
assign (resid  41 and name   HA) (resid  45 and name   HN)  3.85  2.15  2.15
assign (resid  41 and name   HA) (resid  44 and name   HB)  3.20  1.50  1.50
assign (resid  41 and name   HA) (resid  44 and name HG2*)  3.32  1.62  1.62
assign (resid  41 and name  HB*) (resid  40 and name   HN)  3.31  1.61  1.61
assign (resid  41 and name  HB*) (resid  38 and name   HA)  3.66  1.96  1.96
assign (resid  41 and name HD1*) (resid  38 and name   HA)  3.85  2.15  2.15
assign (resid  41 and name   HG) (resid  38 and name   HA)  3.68  1.98  1.98
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assign (resid  48 and name HD1*) (resid  20 and name   HA)  3.85  2.15  2.15
assign (resid  48 and name HD1*) (resid  48 and name   HA)  3.85  2.15  2.15
assign (resid  48 and name HD1*) (resid  45 and name   HA)  3.83  2.13  2.13
assign (resid  48 and name HD1*) (resid  47 and name   HN)  3.85  2.15  2.15
assign (resid  48 and name HD1*) (resid  81 and name  HE*)  3.85  2.15  2.15
assign (resid  48 and name HD1*) (resid  44 and name HG1*)  3.85  2.15  2.15
assign (resid  48 and name   HG) (resid  48 and name   HA)  3.67  1.97  1.97
assign (resid  48 and name   HG) (resid  48 and name   HN)  3.44  1.74  1.74
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assign (resid  57 and name   HA) (resid  60 and name   HN)  3.65  1.95  1.95
assign (resid  57 and name  HB*) (resid  57 and name   HN)  3.23  1.53  1.53
assign (resid  57 and name HD1*) (resid  57 and name   HA)  3.42  1.72  1.72
assign (resid  57 and name HD1*) (resid  57 and name   HN)  3.85  2.15  2.15
assign (resid  57 and name HD1*) (resid  54 and name   HA)  3.58  1.88  1.88
assign (resid  57 and name HD1*) (resid  58 and name   HN)  3.85  2.15  2.15
assign (resid  57 and name HD1*) (resid  38 and name   HB)  3.85  2.15  2.15
assign (resid  57 and name   HG) (resid  57 and name   HN)  3.47  1.77  1.77
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assign (resid  78 and name   HA) (resid  78 and name HD2*)  2.83  1.13  1.12
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assign (resid  78 and name  HB1) (resid  78 and name   HA)  2.67  0.97  0.97
assign (resid  78 and name  HB1) (resid  78 and name   HN)  2.77  1.07  1.08
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assign (resid  78 and name HD1*) (resid  74 and name   HZ)  3.85  2.15  2.15
assign (resid  78 and name HD1*) (resid  17 and name  HB*)  3.85  2.15  2.15
assign (resid  78 and name HD1*) (resid  17 and name  HE*)  3.85  2.15  2.15
assign (resid  78 and name HD1*) (resid  17 and name  HG*)  3.85  2.15  2.15
assign (resid  78 and name HD1*) (resid  78 and name   HA)  3.85  2.15  2.15
assign (resid  78 and name HD1*) (resid  78 and name  HB2)  3.66  1.96  1.96
assign (resid  78 and name HD1*) (resid  78 and name   HN)  3.85  2.15  2.15
assign (resid  78 and name HD1*) (resid  79 and name   HN)  3.85  2.15  2.15
assign (resid  78 and name HD2*) (resid  77 and name   HN)  3.85  2.15  2.15
assign (resid  78 and name HD2*) (resid  12 and name HD1*)  3.85  2.15  2.15
assign (resid  78 and name HD2*) (resid  78 and name  HB1)  3.35  1.65  1.65
assign (resid  78 and name HD2*) (resid  78 and name   HN)  3.85  2.15  2.15
assign (resid  78 and name   HG) (resid  78 and name   HA)  2.93  1.23  1.23
assign (resid  78 and name   HG) (resid  78 and name  HB2)  2.70  1.00  1.00
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assign (resid  45 and name  HE*) (resid  45 and name   HN)  3.85  2.15  2.15
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assign (resid  45 and name  HE*) (resid  50 and name HE21)  3.85  2.15  2.15
assign (resid  45 and name  HE*) (resid  50 and name HE22)  3.85  2.15  2.15
assign (resid  45 and name  HG*) (resid  41 and name HD1*)  3.85  2.15  2.15
assign (resid  45 and name  HG*) (resid  45 and name   HA)  3.67  1.97  1.97
assign (resid  45 and name  HG*) (resid  45 and name  HB*)  3.85  2.15  2.15
assign (resid  45 and name  HG*) (resid  45 and name   HN)  3.37  1.67  1.67
assign (resid  45 and name  HG*) (resid  44 and name HG1*)  3.85  2.15  2.15
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assign (resid  47 and name  HB*) (resid  48 and name   HN)  3.85  2.15  2.15
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assign (resid  47 and name  HB*) (resid  47 and name   HN)  3.29  1.59  1.58
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assign (resid  47 and name  HE*) (resid  47 and name   HN)  3.85  2.15  2.15
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assign (resid  47 and name  HE*) (resid  44 and name HG2*)  3.85  2.15  2.15
assign (resid  47 and name  HE*) (resid  44 and name HG1*)  3.85  2.15  2.15
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assign (resid  60 and name  HE*) (resid  84 and name  HB*)  3.85  2.15  2.15
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assign (resid  54 and name  HG*) (resid  55 and name   HN)  3.85  2.15  2.15
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assign (resid  58 and name  HG*) (resid  59 and name   HN)  3.85  2.15  2.15
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assign (resid  53 and name   HB) (resid  53 and name   HA)  2.67  0.97  0.96
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assign (resid  71 and name   HB) (resid  71 and name   HA)  2.65  0.95  0.95
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assign (resid  28 and name   HA) (resid  28 and name   HB)  2.65  0.95  0.94
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assign (resid  44 and name   HA) (resid  44 and name   HB)  2.67  0.97  0.97
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assign (resid   9 and name   HB) (resid  10 and name   HN)  2.58  0.88  0.88
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assign (resid  78 and name HD1*) (resid  74 and name  HD*)  3.85  2.15  2.15
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assign (resid   5 and name  HE*) (resid   5 and name  HB2)  3.85  2.15  2.15
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assign (resid   6 and name    N) (resid   6 and name   CA)
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assign (resid   8 and name    N) (resid   8 and name   CA)
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assign (resid  10 and name    N) (resid  10 and name   CA)
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assign (resid  11 and name    N) (resid  11 and name   CA)
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assign (resid  12 and name    N) (resid  12 and name   CA)
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assign (resid  13 and name    N) (resid  13 and name   CA)
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assign (resid  14 and name    N) (resid  14 and name   CA)
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assign (resid  17 and name    N) (resid  17 and name   CA)
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assign (resid  18 and name    N) (resid  18 and name   CA)
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assign (resid  19 and name    N) (resid  19 and name   CA)
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assign (resid  20 and name    N) (resid  20 and name   CA)
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assign (resid  23 and name    N) (resid  23 and name   CA)
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assign (resid  24 and name    N) (resid  24 and name   CA)
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assign (resid  25 and name    N) (resid  25 and name   CA)
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assign (resid  28 and name    N) (resid  28 and name   CA)
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assign (resid  31 and name    N) (resid  31 and name   CA)
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assign (resid  38 and name    N) (resid  38 and name   CA)
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assign (resid  39 and name    N) (resid  39 and name   CA)
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assign (resid  40 and name    N) (resid  40 and name   CA)
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assign (resid  43 and name    N) (resid  43 and name   CA)
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assign (resid  45 and name    N) (resid  45 and name   CA)
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assign (resid  46 and name    N) (resid  46 and name   CA)
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assign (resid  47 and name    N) (resid  47 and name   CA)
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assign (resid  50 and name    N) (resid  50 and name   CA)
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assign (resid  54 and name    N) (resid  54 and name   CA)
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assign (resid  58 and name    N) (resid  58 and name   CA)
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assign (resid  60 and name    N) (resid  60 and name   CA)
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assign (resid  61 and name    N) (resid  61 and name   CA)
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assign (resid  62 and name    N) (resid  62 and name   CA)
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assign (resid  65 and name    N) (resid  65 and name   CA)
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assign (resid  66 and name    N) (resid  66 and name   CA)
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assign (resid  71 and name    N) (resid  71 and name   CA)
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assign (resid  80 and name    N) (resid  80 and name   CA)
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assign (resid  82 and name    N) (resid  82 and name   CA)
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assign (resid  44 and name    N) (resid  44 and name   CA)
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assign (resid  26 and name    N) (resid  26 and name   CA)
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assign (resid  48 and name    N) (resid  48 and name   CA)
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assign (resid  11 and name    N) (resid  11 and name   CA)
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assign (resid  12 and name    N) (resid  12 and name   CA)
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assign (resid  27 and name    N) (resid  27 and name   CA)
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assign (resid  38 and name    N) (resid  38 and name   CA)
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assign (resid  46 and name    N) (resid  46 and name   CA)
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assign (resid  50 and name    N) (resid  50 and name   CA)
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assign (resid  51 and name    N) (resid  51 and name   CA)
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assign (resid  61 and name    N) (resid  61 and name   CA)
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assign (resid  65 and name    N) (resid  65 and name   CA)
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assign (resid  74 and name    N) (resid  74 and name   CA)
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assign (resid  76 and name    N) (resid  76 and name   CA)
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assign (resid  78 and name    N) (resid  78 and name   CA)
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assign (resid  97 and name   HA) (resid 153 and name  HE*)  3.85  2.15  2.15
assign (resid  97 and name  HB1) (resid 153 and name  HE*)  3.85  2.15  2.15
assign (resid  97 and name  HB2) (resid 153 and name  HE*)  3.85  2.15  2.15
assign (resid 103 and name  HE*) (resid 104 and name  HD*)  3.85  2.15  2.15
assign (resid 120 and name   HA) (resid 104 and name  HD*)  3.85  2.15  2.15
assign (resid 120 and name   HA) (resid 104 and name  HE*)  3.85  2.15  2.15
assign (resid 120 and name  HE*) (resid 153 and name  HE*)  3.85  2.15  2.15
assign (resid 120 and name  HG*) (resid 104 and name  HE*)  3.85  2.15  2.15
assign (resid 137 and name  HE*) (resid 156 and name  HD*)  3.85  2.15  2.15
assign (resid 137 and name  HE*) (resid 156 and name  HE*)  3.85  2.15  2.15
assign (resid 157 and name   HA) (resid 156 and name  HD*)  3.85  2.15  2.15
assign (resid 157 and name  HE*) (resid 156 and name  HD*)  3.85  2.15  2.15
assign (resid 157 and name  HE*) (resid 156 and name  HE*)  3.85  2.15  2.15
assign (resid 102 and name   HA) (resid 101 and name  HD*)  3.85  2.15  2.15
assign (resid 147 and name  HB2) (resid 111 and name  HD*)  3.85  2.15  2.15
assign (resid 147 and name  HB1) (resid 111 and name  HD*)  3.85  2.15  2.15
assign (resid 147 and name  HD*) (resid 111 and name  HD*)  3.85  2.15  2.15
assign (resid 147 and name  HG*) (resid 111 and name  HD*)  3.85  2.15  2.15
assign (resid  98 and name   HA) (resid 150 and name  HE*)  3.58  1.88  1.88
assign (resid  98 and name  HB*) (resid 150 and name  HE*)  3.85  2.15  2.15
assign (resid 160 and name HG2*) (resid 156 and name  HD*)  3.85  2.15  2.15
assign (resid 160 and name HG2*) (resid 156 and name  HE*)  3.85  2.15  2.15
assign (resid 111 and name   HA) (resid 101 and name  HE*)  3.85  2.15  2.15
assign (resid 111 and name   HA) (resid 111 and name  HD*)  3.68  1.98  1.98
assign (resid 111 and name   HA) (resid 111 and name  HE*)  3.85  2.15  2.15
assign (resid 111 and name  HB1) (resid 111 and name  HD*)  3.61  1.91  1.91
assign (resid 111 and name  HB2) (resid 111 and name  HD*)  3.61  1.91  1.91
assign (resid 111 and name  HE*) (resid 149 and name  HB1)  3.56  1.86  1.86
assign (resid 150 and name   HA) (resid 101 and name  HE*)  3.72  2.02  2.02
assign (resid 150 and name   HA) (resid 153 and name  HD*)  3.85  2.15  2.15
assign (resid 150 and name   HA) (resid 150 and name  HD*)  3.38  1.68  1.67
assign (resid 150 and name  HB2) (resid 150 and name  HD*)  3.60  1.90  1.90
assign (resid 150 and name  HB1) (resid 150 and name  HD*)  3.44  1.74  1.73
assign (resid 150 and name  HD*) (resid 101 and name  HB*)  3.85  2.15  2.15
assign (resid 150 and name  HD*) (resid 150 and name  HE*)  2.97  1.27  1.27
assign (resid 150 and name  HE*) (resid 154 and name   HG)  3.85  2.15  2.15
assign (resid 150 and name  HE*) (resid 150 and name   HA)  3.85  2.15  2.15
assign (resid 150 and name  HE*) (resid 150 and name  HB2)  3.85  2.15  2.15
assign (resid 150 and name  HE*) (resid 150 and name  HB1)  3.85  2.15  2.15
assign (resid 105 and name  OD1) (segid CA2 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 107 and name  OD1) (segid CA2 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 109 and name  OD1) (segid CA2 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 111 and name    O) (segid CA2 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 116 and name  OE1) (segid CA2 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 116 and name  OE2) (segid CA2 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 110 and name   HN) (resid 105 and name  OD2)  2.00  0.30  0.30
assign (resid 110 and name    N) (resid 105 and name  OD2)  2.90  0.40  0.40
assign (resid 141 and name  OD1) (segid CA3 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 143 and name  OD1) (segid CA3 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 145 and name  OD1) (segid CA3 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 147 and name    O) (segid CA3 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 152 and name  OE1) (segid CA3 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 152 and name  OE2) (segid CA3 and resid  1 and name  CAL)  2.40  0.40  0.40
assign (resid 146 and name   HN) (resid 141 and name  OD2)  2.00  0.30  0.30
assign (resid 146 and name    N) (resid 141 and name  OD2)  2.90  0.40  0.40
assign (resid  86 and name    C) (resid  87 and name    N)
       (resid  87 and name   CA) (resid  87 and name    C)  1.0 -120.0   43.0 2
assign (resid  87 and name    C) (resid  88 and name    N)
       (resid  88 and name   CA) (resid  88 and name    C)  1.0 -120.0   43.0 2
assign (resid  94 and name    C) (resid  95 and name    N)
       (resid  95 and name   CA) (resid  95 and name    C)  1.0  -65.0   20.0 2
assign (resid  95 and name    C) (resid  96 and name    N)
       (resid  96 and name   CA) (resid  96 and name    C)  1.0  -70.5   20.0 2
assign (resid  96 and name    C) (resid  97 and name    N)
       (resid  97 and name   CA) (resid  97 and name    C)  1.0  -67.0   20.0 2
assign (resid  97 and name    C) (resid  98 and name    N)
       (resid  98 and name   CA) (resid  98 and name    C)  1.0  -59.5   20.0 2
assign (resid  99 and name    C) (resid 100 and name    N)
       (resid 100 and name   CA) (resid 100 and name    C)  1.0  -63.5   20.0 2
assign (resid 101 and name    C) (resid 102 and name    N)
       (resid 102 and name   CA) (resid 102 and name    C)  1.0  -62.5   20.0 2
assign (resid 103 and name    C) (resid 104 and name    N)
       (resid 104 and name   CA) (resid 104 and name    C)  1.0 -120.0   37.0 2
assign (resid 105 and name    C) (resid 106 and name    N)
       (resid 106 and name   CA) (resid 106 and name    C)  1.0  -59.0   20.0 2
assign (resid 108 and name    C) (resid 109 and name    N)
       (resid 109 and name   CA) (resid 109 and name    C)  1.0 -120.0   29.0 2
assign (resid 110 and name    C) (resid 111 and name    N)
       (resid 111 and name   CA) (resid 111 and name    C)  1.0 -120.0   31.0 2
assign (resid 111 and name    C) (resid 112 and name    N)
       (resid 112 and name   CA) (resid 112 and name    C)  1.0 -120.0   32.0 2
assign (resid 112 and name    C) (resid 113 and name    N)
       (resid 113 and name   CA) (resid 113 and name    C)  1.0 -120.0   26.0 2
assign (resid 113 and name    C) (resid 114 and name    N)
       (resid 114 and name   CA) (resid 114 and name    C)  1.0  -49.0   20.0 2
assign (resid 115 and name    C) (resid 116 and name    N)
       (resid 116 and name   CA) (resid 116 and name    C)  1.0  -66.0   20.0 2
assign (resid 116 and name    C) (resid 117 and name    N)
       (resid 117 and name   CA) (resid 117 and name    C)  1.0  -59.5   20.0 2
assign (resid 122 and name    C) (resid 123 and name    N)
       (resid 123 and name   CA) (resid 123 and name    C)  1.0  -69.5   20.0 2
assign (resid 123 and name    C) (resid 124 and name    N)
       (resid 124 and name   CA) (resid 124 and name    C)  1.0 -120.0   37.0 2
assign (resid 127 and name    C) (resid 128 and name    N)
       (resid 128 and name   CA) (resid 128 and name    C)  1.0 -120.0   34.0 2
assign (resid 128 and name    C) (resid 129 and name    N)
       (resid 129 and name   CA) (resid 129 and name    C)  1.0 -120.0   38.0 2
assign (resid 129 and name    C) (resid 130 and name    N)
       (resid 130 and name   CA) (resid 130 and name    C)  1.0  -53.5   20.0 2
assign (resid 131 and name    C) (resid 132 and name    N)
       (resid 132 and name   CA) (resid 132 and name    C)  1.0  -72.0   20.0 2
assign (resid 133 and name    C) (resid 134 and name    N)
       (resid 134 and name   CA) (resid 134 and name    C)  1.0  -60.5   20.0 2
assign (resid 134 and name    C) (resid 135 and name    N)
       (resid 135 and name   CA) (resid 135 and name    C)  1.0  -69.0   20.0 2
assign (resid 141 and name    C) (resid 142 and name    N)
       (resid 142 and name   CA) (resid 142 and name    C)  1.0  -69.0   20.0 2
assign (resid 142 and name    C) (resid 143 and name    N)
       (resid 143 and name   CA) (resid 143 and name    C)  1.0 -120.0   27.0 2
assign (resid 147 and name    C) (resid 148 and name    N)
       (resid 148 and name   CA) (resid 148 and name    C)  1.0 -120.0   30.0 2
assign (resid 148 and name    C) (resid 149 and name    N)
       (resid 149 and name   CA) (resid 149 and name    C)  1.0 -120.0   29.0 2
assign (resid 149 and name    C) (resid 150 and name    N)
       (resid 150 and name   CA) (resid 150 and name    C)  1.0  -50.0   20.0 2
assign (resid 151 and name    C) (resid 152 and name    N)
       (resid 152 and name   CA) (resid 152 and name    C)  1.0  -62.5   20.0 2
assign (resid 152 and name    C) (resid 153 and name    N)
       (resid 153 and name   CA) (resid 153 and name    C)  1.0  -55.5   20.0 2
assign (resid 153 and name    C) (resid 154 and name    N)
       (resid 154 and name   CA) (resid 154 and name    C)  1.0  -58.0   20.0 2
assign (resid 154 and name    C) (resid 155 and name    N)
       (resid 155 and name   CA) (resid 155 and name    C)  1.0  -73.5   20.0 2
assign (resid 156 and name    C) (resid 157 and name    N)
       (resid 157 and name   CA) (resid 157 and name    C)  1.0  -72.0   20.0 2
assign (resid 157 and name    C) (resid 158 and name    N)
       (resid 158 and name   CA) (resid 158 and name    C)  1.0  -72.0   20.0 2
assign (resid 160 and name    C) (resid 161 and name    N)
       (resid 161 and name   CA) (resid 161 and name    C)  1.0 -120.0   42.0 2
assign (resid 135 and name    C) (resid 136 and name    N)
       (resid 136 and name   CA) (resid 136 and name    C)  1.0  -60.0   20.0 2
assign (resid 136 and name    C) (resid 137 and name    N)
       (resid 137 and name   CA) (resid 137 and name    C)  1.0  -60.0   20.0 2
assign (resid 137 and name    C) (resid 138 and name    N)
       (resid 138 and name   CA) (resid 138 and name    C)  1.0  -65.0   25.0 2
assign (resid 138 and name    C) (resid 139 and name    N)
       (resid 139 and name   CA) (resid 139 and name    C)  1.0  -65.0   25.0 2
assign (resid  92 and name    N) (resid  92 and name   CA)
       (resid  92 and name    C) (resid  93 and name    N)  1.0  120.0  100.0 2
assign (resid  93 and name    N) (resid  93 and name   CA)
       (resid  93 and name    C) (resid  94 and name    N)  1.0  120.0  100.0 2
assign (resid  94 and name    N) (resid  94 and name   CA)
       (resid  94 and name    C) (resid  95 and name    N)  1.0  -30.0  110.0 2
assign (resid  96 and name    N) (resid  96 and name   CA)
       (resid  96 and name    C) (resid  97 and name    N)  1.0  -30.0  110.0 2
assign (resid  99 and name    N) (resid  99 and name   CA)
       (resid  99 and name    C) (resid 100 and name    N)  1.0  -30.0  110.0 2
assign (resid 100 and name    N) (resid 100 and name   CA)
       (resid 100 and name    C) (resid 101 and name    N)  1.0  -30.0  110.0 2
assign (resid 101 and name    N) (resid 101 and name   CA)
       (resid 101 and name    C) (resid 102 and name    N)  1.0  -30.0  110.0 2
assign (resid 105 and name    N) (resid 105 and name   CA)
       (resid 105 and name    C) (resid 106 and name    N)  1.0  120.0  100.0 2
assign (resid 111 and name    N) (resid 111 and name   CA)
       (resid 111 and name    C) (resid 112 and name    N)  1.0  120.0  100.0 2
assign (resid 112 and name    N) (resid 112 and name   CA)
       (resid 112 and name    C) (resid 113 and name    N)  1.0  120.0  100.0 2
assign (resid 113 and name    N) (resid 113 and name   CA)
       (resid 113 and name    C) (resid 114 and name    N)  1.0  110.0  110.0 2
assign (resid 115 and name    N) (resid 115 and name   CA)
       (resid 115 and name    C) (resid 116 and name    N)  1.0  -30.0  110.0 2
assign (resid 122 and name    N) (resid 122 and name   CA)
       (resid 122 and name    C) (resid 123 and name    N)  1.0  -30.0  110.0 2
assign (resid 129 and name    N) (resid 129 and name   CA)
       (resid 129 and name    C) (resid 130 and name    N)  1.0  120.0  100.0 2
assign (resid 130 and name    N) (resid 130 and name   CA)
       (resid 130 and name    C) (resid 131 and name    N)  1.0  -30.0  110.0 2
assign (resid 132 and name    N) (resid 132 and name   CA)
       (resid 132 and name    C) (resid 133 and name    N)  1.0  -30.0  110.0 2
assign (resid 134 and name    N) (resid 134 and name   CA)
       (resid 134 and name    C) (resid 135 and name    N)  1.0  -30.0  110.0 2
assign (resid 141 and name    N) (resid 141 and name   CA)
       (resid 141 and name    C) (resid 142 and name    N)  1.0  120.0  100.0 2
assign (resid 142 and name    N) (resid 142 and name   CA)
       (resid 142 and name    C) (resid 143 and name    N)  1.0  -30.0  110.0 2
assign (resid 147 and name    N) (resid 147 and name   CA)
       (resid 147 and name    C) (resid 148 and name    N)  1.0  120.0  100.0 2
assign (resid 149 and name    N) (resid 149 and name   CA)
       (resid 149 and name    C) (resid 150 and name    N)  1.0  120.0  100.0 2
assign (resid 151 and name    N) (resid 151 and name   CA)
       (resid 151 and name    C) (resid 152 and name    N)  1.0  -30.0  110.0 2
assign (resid 153 and name    N) (resid 153 and name   CA)
       (resid 153 and name    C) (resid 154 and name    N)  1.0  -30.0  110.0 2
assign (resid 154 and name    N) (resid 154 and name   CA)
       (resid 154 and name    C) (resid 155 and name    N)  1.0  -30.0  110.0 2
assign (resid 156 and name    N) (resid 156 and name   CA)
       (resid 156 and name    C) (resid 157 and name    N)  1.0  -30.0  110.0 2
assign (resid 157 and name    N) (resid 157 and name   CA)
       (resid 157 and name    C) (resid 158 and name    N)  1.0  -30.0  110.0 2
assign (resid 112 and name    N) (resid 112 and name   CA)
       (resid 112 and name   CB) (resid 112 and name  CG1)  1.0  -60.0   60.0 2
assign (resid 119 and name    N) (resid 119 and name   CA)
       (resid 119 and name   CB) (resid 119 and name  CG1)  1.0  -60.0   60.0 2
assign (resid  96 and name    N) (resid  96 and name   CA)
       (resid  96 and name   CB) (resid  96 and name   CG)  1.0  -60.0   60.0 2
assign (resid  97 and name    N) (resid  97 and name   CA)
       (resid  97 and name   CB) (resid  97 and name   CG)  1.0  -60.0   60.0 2
assign (resid  99 and name    N) (resid  99 and name   CA)
       (resid  99 and name   CB) (resid  99 and name   CG)  1.0  -60.0   60.0 2
assign (resid 104 and name    N) (resid 104 and name   CA)
       (resid 104 and name   CB) (resid 104 and name   CG)  1.0  -60.0   60.0 2
assign (resid 111 and name    N) (resid 111 and name   CA)
       (resid 111 and name   CB) (resid 111 and name   CG)  1.0  -60.0   60.0 2
assign (resid 113 and name    N) (resid 113 and name   CA)
       (resid 113 and name   CB) (resid 113 and name   CG)  1.0   60.0   60.0 2
assign (resid 121 and name    N) (resid 121 and name   CA)
       (resid 121 and name   CB) (resid 121 and name   CG)  1.0  -60.0   60.0 2
assign (resid 126 and name    N) (resid 126 and name   CA)
       (resid 126 and name   CB) (resid 126 and name   CG)  1.0  -60.0   60.0 2
assign (resid 132 and name    N) (resid 132 and name   CA)
       (resid 132 and name   CB) (resid 132 and name   CG)  1.0  -60.0   60.0 2
assign (resid 143 and name    N) (resid 143 and name   CA)
       (resid 143 and name   CB) (resid 143 and name   CG)  1.0   60.0   60.0 2
assign (resid 144 and name    N) (resid 144 and name   CA)
       (resid 144 and name   CB) (resid 144 and name   CG)  1.0  -60.0   60.0 2
assign (resid 148 and name    N) (resid 148 and name   CA)
       (resid 148 and name   CB) (resid 148 and name  CG1)  1.0  -60.0   60.0 2
assign (resid 149 and name    N) (resid 149 and name   CA)
       (resid 149 and name   CB) (resid 149 and name   CG)  1.0   60.0   60.0 2
assign (resid 150 and name    N) (resid 150 and name   CA)
       (resid 150 and name   CB) (resid 150 and name   CG)  1.0  180.0   60.0 2
assign (resid 151 and name    N) (resid 151 and name   CA)
       (resid 151 and name   CB) (resid 151 and name   CG)  1.0  -60.0   60.0 2
assign (resid 153 and name    N) (resid 153 and name   CA)
       (resid 153 and name   CB) (resid 153 and name   CG)  1.0  180.0   60.0 2
assign (resid 154 and name    N) (resid 154 and name   CA)
       (resid 154 and name   CB) (resid 154 and name   CG)  1.0  -60.0   60.0 2
assign (resid 160 and name    N) (resid 160 and name   CA)
       (resid 160 and name   CB) (resid 160 and name  CG1)  1.0  180.0   60.0 2


  Entry H atom name         Submitted Coord H atom name
    1   1H    ALA   2           HT2      ALA   2  52.526   8.237  -2.355
    2   2H    ALA   2           HT1      ALA   2  54.112   8.683  -2.777
    3   3H    ALA   2           HT3      ALA   2  52.803   9.650  -3.259
    4    HA   ALA   2           HA       ALA   2  52.141   8.205  -4.917
    5   1HB   ALA   2           HB3      ALA   2  55.142   7.960  -4.524
    6   2HB   ALA   2           HB2      ALA   2  54.306   7.608  -6.036
    7   3HB   ALA   2           HB1      ALA   2  54.302   9.248  -5.387
    8    H    ASP   3           HN       ASP   3  53.408   5.894  -5.897
    9    HA   ASP   3           HA       ASP   3  52.289   3.852  -4.096
   10   1HB   ASP   3           HB2      ASP   3  52.828   4.246  -6.885
   11   2HB   ASP   3           HB1      ASP   3  53.639   2.767  -6.368
   12    H    ILE   4           HN       ILE   4  53.553   2.021  -3.332
   13    HA   ILE   4           HA       ILE   4  56.468   2.655  -3.010
   14    HB   ILE   4           HB       ILE   4  54.697   0.919  -1.269
   15   1HG1  ILE   4          HG12      ILE   4  55.303   3.885  -1.044
   16   2HG1  ILE   4          HG11      ILE   4  53.724   3.166  -1.357
   17   1HG2  ILE   4          HG23      ILE   4  57.456   1.342  -1.333
   18   2HG2  ILE   4          HG22      ILE   4  56.890   2.398  -0.039
   19   3HG2  ILE   4          HG21      ILE   4  56.538   0.670   0.015
   20   1HD1  ILE   4          HD12      ILE   4  55.118   2.143   1.043
   21   2HD1  ILE   4          HD11      ILE   4  54.611   3.829   1.131
   22   3HD1  ILE   4          HD13      ILE   4  53.421   2.564   0.821
   23    H    TYR   5           HN       TYR   5  54.283  -0.195  -2.975
   24    HA   TYR   5           HA       TYR   5  56.450  -1.952  -3.898
   25   1HB   TYR   5           HB2      TYR   5  53.486  -2.514  -3.618
   26   2HB   TYR   5           HB1      TYR   5  54.812  -3.673  -3.522
   27    HD1  TYR   5           HD2      TYR   5  56.410  -3.586  -1.590
   28    HD2  TYR   5           HD1      TYR   5  52.843  -1.197  -1.725
   29    HE1  TYR   5           HE2      TYR   5  56.583  -3.189   0.852
   30    HE2  TYR   5           HE1      TYR   5  53.016  -0.800   0.717
   31    HH   TYR   5           HH       TYR   5  54.705  -2.573   2.750
   32    H    LYS   6           HN       LYS   6  53.273  -0.909  -5.198
   33    HA   LYS   6           HA       LYS   6  53.264  -2.170  -7.674
   34   1HB   LYS   6           HB2      LYS   6  51.894  -0.134  -6.374
   35   2HB   LYS   6           HB1      LYS   6  52.536   0.669  -7.808
   36   1HG   LYS   6           HG2      LYS   6  50.943  -1.912  -7.811
   37   2HG   LYS   6           HG1      LYS   6  50.317  -0.325  -8.261
   38   1HD   LYS   6           HD2      LYS   6  51.608  -0.222 -10.211
   39   2HD   LYS   6           HD1      LYS   6  52.771  -1.409  -9.620
   40   1HE   LYS   6           HE2      LYS   6  51.249  -3.223  -9.971
   41   2HE   LYS   6           HE1      LYS   6  49.880  -2.118 -10.206
   42   1HZ   LYS   6           HZ1      LYS   6  51.218  -1.132 -12.078
   43   2HZ   LYS   6           HZ3      LYS   6  52.252  -2.471 -11.951
   44   3HZ   LYS   6           HZ2      LYS   6  50.618  -2.697 -12.358
   45    H    ALA   7           HN       ALA   7  55.119   0.717  -6.736
   46    HA   ALA   7           HA       ALA   7  56.081   1.434  -9.330
   47   1HB   ALA   7           HB1      ALA   7  56.149   2.688  -7.094
   48   2HB   ALA   7           HB3      ALA   7  57.555   1.699  -6.699
   49   3HB   ALA   7           HB2      ALA   7  57.607   2.793  -8.081
   50    H    ALA   8           HN       ALA   8  57.191  -0.957  -6.968
   51    HA   ALA   8           HA       ALA   8  59.673  -1.538  -8.417
   52   1HB   ALA   8           HB2      ALA   8  58.165  -2.778  -6.102
   53   2HB   ALA   8           HB1      ALA   8  59.711  -3.402  -6.678
   54   3HB   ALA   8           HB3      ALA   8  59.609  -1.768  -6.023
   55    H    VAL   9           HN       VAL   9  56.423  -2.937  -8.159
   56    HA   VAL   9           HA       VAL   9  57.092  -5.343  -9.674
   57    HB   VAL   9           HB       VAL   9  54.501  -4.013  -8.826
   58   1HG1  VAL   9          HG11      VAL   9  54.685  -5.812 -10.843
   59   2HG1  VAL   9          HG13      VAL   9  54.606  -6.911  -9.466
   60   3HG1  VAL   9          HG12      VAL   9  53.312  -5.744  -9.738
   61   1HG2  VAL   9          HG23      VAL   9  56.499  -5.530  -7.439
   62   2HG2  VAL   9          HG22      VAL   9  54.974  -4.905  -6.812
   63   3HG2  VAL   9          HG21      VAL   9  55.035  -6.509  -7.543
   64    H    GLU  10           HN       GLU  10  55.637  -2.182 -10.410
   65    HA   GLU  10           HA       GLU  10  54.608  -2.721 -12.990
   66   1HB   GLU  10           HB2      GLU  10  54.599  -0.353 -13.207
   67   2HB   GLU  10           HB1      GLU  10  54.492  -0.633 -11.470
   68   1HG   GLU  10           HG2      GLU  10  56.986  -0.389 -11.338
   69   2HG   GLU  10           HG1      GLU  10  56.987   0.064 -13.043
   70    H    GLN  11           HN       GLN  11  57.883  -2.666 -11.913
   71    HA   GLN  11           HA       GLN  11  58.949  -2.247 -14.660
   72   1HB   GLN  11           HB2      GLN  11  60.205  -2.534 -11.912
   73   2HB   GLN  11           HB1      GLN  11  61.121  -2.243 -13.391
   74   1HG   GLN  11           HG2      GLN  11  60.446  -0.064 -13.543
   75   2HG   GLN  11           HG1      GLN  11  58.839  -0.410 -12.901
   76   1HE2  GLN  11          HE22      GLN  11  61.080   1.438 -10.387
   77   2HE2  GLN  11          HE21      GLN  11  60.852   1.702 -12.048
   78    H    LEU  12           HN       LEU  12  58.052  -4.793 -12.553
   79    HA   LEU  12           HA       LEU  12  59.870  -6.848 -12.866
   80   1HB   LEU  12           HB2      LEU  12  56.913  -6.584 -12.753
   81   2HB   LEU  12           HB1      LEU  12  57.521  -8.147 -13.295
   82    HG   LEU  12           HG       LEU  12  58.216  -6.732 -10.705
   83   1HD1  LEU  12          HD13      LEU  12  56.719  -9.283 -11.373
   84   2HD1  LEU  12          HD12      LEU  12  57.226  -8.842  -9.742
   85   3HD1  LEU  12          HD11      LEU  12  56.063  -7.837 -10.605
   86   1HD2  LEU  12          HD22      LEU  12  59.404  -9.115 -12.111
   87   2HD2  LEU  12          HD21      LEU  12  60.228  -7.793 -11.283
   88   3HD2  LEU  12          HD23      LEU  12  59.403  -9.041 -10.350
   89    H    THR  13           HN       THR  13  59.844  -8.693 -14.473
   90    HA   THR  13           HA       THR  13  59.685  -7.611 -17.246
   91    HB   THR  13           HB       THR  13  60.975  -9.870 -17.584
   92    HG1  THR  13           HG1      THR  13  61.688 -10.804 -15.790
   93   1HG2  THR  13          HG23      THR  13  62.084  -7.539 -16.000
   94   2HG2  THR  13          HG22      THR  13  63.078  -8.773 -16.774
   95   3HG2  THR  13          HG21      THR  13  62.068  -7.711 -17.755
   96    H    GLU  14           HN       GLU  14  58.478  -8.723 -18.863
   97    HA   GLU  14           HA       GLU  14  55.980  -9.776 -18.314
   98   1HB   GLU  14           HB2      GLU  14  57.336  -9.231 -20.523
   99   2HB   GLU  14           HB1      GLU  14  57.627 -10.971 -20.521
  100   1HG   GLU  14           HG2      GLU  14  55.581 -11.277 -21.404
  101   2HG   GLU  14           HG1      GLU  14  54.880 -10.615 -19.927
  102    H    GLU  15           HN       GLU  15  59.056 -11.567 -18.412
  103    HA   GLU  15           HA       GLU  15  57.943 -14.199 -18.129
  104   1HB   GLU  15           HB2      GLU  15  60.613 -13.036 -17.270
  105   2HB   GLU  15           HB1      GLU  15  60.271 -14.751 -17.501
  106   1HG   GLU  15           HG2      GLU  15  59.448 -13.871 -19.891
  107   2HG   GLU  15           HG1      GLU  15  60.613 -12.595 -19.536
  108    H    GLN  16           HN       GLN  16  58.339 -11.588 -15.884
  109    HA   GLN  16           HA       GLN  16  58.311 -13.303 -13.488
  110   1HB   GLN  16           HB2      GLN  16  58.278 -10.341 -14.091
  111   2HB   GLN  16           HB1      GLN  16  58.097 -10.946 -12.443
  112   1HG   GLN  16           HG2      GLN  16  60.342 -12.054 -14.066
  113   2HG   GLN  16           HG1      GLN  16  60.504 -10.395 -13.484
  114   1HE2  GLN  16          HE22      GLN  16  60.351 -13.455 -10.739
  115   2HE2  GLN  16          HE21      GLN  16  59.716 -13.703 -12.293
  116    H    LYS  17           HN       LYS  17  56.119 -10.831 -14.895
  117    HA   LYS  17           HA       LYS  17  53.939 -11.212 -13.126
  118   1HB   LYS  17           HB2      LYS  17  54.038 -10.459 -16.065
  119   2HB   LYS  17           HB1      LYS  17  52.656 -10.181 -15.005
  120   1HG   LYS  17           HG2      LYS  17  55.247  -9.191 -13.974
  121   2HG   LYS  17           HG1      LYS  17  54.642  -8.357 -15.405
  122   1HD   LYS  17           HD2      LYS  17  52.486  -7.965 -14.279
  123   2HD   LYS  17           HD1      LYS  17  53.075  -8.814 -12.849
  124   1HE   LYS  17           HE2      LYS  17  53.273  -6.314 -12.650
  125   2HE   LYS  17           HE1      LYS  17  54.846  -7.129 -12.549
  126   1HZ   LYS  17           HZ2      LYS  17  53.706  -6.233 -15.130
  127   2HZ   LYS  17           HZ1      LYS  17  54.671  -5.207 -14.180
  128   3HZ   LYS  17           HZ3      LYS  17  55.314  -6.658 -14.780
  129    H    ASN  18           HN       ASN  18  54.523 -12.732 -16.323
  130    HA   ASN  18           HA       ASN  18  52.210 -14.372 -16.401
  131   1HB   ASN  18           HB2      ASN  18  55.005 -14.512 -17.522
  132   2HB   ASN  18           HB1      ASN  18  53.852 -15.807 -17.846
  133   1HD2  ASN  18          HD22      ASN  18  53.625 -12.524 -20.070
  134   2HD2  ASN  18          HD21      ASN  18  54.993 -12.991 -19.179
  135    H    GLU  19           HN       GLU  19  55.470 -15.107 -15.113
  136    HA   GLU  19           HA       GLU  19  54.840 -17.778 -14.245
  137   1HB   GLU  19           HB2      GLU  19  56.999 -15.826 -14.135
  138   2HB   GLU  19           HB1      GLU  19  56.875 -16.727 -12.623
  139   1HG   GLU  19           HG2      GLU  19  56.557 -18.460 -14.948
  140   2HG   GLU  19           HG1      GLU  19  58.106 -17.617 -14.962
  141    H    PHE  20           HN       PHE  20  54.714 -14.606 -12.632
  142    HA   PHE  20           HA       PHE  20  54.013 -15.679 -10.024
  143   1HB   PHE  20           HB2      PHE  20  53.915 -12.971 -11.370
  144   2HB   PHE  20           HB1      PHE  20  53.415 -13.201  -9.694
  145    HD1  PHE  20           HD1      PHE  20  55.288 -15.166  -8.661
  146    HD2  PHE  20           HD2      PHE  20  55.994 -11.885 -11.342
  147    HE1  PHE  20           HE1      PHE  20  57.659 -15.089  -7.941
  148    HE2  PHE  20           HE2      PHE  20  58.365 -11.807 -10.621
  149    HZ   PHE  20           HZ       PHE  20  59.199 -13.410  -8.921
  150    H    LYS  21           HN       LYS  21  52.060 -13.654 -12.257
  151    HA   LYS  21           HA       LYS  21  49.549 -14.013 -11.096
  152   1HB   LYS  21           HB2      LYS  21  50.541 -13.691 -13.925
  153   2HB   LYS  21           HB1      LYS  21  48.812 -13.813 -13.599
  154   1HG   LYS  21           HG2      LYS  21  48.732 -11.687 -12.858
  155   2HG   LYS  21           HG1      LYS  21  50.075 -11.970 -11.750
  156   1HD   LYS  21           HD2      LYS  21  51.661 -11.241 -13.262
  157   2HD   LYS  21           HD1      LYS  21  50.701 -11.724 -14.660
  158   1HE   LYS  21           HE2      LYS  21  49.635  -9.532 -12.911
  159   2HE   LYS  21           HE1      LYS  21  50.944  -9.152 -14.048
  160   1HZ   LYS  21           HZ1      LYS  21  49.493 -10.593 -15.647
  161   2HZ   LYS  21           HZ3      LYS  21  48.235 -10.143 -14.602
  162   3HZ   LYS  21           HZ2      LYS  21  49.131  -8.949 -15.413
  163    H    ALA  22           HN       ALA  22  51.346 -16.248 -13.165
  164    HA   ALA  22           HA       ALA  22  49.138 -18.117 -13.521
  165   1HB   ALA  22           HB2      ALA  22  52.147 -18.367 -13.845
  166   2HB   ALA  22           HB1      ALA  22  50.964 -19.516 -14.468
  167   3HB   ALA  22           HB3      ALA  22  51.013 -17.871 -15.101
  168    H    ALA  23           HN       ALA  23  52.178 -18.247 -11.612
  169    HA   ALA  23           HA       ALA  23  51.811 -20.655 -10.254
  170   1HB   ALA  23           HB2      ALA  23  53.170 -18.075  -9.830
  171   2HB   ALA  23           HB1      ALA  23  52.852 -18.962  -8.339
  172   3HB   ALA  23           HB3      ALA  23  53.790 -19.714  -9.630
  173    H    PHE  24           HN       PHE  24  50.642 -17.438  -9.170
  174    HA   PHE  24           HA       PHE  24  49.279 -18.205  -6.840
  175   1HB   PHE  24           HB2      PHE  24  49.494 -15.902  -7.374
  176   2HB   PHE  24           HB1      PHE  24  48.802 -16.127  -8.981
  177    HD1  PHE  24           HD2      PHE  24  46.349 -16.726  -9.194
  178    HD2  PHE  24           HD1      PHE  24  48.113 -15.457  -5.489
  179    HE1  PHE  24           HE2      PHE  24  44.095 -16.215  -8.297
  180    HE2  PHE  24           HE1      PHE  24  45.857 -14.946  -4.591
  181    HZ   PHE  24           HZ       PHE  24  43.849 -15.325  -5.995
  182    H    ASP  25           HN       ASP  25  47.971 -18.078 -10.176
  183    HA   ASP  25           HA       ASP  25  45.381 -19.126  -9.527
  184   1HB   ASP  25           HB2      ASP  25  46.913 -18.273 -11.787
  185   2HB   ASP  25           HB1      ASP  25  46.209 -19.844 -12.175
  186    H    ILE  26           HN       ILE  26  48.466 -20.619  -9.654
  187    HA   ILE  26           HA       ILE  26  47.310 -23.330 -10.112
  188    HB   ILE  26           HB       ILE  26  50.170 -22.340  -9.862
  189   1HG1  ILE  26          HG12      ILE  26  48.805 -23.176 -12.415
  190   2HG1  ILE  26          HG11      ILE  26  48.640 -21.523 -11.820
  191   1HG2  ILE  26          HG22      ILE  26  49.227 -24.917  -9.630
  192   2HG2  ILE  26          HG21      ILE  26  49.577 -24.807 -11.355
  193   3HG2  ILE  26          HG23      ILE  26  50.848 -24.485 -10.177
  194   1HD1  ILE  26          HD13      ILE  26  51.384 -22.184 -11.593
  195   2HD1  ILE  26          HD12      ILE  26  50.871 -22.725 -13.191
  196   3HD1  ILE  26          HD11      ILE  26  50.646 -21.041 -12.715
  197    H    PHE  27           HN       PHE  27  48.596 -21.258  -7.621
  198    HA   PHE  27           HA       PHE  27  48.901 -23.540  -5.729
  199   1HB   PHE  27           HB2      PHE  27  49.601 -20.590  -5.665
  200   2HB   PHE  27           HB1      PHE  27  49.865 -21.677  -4.300
  201    HD1  PHE  27           HD1      PHE  27  50.998 -24.036  -5.097
  202    HD2  PHE  27           HD2      PHE  27  51.444 -20.224  -7.026
  203    HE1  PHE  27           HE1      PHE  27  53.125 -24.802  -6.120
  204    HE2  PHE  27           HE2      PHE  27  53.568 -20.989  -8.046
  205    HZ   PHE  27           HZ       PHE  27  54.411 -23.278  -7.595
  206    H    VAL  28           HN       VAL  28  46.746 -20.928  -6.533
  207    HA   VAL  28           HA       VAL  28  45.442 -20.760  -3.935
  208    HB   VAL  28           HB       VAL  28  45.226 -19.639  -6.673
  209   1HG1  VAL  28          HG12      VAL  28  42.828 -19.715  -4.814
  210   2HG1  VAL  28          HG11      VAL  28  42.957 -18.726  -6.269
  211   3HG1  VAL  28          HG13      VAL  28  42.932 -20.484  -6.397
  212   1HG2  VAL  28          HG22      VAL  28  45.594 -18.805  -3.902
  213   2HG2  VAL  28          HG21      VAL  28  46.075 -17.989  -5.391
  214   3HG2  VAL  28          HG23      VAL  28  44.442 -17.779  -4.758
  215    H    LEU  29           HN       LEU  29  45.368 -23.016  -6.488
  216    HA   LEU  29           HA       LEU  29  42.707 -23.879  -6.686
  217   1HB   LEU  29           HB2      LEU  29  45.430 -25.019  -6.878
  218   2HB   LEU  29           HB1      LEU  29  44.144 -26.202  -6.643
  219    HG   LEU  29           HG       LEU  29  44.596 -25.731  -9.058
  220   1HD1  LEU  29          HD12      LEU  29  42.313 -26.381  -8.097
  221   2HD1  LEU  29          HD11      LEU  29  41.880 -24.677  -8.244
  222   3HD1  LEU  29          HD13      LEU  29  42.296 -25.610  -9.682
  223   1HD2  LEU  29          HD23      LEU  29  43.626 -22.967  -8.262
  224   2HD2  LEU  29          HD22      LEU  29  45.229 -23.380  -8.874
  225   3HD2  LEU  29          HD21      LEU  29  43.821 -23.515  -9.927
  226    H    GLY  30           HN       GLY  30  44.996 -24.286  -4.038
  227   1HA   GLY  30           HA2      GLY  30  43.055 -26.008  -2.580
  228   2HA   GLY  30           HA1      GLY  30  44.738 -25.747  -2.114
  229    H    ALA  31           HN       ALA  31  43.454 -22.823  -3.055
  230    HA   ALA  31           HA       ALA  31  43.416 -21.813  -0.315
  231   1HB   ALA  31           HB1      ALA  31  43.933 -20.823  -2.820
  232   2HB   ALA  31           HB3      ALA  31  42.321 -20.174  -2.517
  233   3HB   ALA  31           HB2      ALA  31  43.639 -19.816  -1.402
  234    H    GLU  32           HN       GLU  32  41.291 -19.947  -0.496
  235    HA   GLU  32           HA       GLU  32  38.820 -21.571  -0.850
  236   1HB   GLU  32           HB2      GLU  32  40.019 -21.589   1.530
  237   2HB   GLU  32           HB1      GLU  32  39.198 -20.037   1.695
  238   1HG   GLU  32           HG2      GLU  32  37.047 -21.135   1.118
  239   2HG   GLU  32           HG1      GLU  32  37.881 -22.686   1.026
  240    H    ASP  33           HN       ASP  33  40.285 -18.425  -0.057
  241    HA   ASP  33           HA       ASP  33  37.796 -17.052  -0.977
  242   1HB   ASP  33           HB2      ASP  33  39.851 -16.638   1.032
  243   2HB   ASP  33           HB1      ASP  33  39.692 -15.213   0.006
  244    H    GLY  34           HN       GLY  34  40.374 -18.255  -2.473
  245   1HA   GLY  34           HA2      GLY  34  41.206 -17.754  -4.633
  246   2HA   GLY  34           HA1      GLY  34  40.319 -16.230  -4.585
  247    H    SER  35           HN       SER  35  42.684 -17.431  -2.217
  248    HA   SER  35           HA       SER  35  44.694 -15.461  -3.148
  249   1HB   SER  35           HB2      SER  35  44.177 -15.212  -0.280
  250   2HB   SER  35           HB1      SER  35  44.288 -13.952  -1.504
  251    HG   SER  35           HG       SER  35  42.174 -14.296  -0.443
  252    H    ILE  36           HN       ILE  36  46.680 -15.631  -1.574
  253    HA   ILE  36           HA       ILE  36  46.890 -18.418  -0.500
  254    HB   ILE  36           HB       ILE  36  49.374 -18.043  -1.458
  255   1HG1  ILE  36          HG12      ILE  36  47.567 -16.399  -3.265
  256   2HG1  ILE  36          HG11      ILE  36  48.979 -15.820  -2.380
  257   1HG2  ILE  36          HG22      ILE  36  46.990 -19.401  -2.292
  258   2HG2  ILE  36          HG21      ILE  36  47.866 -18.854  -3.722
  259   3HG2  ILE  36          HG23      ILE  36  48.671 -19.879  -2.532
  260   1HD1  ILE  36          HD11      ILE  36  50.235 -17.716  -3.695
  261   2HD1  ILE  36          HD13      ILE  36  48.860 -17.607  -4.793
  262   3HD1  ILE  36          HD12      ILE  36  49.874 -16.193  -4.507
  263    H    SER  37           HN       SER  37  46.987 -17.897   1.681
  264    HA   SER  37           HA       SER  37  48.518 -15.608   2.670
  265   1HB   SER  37           HB2      SER  37  47.635 -16.312   4.778
  266   2HB   SER  37           HB1      SER  37  46.378 -16.691   3.604
  267    HG   SER  37           HG       SER  37  46.755 -18.469   4.944
  268    H    THR  38           HN       THR  38  50.098 -16.220   4.612
  269    HA   THR  38           HA       THR  38  52.475 -17.271   3.683
  270    HB   THR  38           HB       THR  38  52.458 -16.198   5.784
  271    HG1  THR  38           HG1      THR  38  52.859 -18.197   7.258
  272   1HG2  THR  38          HG22      THR  38  50.012 -17.727   6.098
  273   2HG2  THR  38          HG21      THR  38  51.004 -17.798   7.555
  274   3HG2  THR  38          HG23      THR  38  50.507 -16.236   6.901
  275    H    LYS  39           HN       LYS  39  49.634 -19.070   4.660
  276    HA   LYS  39           HA       LYS  39  50.979 -21.651   4.887
  277   1HB   LYS  39           HB2      LYS  39  48.861 -20.959   6.041
  278   2HB   LYS  39           HB1      LYS  39  48.057 -20.941   4.471
  279   1HG   LYS  39           HG2      LYS  39  47.660 -23.080   5.632
  280   2HG   LYS  39           HG1      LYS  39  48.602 -23.329   4.161
  281   1HD   LYS  39           HD2      LYS  39  50.661 -23.470   5.428
  282   2HD   LYS  39           HD1      LYS  39  49.826 -23.023   6.916
  283   1HE   LYS  39           HE2      LYS  39  48.368 -25.214   5.972
  284   2HE   LYS  39           HE1      LYS  39  50.063 -25.651   5.669
  285   1HZ   LYS  39           HZ3      LYS  39  50.573 -24.882   7.945
  286   2HZ   LYS  39           HZ2      LYS  39  48.913 -24.652   8.223
  287   3HZ   LYS  39           HZ1      LYS  39  49.521 -26.212   7.927
  288    H    GLU  40           HN       GLU  40  49.256 -19.879   2.340
  289    HA   GLU  40           HA       GLU  40  49.524 -22.188   0.483
  290   1HB   GLU  40           HB2      GLU  40  48.173 -19.476   0.319
  291   2HB   GLU  40           HB1      GLU  40  48.099 -20.697  -0.950
  292   1HG   GLU  40           HG2      GLU  40  47.173 -21.126   1.905
  293   2HG   GLU  40           HG1      GLU  40  46.106 -20.760   0.548
  294    H    LEU  41           HN       LEU  41  50.683 -18.874   0.978
  295    HA   LEU  41           HA       LEU  41  52.090 -18.680  -1.556
  296   1HB   LEU  41           HB2      LEU  41  51.244 -16.955   0.347
  297   2HB   LEU  41           HB1      LEU  41  52.931 -17.116   0.836
  298    HG   LEU  41           HG       LEU  41  52.573 -15.251  -0.786
  299   1HD1  LEU  41          HD11      LEU  41  54.704 -16.691  -0.617
  300   2HD1  LEU  41          HD13      LEU  41  54.151 -17.465  -2.102
  301   3HD1  LEU  41          HD12      LEU  41  54.498 -15.736  -2.085
  302   1HD2  LEU  41          HD22      LEU  41  50.759 -16.762  -1.993
  303   2HD2  LEU  41          HD21      LEU  41  51.704 -15.595  -2.918
  304   3HD2  LEU  41          HD23      LEU  41  52.150 -17.302  -2.934
  305    H    GLY  42           HN       GLY  42  52.720 -20.377   1.341
  306   1HA   GLY  42           HA2      GLY  42  55.592 -20.168   1.418
  307   2HA   GLY  42           HA1      GLY  42  54.640 -21.453   2.166
  308    H    LYS  43           HN       LYS  43  53.345 -22.253  -0.333
  309    HA   LYS  43           HA       LYS  43  55.450 -24.030  -1.332
  310   1HB   LYS  43           HB2      LYS  43  52.502 -23.591  -1.797
  311   2HB   LYS  43           HB1      LYS  43  53.415 -24.712  -2.808
  312   1HG   LYS  43           HG2      LYS  43  53.920 -26.130  -1.003
  313   2HG   LYS  43           HG1      LYS  43  53.585 -24.879   0.193
  314   1HD   LYS  43           HD2      LYS  43  51.627 -26.085   0.378
  315   2HD   LYS  43           HD1      LYS  43  51.159 -24.995  -0.926
  316   1HE   LYS  43           HE2      LYS  43  50.857 -26.766  -2.300
  317   2HE   LYS  43           HE1      LYS  43  52.550 -27.244  -2.064
  318   1HZ   LYS  43           HZ3      LYS  43  51.831 -28.150   0.141
  319   2HZ   LYS  43           HZ2      LYS  43  50.222 -27.923  -0.353
  320   3HZ   LYS  43           HZ1      LYS  43  51.230 -28.996  -1.201
  321    H    VAL  44           HN       VAL  44  54.134 -20.966  -2.240
  322    HA   VAL  44           HA       VAL  44  54.846 -21.196  -5.088
  323    HB   VAL  44           HB       VAL  44  54.017 -18.826  -3.382
  324   1HG1  VAL  44          HG13      VAL  44  54.614 -19.223  -6.234
  325   2HG1  VAL  44          HG12      VAL  44  53.047 -18.469  -5.937
  326   3HG1  VAL  44          HG11      VAL  44  54.517 -17.729  -5.304
  327   1HG2  VAL  44          HG22      VAL  44  52.551 -21.154  -4.408
  328   2HG2  VAL  44          HG21      VAL  44  52.066 -19.970  -3.194
  329   3HG2  VAL  44          HG23      VAL  44  51.846 -19.618  -4.908
  330    H    MET  45           HN       MET  45  56.275 -19.971  -2.119
  331    HA   MET  45           HA       MET  45  58.305 -18.328  -3.400
  332   1HB   MET  45           HB2      MET  45  57.812 -19.500  -0.662
  333   2HB   MET  45           HB1      MET  45  59.278 -18.582  -1.008
  334   1HG   MET  45           HG2      MET  45  58.034 -16.615  -1.550
  335   2HG   MET  45           HG1      MET  45  56.514 -17.508  -1.603
  336   1HE   MET  45           HE3      MET  45  58.770 -15.359   0.104
  337   2HE   MET  45           HE2      MET  45  57.120 -14.751   0.216
  338   3HE   MET  45           HE1      MET  45  58.024 -15.099   1.687
  339    H    ARG  46           HN       ARG  46  58.389 -21.539  -1.807
  340    HA   ARG  46           HA       ARG  46  61.124 -22.121  -2.369
  341   1HB   ARG  46           HB2      ARG  46  58.958 -23.262  -1.059
  342   2HB   ARG  46           HB1      ARG  46  59.278 -24.401  -2.367
  343   1HG   ARG  46           HG2      ARG  46  61.818 -23.803  -1.459
  344   2HG   ARG  46           HG1      ARG  46  60.869 -23.817   0.028
  345   1HD   ARG  46           HD2      ARG  46  59.954 -26.054  -0.606
  346   2HD   ARG  46           HD1      ARG  46  61.013 -26.048  -2.031
  347    HE   ARG  46           HE       ARG  46  62.337 -25.532   0.558
  348   1HH1  ARG  46          HH21      ARG  46  62.713 -26.959  -2.394
  349   2HH1  ARG  46          HH22      ARG  46  63.406 -28.439  -1.819
  350   1HH2  ARG  46          HH11      ARG  46  62.704 -27.782   1.512
  351   2HH2  ARG  46          HH12      ARG  46  63.402 -28.905   0.393
  352    H    MET  47           HN       MET  47  58.225 -22.388  -4.352
  353    HA   MET  47           HA       MET  47  59.494 -24.088  -6.371
  354   1HB   MET  47           HB2      MET  47  57.356 -24.155  -7.262
  355   2HB   MET  47           HB1      MET  47  56.963 -23.675  -5.614
  356   1HG   MET  47           HG2      MET  47  55.758 -22.115  -6.875
  357   2HG   MET  47           HG1      MET  47  57.248 -21.236  -6.539
  358   1HE   MET  47           HE1      MET  47  55.239 -20.485  -8.731
  359   2HE   MET  47           HE3      MET  47  55.486 -21.128 -10.360
  360   3HE   MET  47           HE2      MET  47  54.768 -22.140  -9.110
  361    H    LEU  48           HN       LEU  48  58.901 -20.625  -5.922
  362    HA   LEU  48           HA       LEU  48  59.747 -19.879  -8.610
  363   1HB   LEU  48           HB2      LEU  48  59.239 -18.439  -5.996
  364   2HB   LEU  48           HB1      LEU  48  59.740 -17.583  -7.455
  365    HG   LEU  48           HG       LEU  48  57.364 -19.452  -7.422
  366   1HD1  LEU  48          HD13      LEU  48  57.622 -16.631  -6.494
  367   2HD1  LEU  48          HD12      LEU  48  56.210 -17.026  -7.472
  368   3HD1  LEU  48          HD11      LEU  48  56.507 -17.889  -5.964
  369   1HD2  LEU  48          HD22      LEU  48  58.742 -17.768  -9.373
  370   2HD2  LEU  48          HD21      LEU  48  57.546 -19.035  -9.640
  371   3HD2  LEU  48          HD23      LEU  48  57.022 -17.393  -9.270
  372    H    GLY  49           HN       GLY  49  61.210 -18.536  -5.677
  373   1HA   GLY  49           HA2      GLY  49  63.788 -19.760  -5.985
  374   2HA   GLY  49           HA1      GLY  49  63.778 -18.188  -6.787
  375    H    GLN  50           HN       GLN  50  62.405 -19.433  -3.718
  376    HA   GLN  50           HA       GLN  50  63.951 -17.328  -2.268
  377   1HB   GLN  50           HB2      GLN  50  60.960 -17.832  -2.207
  378   2HB   GLN  50           HB1      GLN  50  61.801 -16.786  -1.063
  379   1HG   GLN  50           HG2      GLN  50  62.763 -15.739  -3.334
  380   2HG   GLN  50           HG1      GLN  50  61.233 -16.357  -3.956
  381   1HE2  GLN  50          HE22      GLN  50  59.263 -13.947  -2.263
  382   2HE2  GLN  50          HE21      GLN  50  59.263 -15.353  -3.214
  383    H    ASN  51           HN       ASN  51  64.419 -17.913  -0.091
  384    HA   ASN  51           HA       ASN  51  63.552 -20.668   0.729
  385   1HB   ASN  51           HB2      ASN  51  66.078 -19.791  -0.050
  386   2HB   ASN  51           HB1      ASN  51  66.158 -19.762   1.712
  387   1HD2  ASN  51          HD22      ASN  51  66.612 -23.268  -0.018
  388   2HD2  ASN  51          HD21      ASN  51  66.971 -21.760  -0.708
  389    HA   PRO  52           HA       PRO  52  62.976 -17.296   4.005
  390   1HB   PRO  52           HB2      PRO  52  60.244 -17.131   3.938
  391   2HB   PRO  52           HB1      PRO  52  61.300 -16.103   2.948
  392   1HG   PRO  52           HG2      PRO  52  59.779 -18.545   2.186
  393   2HG   PRO  52           HG1      PRO  52  60.062 -17.058   1.268
  394   1HD   PRO  52           HD2      PRO  52  61.433 -19.377   0.839
  395   2HD   PRO  52           HD1      PRO  52  62.096 -17.764   0.498
  396    H    THR  53           HN       THR  53  61.922 -17.720   6.131
  397    HA   THR  53           HA       THR  53  61.486 -20.642   6.558
  398    HB   THR  53           HB       THR  53  61.702 -19.422   9.021
  399    HG1  THR  53           HG1      THR  53  63.038 -17.739   8.848
  400   1HG2  THR  53          HG22      THR  53  63.249 -21.095   7.317
  401   2HG2  THR  53          HG21      THR  53  64.339 -19.894   8.008
  402   3HG2  THR  53          HG23      THR  53  63.372 -20.921   9.067
  403    HA   PRO  54           HA       PRO  54  57.292 -20.096   7.721
  404   1HB   PRO  54           HB2      PRO  54  57.057 -21.598   9.997
  405   2HB   PRO  54           HB1      PRO  54  57.253 -22.313   8.384
  406   1HG   PRO  54           HG2      PRO  54  59.269 -21.912  10.534
  407   2HG   PRO  54           HG1      PRO  54  59.074 -23.262   9.406
  408   1HD   PRO  54           HD2      PRO  54  60.949 -21.296   9.110
  409   2HD   PRO  54           HD1      PRO  54  60.269 -22.226   7.757
  410    H    GLU  55           HN       GLU  55  59.592 -19.617  10.392
  411    HA   GLU  55           HA       GLU  55  57.802 -18.134  12.102
  412   1HB   GLU  55           HB2      GLU  55  60.604 -18.946  11.927
  413   2HB   GLU  55           HB1      GLU  55  60.428 -17.335  12.626
  414   1HG   GLU  55           HG2      GLU  55  59.265 -18.105  14.463
  415   2HG   GLU  55           HG1      GLU  55  58.570 -19.467  13.583
  416    H    GLU  56           HN       GLU  56  60.254 -17.142   9.698
  417    HA   GLU  56           HA       GLU  56  59.769 -14.295  10.093
  418   1HB   GLU  56           HB2      GLU  56  61.599 -16.051   8.764
  419   2HB   GLU  56           HB1      GLU  56  60.986 -14.900   7.576
  420   1HG   GLU  56           HG2      GLU  56  62.194 -13.225   8.476
  421   2HG   GLU  56           HG1      GLU  56  61.556 -13.565  10.085
  422    H    LEU  57           HN       LEU  57  58.661 -16.778   7.809
  423    HA   LEU  57           HA       LEU  57  57.497 -15.313   5.764
  424   1HB   LEU  57           HB2      LEU  57  57.227 -17.882   7.014
  425   2HB   LEU  57           HB1      LEU  57  55.615 -17.281   6.621
  426    HG   LEU  57           HG       LEU  57  57.691 -16.906   4.530
  427   1HD1  LEU  57          HD11      LEU  57  57.330 -19.456   5.767
  428   2HD1  LEU  57          HD13      LEU  57  56.576 -19.516   4.173
  429   3HD1  LEU  57          HD12      LEU  57  58.276 -19.068   4.329
  430   1HD2  LEU  57          HD22      LEU  57  54.777 -17.219   4.817
  431   2HD2  LEU  57          HD21      LEU  57  55.697 -16.353   3.587
  432   3HD2  LEU  57          HD23      LEU  57  55.449 -18.093   3.439
  433    H    GLN  58           HN       GLN  58  55.619 -16.298   8.662
  434    HA   GLN  58           HA       GLN  58  53.357 -14.717   8.304
  435   1HB   GLN  58           HB2      GLN  58  53.474 -16.284  10.095
  436   2HB   GLN  58           HB1      GLN  58  54.933 -15.540  10.751
  437   1HG   GLN  58           HG2      GLN  58  53.024 -14.897  12.125
  438   2HG   GLN  58           HG1      GLN  58  53.608 -13.481  11.249
  439   1HE2  GLN  58          HE22      GLN  58  50.551 -12.988   9.581
  440   2HE2  GLN  58          HE21      GLN  58  52.076 -12.373  10.005
  441    H    GLU  59           HN       GLU  59  56.502 -13.721   9.636
  442    HA   GLU  59           HA       GLU  59  55.693 -11.064  10.417
  443   1HB   GLU  59           HB2      GLU  59  57.670 -12.221  11.289
  444   2HB   GLU  59           HB1      GLU  59  58.371 -12.284   9.671
  445   1HG   GLU  59           HG2      GLU  59  57.718  -9.582  10.084
  446   2HG   GLU  59           HG1      GLU  59  58.436 -10.123  11.602
  447    H    MET  60           HN       MET  60  57.213 -12.386   7.469
  448    HA   MET  60           HA       MET  60  57.749 -10.002   6.076
  449   1HB   MET  60           HB2      MET  60  57.187 -12.844   5.482
  450   2HB   MET  60           HB1      MET  60  56.919 -11.743   4.129
  451   1HG   MET  60           HG2      MET  60  59.321 -10.872   5.267
  452   2HG   MET  60           HG1      MET  60  59.429 -12.631   5.305
  453   1HE   MET  60           HE1      MET  60  61.365 -11.378   4.169
  454   2HE   MET  60           HE3      MET  60  61.525 -12.647   2.947
  455   3HE   MET  60           HE2      MET  60  61.444 -10.956   2.460
  456    H    ILE  61           HN       ILE  61  54.724 -11.939   5.946
  457    HA   ILE  61           HA       ILE  61  53.292 -10.058   4.308
  458    HB   ILE  61           HB       ILE  61  52.624 -12.373   6.114
  459   1HG1  ILE  61          HG12      ILE  61  51.571 -12.562   3.478
  460   2HG1  ILE  61          HG11      ILE  61  53.213 -11.934   3.337
  461   1HG2  ILE  61          HG21      ILE  61  50.729 -10.378   4.896
  462   2HG2  ILE  61          HG23      ILE  61  50.249 -12.070   5.039
  463   3HG2  ILE  61          HG22      ILE  61  50.663 -11.146   6.484
  464   1HD1  ILE  61          HD12      ILE  61  53.306 -13.969   5.299
  465   2HD1  ILE  61          HD11      ILE  61  52.362 -14.614   3.956
  466   3HD1  ILE  61          HD13      ILE  61  53.996 -14.012   3.677
  467    H    ASP  62           HN       ASP  62  52.904 -10.776   7.805
  468    HA   ASP  62           HA       ASP  62  51.142  -8.804   8.584
  469   1HB   ASP  62           HB2      ASP  62  52.136 -10.456  10.082
  470   2HB   ASP  62           HB1      ASP  62  53.719  -9.697   9.914
  471    H    GLU  63           HN       GLU  63  54.456  -8.336   7.515
  472    HA   GLU  63           HA       GLU  63  54.572  -5.543   8.439
  473   1HB   GLU  63           HB2      GLU  63  56.321  -7.618   7.335
  474   2HB   GLU  63           HB1      GLU  63  56.653  -6.023   6.658
  475   1HG   GLU  63           HG2      GLU  63  56.269  -6.298   9.621
  476   2HG   GLU  63           HG1      GLU  63  57.815  -6.762   8.908
  477    H    VAL  64           HN       VAL  64  54.455  -7.225   5.273
  478    HA   VAL  64           HA       VAL  64  54.101  -4.697   3.822
  479    HB   VAL  64           HB       VAL  64  54.095  -6.176   1.888
  480   1HG1  VAL  64          HG12      VAL  64  56.213  -5.833   3.391
  481   2HG1  VAL  64          HG11      VAL  64  55.975  -7.530   3.809
  482   3HG1  VAL  64          HG13      VAL  64  56.250  -7.066   2.129
  483   1HG2  VAL  64          HG21      VAL  64  53.137  -8.089   3.912
  484   2HG2  VAL  64          HG23      VAL  64  52.862  -8.065   2.170
  485   3HG2  VAL  64          HG22      VAL  64  54.349  -8.757   2.819
  486    H    ASP  65           HN       ASP  65  52.064  -7.193   5.184
  487    HA   ASP  65           HA       ASP  65  49.697  -6.758   3.620
  488   1HB   ASP  65           HB2      ASP  65  50.479  -8.573   5.396
  489   2HB   ASP  65           HB1      ASP  65  49.628  -7.513   6.521
  490    H    GLU  66           HN       GLU  66  48.266  -5.064   3.688
  491    HA   GLU  66           HA       GLU  66  48.742  -2.768   5.401
  492   1HB   GLU  66           HB2      GLU  66  46.781  -1.893   4.204
  493   2HB   GLU  66           HB1      GLU  66  47.853  -2.717   3.070
  494   1HG   GLU  66           HG2      GLU  66  46.456  -4.778   3.318
  495   2HG   GLU  66           HG1      GLU  66  45.339  -3.855   4.326
  496    H    ASP  67           HN       ASP  67  47.171  -5.722   5.930
  497    HA   ASP  67           HA       ASP  67  45.539  -4.521   8.145
  498   1HB   ASP  67           HB2      ASP  67  43.868  -6.203   7.660
  499   2HB   ASP  67           HB1      ASP  67  44.300  -5.434   6.131
  500    H    GLY  68           HN       GLY  68  48.080  -6.620   7.300
  501   1HA   GLY  68           HA2      GLY  68  49.346  -8.143   8.558
  502   2HA   GLY  68           HA1      GLY  68  48.653  -7.370   9.985
  503    H    SER  69           HN       SER  69  47.777  -9.701   7.419
  504    HA   SER  69           HA       SER  69  46.196 -11.188   9.493
  505   1HB   SER  69           HB2      SER  69  44.773 -11.799   7.430
  506   2HB   SER  69           HB1      SER  69  44.650 -10.143   8.017
  507    HG   SER  69           HG       SER  69  45.312 -10.922   5.617
  508    H    GLY  70           HN       GLY  70  48.398 -11.330   6.752
  509   1HA   GLY  70           HA2      GLY  70  50.033 -13.142   6.604
  510   2HA   GLY  70           HA1      GLY  70  48.857 -14.209   7.371
  511    H    THR  71           HN       THR  71  47.016 -12.495   5.315
  512    HA   THR  71           HA       THR  71  47.051 -14.654   3.294
  513    HB   THR  71           HB       THR  71  44.946 -13.503   2.590
  514    HG1  THR  71           HG1      THR  71  44.316 -11.807   4.167
  515   1HG2  THR  71          HG22      THR  71  45.285 -15.102   4.693
  516   2HG2  THR  71          HG21      THR  71  44.790 -13.653   5.569
  517   3HG2  THR  71          HG23      THR  71  43.723 -14.356   4.353
  518    H    VAL  72           HN       VAL  72  47.185 -14.163   0.998
  519    HA   VAL  72           HA       VAL  72  48.190 -11.471   0.235
  520    HB   VAL  72           HB       VAL  72  49.684 -14.099   0.042
  521   1HG1  VAL  72          HG12      VAL  72  49.610 -12.078  -1.924
  522   2HG1  VAL  72          HG11      VAL  72  51.114 -11.827  -1.039
  523   3HG1  VAL  72          HG13      VAL  72  50.783 -13.388  -1.790
  524   1HG2  VAL  72          HG23      VAL  72  49.894 -12.722   2.121
  525   2HG2  VAL  72          HG22      VAL  72  51.416 -12.869   1.242
  526   3HG2  VAL  72          HG21      VAL  72  50.477 -11.381   1.132
  527    H    ASP  73           HN       ASP  73  47.119 -10.943  -1.630
  528    HA   ASP  73           HA       ASP  73  46.072 -13.161  -3.348
  529   1HB   ASP  73           HB2      ASP  73  44.538 -11.312  -4.139
  530   2HB   ASP  73           HB1      ASP  73  44.389 -11.684  -2.421
  531    H    PHE  74           HN       PHE  74  45.648 -11.709  -5.681
  532    HA   PHE  74           HA       PHE  74  48.053 -11.873  -7.105
  533   1HB   PHE  74           HB2      PHE  74  45.986 -11.720  -8.266
  534   2HB   PHE  74           HB1      PHE  74  45.529 -10.240  -7.422
  535    HD1  PHE  74           HD2      PHE  74  48.637 -11.308  -9.240
  536    HD2  PHE  74           HD1      PHE  74  45.448  -8.450  -8.910
  537    HE1  PHE  74           HE2      PHE  74  49.662  -9.956 -11.050
  538    HE2  PHE  74           HE1      PHE  74  46.471  -7.097 -10.719
  539    HZ   PHE  74           HZ       PHE  74  48.578  -7.851 -11.789
  540    H    ASP  75           HN       ASP  75  46.868  -9.248  -5.081
  541    HA   ASP  75           HA       ASP  75  48.899  -7.339  -6.027
  542   1HB   ASP  75           HB2      ASP  75  46.408  -7.164  -4.924
  543   2HB   ASP  75           HB1      ASP  75  47.416  -6.885  -3.503
  544    H    GLU  76           HN       GLU  76  48.149  -8.571  -2.743
  545    HA   GLU  76           HA       GLU  76  50.515  -7.896  -1.448
  546   1HB   GLU  76           HB2      GLU  76  48.966 -10.493  -1.177
  547   2HB   GLU  76           HB1      GLU  76  49.926  -9.710   0.079
  548   1HG   GLU  76           HG2      GLU  76  48.337  -7.653  -0.454
  549   2HG   GLU  76           HG1      GLU  76  47.261  -8.923  -1.040
  550    H    PHE  77           HN       PHE  77  49.983 -10.525  -3.743
  551    HA   PHE  77           HA       PHE  77  52.374 -12.024  -3.222
  552   1HB   PHE  77           HB2      PHE  77  50.302 -12.653  -4.562
  553   2HB   PHE  77           HB1      PHE  77  50.935 -11.645  -5.862
  554    HD1  PHE  77           HD2      PHE  77  52.562 -14.015  -3.451
  555    HD2  PHE  77           HD1      PHE  77  51.807 -12.996  -7.555
  556    HE1  PHE  77           HE2      PHE  77  54.028 -15.876  -4.182
  557    HE2  PHE  77           HE1      PHE  77  53.273 -14.858  -8.286
  558    HZ   PHE  77           HZ       PHE  77  54.385 -16.298  -6.600
  559    H    LEU  78           HN       LEU  78  51.739  -9.850  -6.006
  560    HA   LEU  78           HA       LEU  78  54.410  -9.613  -6.895
  561   1HB   LEU  78           HB2      LEU  78  52.208  -7.522  -6.922
  562   2HB   LEU  78           HB1      LEU  78  53.565  -7.619  -8.044
  563    HG   LEU  78           HG       LEU  78  51.240  -9.533  -7.769
  564   1HD1  LEU  78          HD12      LEU  78  52.384  -7.818  -9.983
  565   2HD1  LEU  78          HD11      LEU  78  51.202  -9.094 -10.280
  566   3HD1  LEU  78          HD13      LEU  78  50.778  -7.720  -9.259
  567   1HD2  LEU  78          HD21      LEU  78  53.977  -9.935  -8.954
  568   2HD2  LEU  78          HD23      LEU  78  53.004 -11.058  -8.003
  569   3HD2  LEU  78          HD22      LEU  78  52.582 -10.729  -9.684
  570    H    VAL  79           HN       VAL  79  52.896  -8.290  -4.081
  571    HA   VAL  79           HA       VAL  79  54.844  -6.117  -3.711
  572    HB   VAL  79           HB       VAL  79  52.695  -7.342  -1.947
  573   1HG1  VAL  79          HG11      VAL  79  54.296  -4.779  -1.689
  574   2HG1  VAL  79          HG13      VAL  79  52.878  -5.167  -0.716
  575   3HG1  VAL  79          HG12      VAL  79  54.332  -6.156  -0.589
  576   1HG2  VAL  79          HG21      VAL  79  51.941  -6.303  -4.111
  577   2HG2  VAL  79          HG23      VAL  79  51.322  -5.479  -2.679
  578   3HG2  VAL  79          HG22      VAL  79  52.671  -4.787  -3.581
  579    H    MET  80           HN       MET  80  54.507  -9.474  -2.847
  580    HA   MET  80           HA       MET  80  56.319  -9.433  -0.567
  581   1HB   MET  80           HB2      MET  80  54.490 -11.170  -1.780
  582   2HB   MET  80           HB1      MET  80  56.052 -11.961  -1.998
  583   1HG   MET  80           HG2      MET  80  56.328 -12.326   0.238
  584   2HG   MET  80           HG1      MET  80  55.585 -10.790   0.682
  585   1HE   MET  80           HE1      MET  80  55.477 -14.248   1.062
  586   2HE   MET  80           HE3      MET  80  53.855 -14.889   0.764
  587   3HE   MET  80           HE2      MET  80  54.903 -14.471  -0.589
  588    H    MET  81           HN       MET  81  56.800  -9.168  -3.923
  589    HA   MET  81           HA       MET  81  59.544 -10.343  -3.750
  590   1HB   MET  81           HB2      MET  81  58.902  -9.421  -6.388
  591   2HB   MET  81           HB1      MET  81  59.116 -11.077  -5.843
  592   1HG   MET  81           HG2      MET  81  56.509  -9.536  -5.632
  593   2HG   MET  81           HG1      MET  81  56.898 -10.665  -6.923
  594   1HE   MET  81           HE3      MET  81  58.147 -12.638  -6.419
  595   2HE   MET  81           HE2      MET  81  58.221 -13.514  -4.893
  596   3HE   MET  81           HE1      MET  81  56.922 -13.853  -6.034
  597    H    VAL  82           HN       VAL  82  57.835  -7.373  -3.784
  598    HA   VAL  82           HA       VAL  82  59.912  -5.704  -4.953
  599    HB   VAL  82           HB       VAL  82  57.437  -5.289  -3.265
  600   1HG1  VAL  82          HG11      VAL  82  59.664  -3.431  -3.785
  601   2HG1  VAL  82          HG13      VAL  82  58.081  -2.797  -4.237
  602   3HG1  VAL  82          HG12      VAL  82  58.375  -3.335  -2.585
  603   1HG2  VAL  82          HG21      VAL  82  58.228  -4.919  -6.147
  604   2HG2  VAL  82          HG23      VAL  82  56.825  -5.756  -5.483
  605   3HG2  VAL  82          HG22      VAL  82  56.887  -3.993  -5.471
  606    H    ARG  83           HN       ARG  83  59.119  -6.883  -1.727
  607    HA   ARG  83           HA       ARG  83  61.156  -5.162  -0.441
  608   1HB   ARG  83           HB2      ARG  83  58.728  -6.388   0.265
  609   2HB   ARG  83           HB1      ARG  83  59.959  -7.270   1.170
  610   1HG   ARG  83           HG2      ARG  83  60.604  -5.408   2.382
  611   2HG   ARG  83           HG1      ARG  83  60.135  -4.285   1.105
  612   1HD   ARG  83           HD2      ARG  83  57.695  -5.247   1.678
  613   2HD   ARG  83           HD1      ARG  83  58.462  -5.500   3.259
  614    HE   ARG  83           HE       ARG  83  58.091  -2.879   1.923
  615   1HH1  ARG  83          HH11      ARG  83  60.824  -3.174   3.229
  616   2HH1  ARG  83          HH12      ARG  83  60.512  -2.544   4.812
  617   1HH2  ARG  83          HH21      ARG  83  57.064  -2.755   4.506
  618   2HH2  ARG  83          HH22      ARG  83  58.383  -2.306   5.535
  619    H    SER  84           HN       SER  84  60.820  -8.381  -1.719
  620    HA   SER  84           HA       SER  84  63.182  -9.401  -0.243
  621   1HB   SER  84           HB2      SER  84  60.971 -10.635  -0.778
  622   2HB   SER  84           HB1      SER  84  61.591 -10.763  -2.421
  623    HG   SER  84           HG       SER  84  62.225 -12.199  -0.239
  624    H    MET  85           HN       MET  85  62.579  -7.655  -3.074
  625    HA   MET  85           HA       MET  85  64.930  -8.818  -4.507
  626   1HB   MET  85           HB2      MET  85  62.490  -7.216  -5.223
  627   2HB   MET  85           HB1      MET  85  63.895  -7.161  -6.289
  628   1HG   MET  85           HG2      MET  85  63.715  -9.840  -5.852
  629   2HG   MET  85           HG1      MET  85  62.013  -9.384  -5.763
  630   1HE   MET  85           HE1      MET  85  60.977 -10.191  -7.267
  631   2HE   MET  85           HE3      MET  85  60.856  -9.642  -8.944
  632   3HE   MET  85           HE2      MET  85  61.862 -11.031  -8.538
  633    H    LYS  86           HN       LYS  86  63.545  -5.536  -4.085
  634    HA   LYS  86           HA       LYS  86  66.322  -4.545  -3.524
  635   1HB   LYS  86           HB2      LYS  86  65.893  -2.704  -5.011
  636   2HB   LYS  86           HB1      LYS  86  65.391  -4.161  -5.870
  637   1HG   LYS  86           HG2      LYS  86  63.045  -3.733  -4.969
  638   2HG   LYS  86           HG1      LYS  86  63.628  -2.148  -4.458
  639   1HD   LYS  86           HD2      LYS  86  64.454  -2.593  -7.167
  640   2HD   LYS  86           HD1      LYS  86  62.726  -2.922  -7.045
  641   1HE   LYS  86           HE2      LYS  86  62.397  -0.678  -7.113
  642   2HE   LYS  86           HE1      LYS  86  63.151  -0.591  -5.508
  643   1HZ   LYS  86           HZ1      LYS  86  65.300  -0.905  -7.017
  644   2HZ   LYS  86           HZ3      LYS  86  64.317  -0.090  -8.133
  645   3HZ   LYS  86           HZ2      LYS  86  64.672   0.626  -6.635
  646    H    ASP  87           HN       ASP  87  65.889  -2.004  -2.847
  647    HA   ASP  87           HA       ASP  87  65.100  -0.595  -1.129
  648   1HB   ASP  87           HB2      ASP  87  63.056  -0.681  -2.419
  649   2HB   ASP  87           HB1      ASP  87  62.651  -2.268  -1.768
  650    H    ASP  88           HN       ASP  88  66.008  -0.965   0.845
  651    HA   ASP  88           HA       ASP  88  66.494  -2.009   2.910
  652   1HB   ASP  88           HB2      ASP  88  63.690  -1.731   2.454
  653   2HB   ASP  88           HB1      ASP  88  63.943  -3.258   3.302
  654    H    SER  89           HN       SER  89  67.733  -3.571   1.255
  655    HA   SER  89           HA       SER  89  67.442  -6.253   2.253
  656   1HB   SER  89           HB2      SER  89  65.411  -6.056   0.813
  657   2HB   SER  89           HB1      SER  89  66.453  -5.731  -0.569
  658    HG   SER  89           HG       SER  89  66.684  -7.804  -0.732
  659    H    LYS  90           HN       LYS  90  68.349  -4.577  -0.791
  660    HA   LYS  90           HA       LYS  90  70.548  -6.212  -1.491
  661   1HB   LYS  90           HB2      LYS  90  71.250  -4.165  -2.757
  662   2HB   LYS  90           HB1      LYS  90  69.535  -4.535  -2.950
  663   1HG   LYS  90           HG2      LYS  90  68.882  -2.814  -1.449
  664   2HG   LYS  90           HG1      LYS  90  70.519  -2.638  -0.815
  665   1HD   LYS  90           HD2      LYS  90  71.053  -1.154  -2.423
  666   2HD   LYS  90           HD1      LYS  90  70.491  -2.248  -3.687
  667   1HE   LYS  90           HE2      LYS  90  68.399  -0.863  -2.058
  668   2HE   LYS  90           HE1      LYS  90  69.277   0.099  -3.263
  669   1HZ   LYS  90           HZ1      LYS  90  68.276  -2.592  -3.934
  670   2HZ   LYS  90           HZ3      LYS  90  67.240  -1.253  -4.031
  671   3HZ   LYS  90           HZ2      LYS  90  68.651  -1.304  -4.975
  672    H    GLY  91           HN       GLY  91  72.909  -5.292  -1.460
  673   1HA   GLY  91           HA2      GLY  91  73.831  -5.204   1.231
  674   2HA   GLY  91           HA1      GLY  91  74.801  -4.768  -0.176
  675    H    LYS  92           HN       LYS  92  75.105  -3.330   2.175
  676    HA   LYS  92           HA       LYS  92  74.703  -0.627   1.303
  677   1HB   LYS  92           HB2      LYS  92  72.384  -0.952   1.712
  678   2HB   LYS  92           HB1      LYS  92  72.691  -1.868   3.188
  679   1HG   LYS  92           HG2      LYS  92  73.395   0.090   4.369
  680   2HG   LYS  92           HG1      LYS  92  73.472   1.038   2.884
  681   1HD   LYS  92           HD2      LYS  92  71.253   1.485   2.925
  682   2HD   LYS  92           HD1      LYS  92  70.842  -0.179   3.338
  683   1HE   LYS  92           HE2      LYS  92  72.173   1.050   5.585
  684   2HE   LYS  92           HE1      LYS  92  70.801   2.055   5.077
  685   1HZ   LYS  92           HZ2      LYS  92  70.614  -0.893   5.304
  686   2HZ   LYS  92           HZ1      LYS  92  70.252   0.137   6.606
  687   3HZ   LYS  92           HZ3      LYS  92  69.346   0.229   5.175
  688    H    THR  93           HN       THR  93  76.789  -0.235   2.085
  689    HA   THR  93           HA       THR  93  77.077  -0.148   5.044
  690    HB   THR  93           HB       THR  93  79.155  -1.413   3.241
  691    HG1  THR  93           HG1      THR  93  77.076  -2.661   4.712
  692   1HG2  THR  93          HG23      THR  93  79.648  -0.541   5.619
  693   2HG2  THR  93          HG22      THR  93  78.652  -1.886   6.176
  694   3HG2  THR  93          HG21      THR  93  80.120  -2.200   5.249
  695    H    GLU  94           HN       GLU  94  80.117   0.103   3.889
  696    HA   GLU  94           HA       GLU  94  80.207   2.984   4.098
  697   1HB   GLU  94           HB2      GLU  94  82.202   0.976   2.997
  698   2HB   GLU  94           HB1      GLU  94  82.579   2.613   3.537
  699   1HG   GLU  94           HG2      GLU  94  82.621   1.986   5.705
  700   2HG   GLU  94           HG1      GLU  94  81.096   1.111   5.553
  701    H    GLU  95           HN       GLU  95  79.760   0.762   1.434
  702    HA   GLU  95           HA       GLU  95  80.510   2.655  -0.662
  703   1HB   GLU  95           HB2      GLU  95  78.895   0.083  -0.707
  704   2HB   GLU  95           HB1      GLU  95  79.624   0.866  -2.109
  705   1HG   GLU  95           HG2      GLU  95  81.831   0.432  -1.340
  706   2HG   GLU  95           HG1      GLU  95  81.267   0.026   0.282
  707    H    GLU  96           HN       GLU  96  77.456   1.508   0.779
  708    HA   GLU  96           HA       GLU  96  75.660   2.852  -0.985
  709   1HB   GLU  96           HB2      GLU  96  75.656   1.379   1.495
  710   2HB   GLU  96           HB1      GLU  96  74.580   2.769   1.638
  711   1HG   GLU  96           HG2      GLU  96  73.438   0.733   0.726
  712   2HG   GLU  96           HG1      GLU  96  73.381   2.111  -0.374
  713    H    LEU  97           HN       LEU  97  77.552   4.009   1.747
  714    HA   LEU  97           HA       LEU  97  76.072   6.481   2.131
  715   1HB   LEU  97           HB2      LEU  97  78.727   5.321   2.960
  716   2HB   LEU  97           HB1      LEU  97  78.338   7.000   3.334
  717    HG   LEU  97           HG       LEU  97  76.361   4.830   3.983
  718   1HD1  LEU  97          HD12      LEU  97  78.976   5.375   5.303
  719   2HD1  LEU  97          HD11      LEU  97  77.582   5.150   6.359
  720   3HD1  LEU  97          HD13      LEU  97  78.044   3.880   5.228
  721   1HD2  LEU  97          HD22      LEU  97  77.007   7.621   4.936
  722   2HD2  LEU  97          HD21      LEU  97  75.483   7.002   4.300
  723   3HD2  LEU  97          HD23      LEU  97  76.020   6.533   5.913
  724    H    SER  98           HN       SER  98  79.070   5.603   0.398
  725    HA   SER  98           HA       SER  98  79.733   8.264  -0.463
  726   1HB   SER  98           HB2      SER  98  81.440   7.152  -1.578
  727   2HB   SER  98           HB1      SER  98  80.982   5.910  -0.416
  728    HG   SER  98           HG       SER  98  80.690   5.989  -3.144
  729    H    ASP  99           HN       ASP  99  78.079   5.579  -2.170
  730    HA   ASP  99           HA       ASP  99  77.554   6.916  -4.609
  731   1HB   ASP  99           HB2      ASP  99  76.158   4.757  -3.018
  732   2HB   ASP  99           HB1      ASP  99  75.580   5.245  -4.612
  733    H    LEU 100           HN       LEU 100  75.518   6.733  -1.666
  734    HA   LEU 100           HA       LEU 100  73.301   8.224  -2.583
  735   1HB   LEU 100           HB2      LEU 100  74.660   7.776   0.067
  736   2HB   LEU 100           HB1      LEU 100  73.254   8.837  -0.032
  737    HG   LEU 100           HG       LEU 100  73.385   5.929  -0.882
  738   1HD1  LEU 100          HD13      LEU 100  73.200   6.456   1.583
  739   2HD1  LEU 100          HD12      LEU 100  71.685   7.285   1.230
  740   3HD1  LEU 100          HD11      LEU 100  71.833   5.553   0.931
  741   1HD2  LEU 100          HD23      LEU 100  71.590   8.123  -1.627
  742   2HD2  LEU 100          HD22      LEU 100  71.746   6.515  -2.333
  743   3HD2  LEU 100          HD21      LEU 100  70.734   6.758  -0.909
  744    H    PHE 101           HN       PHE 101  76.455   9.339  -1.408
  745    HA   PHE 101           HA       PHE 101  75.765  12.123  -1.140
  746   1HB   PHE 101           HB2      PHE 101  77.717  11.088  -0.090
  747   2HB   PHE 101           HB1      PHE 101  78.380  10.676  -1.671
  748    HD1  PHE 101           HD2      PHE 101  78.782  12.640  -3.328
  749    HD2  PHE 101           HD1      PHE 101  78.243  13.151   0.903
  750    HE1  PHE 101           HE2      PHE 101  79.858  14.873  -3.459
  751    HE2  PHE 101           HE1      PHE 101  79.318  15.383   0.771
  752    HZ   PHE 101           HZ       PHE 101  80.126  16.240  -1.409
  753    H    ARG 102           HN       ARG 102  77.625  10.449  -3.718
  754    HA   ARG 102           HA       ARG 102  77.597  12.717  -5.503
  755   1HB   ARG 102           HB2      ARG 102  79.186  10.712  -5.379
  756   2HB   ARG 102           HB1      ARG 102  77.928   9.791  -6.204
  757   1HG   ARG 102           HG2      ARG 102  77.938  11.633  -7.978
  758   2HG   ARG 102           HG1      ARG 102  79.425  12.211  -7.224
  759   1HD   ARG 102           HD2      ARG 102  80.404   9.907  -7.534
  760   2HD   ARG 102           HD1      ARG 102  78.956   9.481  -8.470
  761    HE   ARG 102           HE       ARG 102  80.543  11.888  -9.241
  762   1HH1  ARG 102          HH11      ARG 102  78.390  11.297 -11.047
  763   2HH1  ARG 102          HH12      ARG 102  79.090  10.240 -12.227
  764   1HH2  ARG 102          HH21      ARG 102  81.827   9.427 -10.258
  765   2HH2  ARG 102          HH22      ARG 102  81.037   9.180 -11.780
  766    H    MET 103           HN       MET 103  75.176  10.458  -4.662
  767    HA   MET 103           HA       MET 103  73.786  10.659  -7.284
  768   1HB   MET 103           HB2      MET 103  73.630   9.005  -4.796
  769   2HB   MET 103           HB1      MET 103  72.167   9.169  -5.765
  770   1HG   MET 103           HG2      MET 103  74.269   8.690  -7.595
  771   2HG   MET 103           HG1      MET 103  74.492   7.540  -6.276
  772   1HE   MET 103           HE2      MET 103  72.153   7.280  -5.030
  773   2HE   MET 103           HE1      MET 103  70.686   6.703  -5.817
  774   3HE   MET 103           HE3      MET 103  72.075   5.624  -5.626
  775    H    PHE 104           HN       PHE 104  73.862  12.232  -4.239
  776    HA   PHE 104           HA       PHE 104  71.104  13.330  -4.665
  777   1HB   PHE 104           HB2      PHE 104  72.775  12.572  -2.323
  778   2HB   PHE 104           HB1      PHE 104  71.747  13.990  -2.122
  779    HD1  PHE 104           HD1      PHE 104  69.271  13.674  -3.125
  780    HD2  PHE 104           HD2      PHE 104  71.849  10.496  -1.818
  781    HE1  PHE 104           HE1      PHE 104  67.300  12.204  -2.813
  782    HE2  PHE 104           HE2      PHE 104  69.877   9.026  -1.506
  783    HZ   PHE 104           HZ       PHE 104  67.602   9.880  -2.003
  784    H    ASP 105           HN       ASP 105  74.432  14.092  -4.820
  785    HA   ASP 105           HA       ASP 105  74.566  16.776  -3.934
  786   1HB   ASP 105           HB2      ASP 105  76.394  15.200  -4.749
  787   2HB   ASP 105           HB1      ASP 105  75.899  15.608  -6.391
  788    H    LYS 106           HN       LYS 106  72.520  17.794  -4.528
  789    HA   LYS 106           HA       LYS 106  71.493  17.953  -7.188
  790   1HB   LYS 106           HB2      LYS 106  71.266  19.510  -4.630
  791   2HB   LYS 106           HB1      LYS 106  70.524  20.159  -6.093
  792   1HG   LYS 106           HG2      LYS 106  70.061  17.287  -5.362
  793   2HG   LYS 106           HG1      LYS 106  69.143  18.547  -4.537
  794   1HD   LYS 106           HD2      LYS 106  67.730  18.358  -6.314
  795   2HD   LYS 106           HD1      LYS 106  68.926  19.361  -7.137
  796   1HE   LYS 106           HE2      LYS 106  69.945  17.479  -8.184
  797   2HE   LYS 106           HE1      LYS 106  69.131  16.337  -7.094
  798   1HZ   LYS 106           HZ1      LYS 106  67.038  17.645  -8.040
  799   2HZ   LYS 106           HZ3      LYS 106  68.064  17.793  -9.384
  800   3HZ   LYS 106           HZ2      LYS 106  67.657  16.254  -8.793
  801    H    ASN 107           HN       ASN 107  73.717  20.090  -5.386
  802    HA   ASN 107           HA       ASN 107  74.017  21.988  -7.572
  803   1HB   ASN 107           HB2      ASN 107  74.390  22.698  -5.316
  804   2HB   ASN 107           HB1      ASN 107  75.488  21.354  -5.008
  805   1HD2  ASN 107          HD22      ASN 107  77.010  24.126  -7.627
  806   2HD2  ASN 107          HD21      ASN 107  75.450  23.507  -7.878
  807    H    ALA 108           HN       ALA 108  75.308  18.881  -6.873
  808    HA   ALA 108           HA       ALA 108  77.102  17.645  -7.817
  809   1HB   ALA 108           HB2      ALA 108  75.392  18.859  -9.735
  810   2HB   ALA 108           HB1      ALA 108  77.031  18.964 -10.379
  811   3HB   ALA 108           HB3      ALA 108  76.356  17.396  -9.934
  812    H    ASP 109           HN       ASP 109  78.445  19.279  -6.313
  813    HA   ASP 109           HA       ASP 109  80.495  20.544  -8.093
  814   1HB   ASP 109           HB2      ASP 109  80.511  22.481  -6.680
  815   2HB   ASP 109           HB1      ASP 109  78.811  22.129  -6.993
  816    H    GLY 110           HN       GLY 110  80.030  18.055  -6.122
  817   1HA   GLY 110           HA2      GLY 110  81.870  16.718  -5.274
  818   2HA   GLY 110           HA1      GLY 110  82.794  18.200  -5.031
  819    H    TYR 111           HN       TYR 111  80.394  19.528  -3.819
  820    HA   TYR 111           HA       TYR 111  80.323  18.074  -1.196
  821   1HB   TYR 111           HB2      TYR 111  80.651  21.044  -1.736
  822   2HB   TYR 111           HB1      TYR 111  80.585  20.295  -0.141
  823    HD1  TYR 111           HD2      TYR 111  82.456  20.019  -3.382
  824    HD2  TYR 111           HD1      TYR 111  82.578  19.685   0.898
  825    HE1  TYR 111           HE2      TYR 111  84.893  19.570  -3.489
  826    HE2  TYR 111           HE1      TYR 111  85.016  19.236   0.793
  827    HH   TYR 111           HH       TYR 111  86.925  19.968  -1.445
  828    H    ILE 112           HN       ILE 112  78.479  19.121   0.207
  829    HA   ILE 112           HA       ILE 112  76.190  19.936  -1.546
  830    HB   ILE 112           HB       ILE 112  76.103  17.912   0.697
  831   1HG1  ILE 112          HG12      ILE 112  76.711  17.749  -2.210
  832   2HG1  ILE 112          HG11      ILE 112  77.224  16.687  -0.901
  833   1HG2  ILE 112          HG22      ILE 112  74.099  18.735  -1.439
  834   2HG2  ILE 112          HG21      ILE 112  73.850  17.466  -0.237
  835   3HG2  ILE 112          HG23      ILE 112  73.998  19.149   0.273
  836   1HD1  ILE 112          HD12      ILE 112  74.441  16.768  -2.086
  837   2HD1  ILE 112          HD11      ILE 112  75.665  15.557  -2.472
  838   3HD1  ILE 112          HD13      ILE 112  75.003  15.655  -0.839
  839    H    ASP 113           HN       ASP 113  74.921  21.530  -0.653
  840    HA   ASP 113           HA       ASP 113  75.702  22.524   2.059
  841   1HB   ASP 113           HB2      ASP 113  74.448  24.594   1.166
  842   2HB   ASP 113           HB1      ASP 113  75.967  24.184   0.372
  843    H    LEU 114           HN       LEU 114  73.527  23.872   2.893
  844    HA   LEU 114           HA       LEU 114  71.723  21.837   3.800
  845   1HB   LEU 114           HB2      LEU 114  72.411  24.408   4.468
  846   2HB   LEU 114           HB1      LEU 114  70.793  24.639   3.806
  847    HG   LEU 114           HG       LEU 114  71.337  22.439   5.790
  848   1HD1  LEU 114          HD11      LEU 114  71.701  25.185   6.326
  849   2HD1  LEU 114          HD13      LEU 114  70.116  24.775   6.984
  850   3HD1  LEU 114          HD12      LEU 114  71.546  23.883   7.506
  851   1HD2  LEU 114          HD22      LEU 114  68.971  23.898   4.660
  852   2HD2  LEU 114          HD21      LEU 114  69.201  22.167   4.906
  853   3HD2  LEU 114          HD23      LEU 114  68.853  23.213   6.281
  854    H    GLU 115           HN       GLU 115  71.391  24.340   1.268
  855    HA   GLU 115           HA       GLU 115  68.668  23.911   0.604
  856   1HB   GLU 115           HB2      GLU 115  71.136  24.951  -0.712
  857   2HB   GLU 115           HB1      GLU 115  69.754  24.615  -1.755
  858   1HG   GLU 115           HG2      GLU 115  68.533  26.338  -0.904
  859   2HG   GLU 115           HG1      GLU 115  69.100  26.053   0.743
  860    H    GLU 116           HN       GLU 116  71.528  22.021  -0.175
  861    HA   GLU 116           HA       GLU 116  70.148  20.431  -2.235
  862   1HB   GLU 116           HB2      GLU 116  72.865  20.375  -0.897
  863   2HB   GLU 116           HB1      GLU 116  72.385  19.208  -2.131
  864   1HG   GLU 116           HG2      GLU 116  72.039  20.972  -3.755
  865   2HG   GLU 116           HG1      GLU 116  72.307  22.212  -2.530
  866    H    LEU 117           HN       LEU 117  71.409  19.901   1.076
  867    HA   LEU 117           HA       LEU 117  70.731  17.161   1.333
  868   1HB   LEU 117           HB2      LEU 117  72.130  18.536   2.874
  869   2HB   LEU 117           HB1      LEU 117  70.674  19.374   3.412
  870    HG   LEU 117           HG       LEU 117  69.794  16.932   3.868
  871   1HD1  LEU 117          HD12      LEU 117  71.897  15.966   2.794
  872   2HD1  LEU 117          HD11      LEU 117  72.773  16.529   4.217
  873   3HD1  LEU 117          HD13      LEU 117  71.493  15.328   4.387
  874   1HD2  LEU 117          HD23      LEU 117  70.650  18.928   5.450
  875   2HD2  LEU 117          HD22      LEU 117  70.204  17.350   6.098
  876   3HD2  LEU 117          HD21      LEU 117  71.901  17.742   5.820
  877    H    LYS 118           HN       LYS 118  68.761  20.082   1.726
  878    HA   LYS 118           HA       LYS 118  66.479  18.936   2.966
  879   1HB   LYS 118           HB2      LYS 118  66.962  21.229   1.060
  880   2HB   LYS 118           HB1      LYS 118  65.353  20.895   1.701
  881   1HG   LYS 118           HG2      LYS 118  66.155  21.138   3.984
  882   2HG   LYS 118           HG1      LYS 118  67.816  21.320   3.417
  883   1HD   LYS 118           HD2      LYS 118  67.477  23.476   2.683
  884   2HD   LYS 118           HD1      LYS 118  65.782  23.186   2.289
  885   1HE   LYS 118           HE2      LYS 118  65.063  23.618   4.451
  886   2HE   LYS 118           HE1      LYS 118  66.590  23.073   5.175
  887   1HZ   LYS 118           HZ3      LYS 118  67.507  25.057   3.727
  888   2HZ   LYS 118           HZ2      LYS 118  65.930  25.649   3.950
  889   3HZ   LYS 118           HZ1      LYS 118  66.912  25.311   5.295
  890    H    ILE 119           HN       ILE 119  67.545  18.927  -0.401
  891    HA   ILE 119           HA       ILE 119  65.031  17.867  -1.452
  892    HB   ILE 119           HB       ILE 119  67.841  18.037  -2.584
  893   1HG1  ILE 119          HG12      ILE 119  65.456  19.907  -2.721
  894   2HG1  ILE 119          HG11      ILE 119  67.013  20.236  -1.959
  895   1HG2  ILE 119          HG23      ILE 119  65.655  16.638  -3.571
  896   2HG2  ILE 119          HG22      ILE 119  65.567  18.179  -4.423
  897   3HG2  ILE 119          HG21      ILE 119  67.029  17.198  -4.523
  898   1HD1  ILE 119          HD13      ILE 119  67.335  19.386  -4.722
  899   2HD1  ILE 119          HD12      ILE 119  66.314  20.818  -4.599
  900   3HD1  ILE 119          HD11      ILE 119  67.943  20.835  -3.923
  901    H    MET 120           HN       MET 120  68.194  16.544  -0.507
  902    HA   MET 120           HA       MET 120  67.892  13.897  -1.490
  903   1HB   MET 120           HB2      MET 120  70.004  14.635  -0.683
  904   2HB   MET 120           HB1      MET 120  69.320  15.162   0.854
  905   1HG   MET 120           HG2      MET 120  68.764  12.764   1.357
  906   2HG   MET 120           HG1      MET 120  69.637  12.305  -0.105
  907   1HE   MET 120           HE1      MET 120  70.809  10.799   1.011
  908   2HE   MET 120           HE3      MET 120  72.339  11.428   0.386
  909   3HE   MET 120           HE2      MET 120  72.185  11.009   2.089
  910    H    LEU 121           HN       LEU 121  66.799  15.370   1.562
  911    HA   LEU 121           HA       LEU 121  65.767  12.894   2.685
  912   1HB   LEU 121           HB2      LEU 121  65.042  15.768   3.269
  913   2HB   LEU 121           HB1      LEU 121  64.861  14.400   4.363
  914    HG   LEU 121           HG       LEU 121  67.514  15.392   3.276
  915   1HD1  LEU 121          HD12      LEU 121  65.889  16.138   5.625
  916   2HD1  LEU 121          HD11      LEU 121  67.567  15.742   5.993
  917   3HD1  LEU 121          HD13      LEU 121  67.195  17.020   4.835
  918   1HD2  LEU 121          HD22      LEU 121  66.623  13.052   4.867
  919   2HD2  LEU 121          HD21      LEU 121  68.044  13.237   3.837
  920   3HD2  LEU 121          HD23      LEU 121  68.053  13.886   5.477
  921    H    GLN 122           HN       GLN 122  64.472  15.482   0.660
  922    HA   GLN 122           HA       GLN 122  61.686  14.836   0.960
  923   1HB   GLN 122           HB2      GLN 122  63.405  16.601  -0.521
  924   2HB   GLN 122           HB1      GLN 122  62.253  15.865  -1.638
  925   1HG   GLN 122           HG2      GLN 122  60.393  16.511  -0.159
  926   2HG   GLN 122           HG1      GLN 122  61.539  17.245   0.963
  927   1HE2  GLN 122          HE22      GLN 122  62.369  19.903  -1.429
  928   2HE2  GLN 122          HE21      GLN 122  63.180  18.812  -0.414
  929    H    ALA 123           HN       ALA 123  64.298  13.512  -0.953
  930    HA   ALA 123           HA       ALA 123  62.603  11.995  -2.779
  931   1HB   ALA 123           HB2      ALA 123  65.437  12.482  -2.200
  932   2HB   ALA 123           HB1      ALA 123  65.121  10.814  -2.675
  933   3HB   ALA 123           HB3      ALA 123  64.657  12.138  -3.744
  934    H    THR 124           HN       THR 124  63.580  11.659   0.493
  935    HA   THR 124           HA       THR 124  62.517   8.862   0.517
  936    HB   THR 124           HB       THR 124  64.461   8.440   2.179
  937    HG1  THR 124           HG1      THR 124  66.240   9.954   1.260
  938   1HG2  THR 124          HG21      THR 124  64.201   8.101  -0.562
  939   2HG2  THR 124          HG23      THR 124  65.771   8.886  -0.396
  940   3HG2  THR 124          HG22      THR 124  65.448   7.373   0.451
  941    H    GLY 125           HN       GLY 125  61.679  11.718   1.478
  942   1HA   GLY 125           HA2      GLY 125  60.722  10.785   4.112
  943   2HA   GLY 125           HA1      GLY 125  61.720  12.239   4.125
  944    H    GLU 126           HN       GLU 126  59.215  12.576   5.053
  945    HA   GLU 126           HA       GLU 126  57.278  13.265   2.997
  946   1HB   GLU 126           HB2      GLU 126  57.435  14.160   5.889
  947   2HB   GLU 126           HB1      GLU 126  55.984  14.007   4.898
  948   1HG   GLU 126           HG2      GLU 126  57.318  11.498   4.814
  949   2HG   GLU 126           HG1      GLU 126  57.266  12.001   6.503
  950    H    THR 127           HN       THR 127  56.459  15.817   4.118
  951    HA   THR 127           HA       THR 127  58.504  17.553   2.819
  952    HB   THR 127           HB       THR 127  56.474  19.166   2.988
  953    HG1  THR 127           HG1      THR 127  54.747  18.383   3.865
  954   1HG2  THR 127          HG21      THR 127  56.484  16.619   1.361
  955   2HG2  THR 127          HG23      THR 127  55.314  17.912   1.094
  956   3HG2  THR 127          HG22      THR 127  57.035  18.221   0.869
  957    H    ILE 128           HN       ILE 128  59.983  17.764   4.615
  958    HA   ILE 128           HA       ILE 128  58.951  18.784   7.193
  959    HB   ILE 128           HB       ILE 128  61.595  17.882   6.055
  960   1HG1  ILE 128          HG12      ILE 128  59.880  16.261   6.943
  961   2HG1  ILE 128          HG11      ILE 128  61.425  16.203   7.793
  962   1HG2  ILE 128          HG23      ILE 128  62.059  19.888   7.430
  963   2HG2  ILE 128          HG22      ILE 128  61.154  19.175   8.766
  964   3HG2  ILE 128          HG21      ILE 128  62.651  18.424   8.216
  965   1HD1  ILE 128          HD13      ILE 128  59.717  18.194   9.000
  966   2HD1  ILE 128          HD12      ILE 128  58.874  16.646   8.922
  967   3HD1  ILE 128          HD11      ILE 128  60.435  16.760   9.735
  968    H    THR 129           HN       THR 129  60.081  20.765   8.121
  969    HA   THR 129           HA       THR 129  60.234  22.884   6.027
  970    HB   THR 129           HB       THR 129  59.993  24.326   8.138
  971    HG1  THR 129           HG1      THR 129  59.096  22.004   9.392
  972   1HG2  THR 129          HG21      THR 129  58.096  23.757   6.658
  973   2HG2  THR 129          HG23      THR 129  57.849  22.263   7.562
  974   3HG2  THR 129          HG22      THR 129  57.596  23.821   8.349
  975    H    GLU 130           HN       GLU 130  61.941  24.561   6.322
  976    HA   GLU 130           HA       GLU 130  64.567  23.507   6.500
  977   1HB   GLU 130           HB2      GLU 130  65.135  25.989   6.694
  978   2HB   GLU 130           HB1      GLU 130  64.088  25.558   5.341
  979   1HG   GLU 130           HG2      GLU 130  62.415  26.025   7.600
  980   2HG   GLU 130           HG1      GLU 130  63.548  27.373   7.489
  981    H    ASP 131           HN       ASP 131  62.370  24.449   9.009
  982    HA   ASP 131           HA       ASP 131  64.230  25.170  11.071
  983   1HB   ASP 131           HB2      ASP 131  61.405  24.191  10.855
  984   2HB   ASP 131           HB1      ASP 131  62.157  24.239  12.450
  985    H    ASP 132           HN       ASP 132  62.719  22.032  10.238
  986    HA   ASP 132           HA       ASP 132  64.148  20.578  12.318
  987   1HB   ASP 132           HB2      ASP 132  62.299  20.039  10.039
  988   2HB   ASP 132           HB1      ASP 132  63.266  18.682  10.618
  989    H    ILE 133           HN       ILE 133  64.546  20.986   8.795
  990    HA   ILE 133           HA       ILE 133  66.858  19.218   8.642
  991    HB   ILE 133           HB       ILE 133  65.853  21.369   6.749
  992   1HG1  ILE 133          HG12      ILE 133  65.137  18.422   6.833
  993   2HG1  ILE 133          HG11      ILE 133  64.106  19.701   7.476
  994   1HG2  ILE 133          HG23      ILE 133  67.931  19.283   6.634
  995   2HG2  ILE 133          HG22      ILE 133  66.825  19.272   5.260
  996   3HG2  ILE 133          HG21      ILE 133  67.736  20.732   5.648
  997   1HD1  ILE 133          HD13      ILE 133  64.142  20.783   5.210
  998   2HD1  ILE 133          HD12      ILE 133  65.011  19.374   4.602
  999   3HD1  ILE 133          HD11      ILE 133  63.369  19.197   5.221
 1000    H    GLU 134           HN       GLU 134  66.482  22.257   9.979
 1001    HA   GLU 134           HA       GLU 134  68.922  23.537   9.023
 1002   1HB   GLU 134           HB2      GLU 134  66.681  24.019  10.869
 1003   2HB   GLU 134           HB1      GLU 134  68.205  24.717  11.418
 1004   1HG   GLU 134           HG2      GLU 134  67.775  25.138   8.561
 1005   2HG   GLU 134           HG1      GLU 134  66.483  25.837   9.538
 1006    H    GLU 135           HN       GLU 135  67.996  21.638  11.889
 1007    HA   GLU 135           HA       GLU 135  70.631  21.927  13.143
 1008   1HB   GLU 135           HB2      GLU 135  68.343  20.023  13.735
 1009   2HB   GLU 135           HB1      GLU 135  69.620  20.520  14.847
 1010   1HG   GLU 135           HG2      GLU 135  68.344  22.858  13.749
 1011   2HG   GLU 135           HG1      GLU 135  67.119  21.784  14.426
 1012    H    LEU 136           HN       LEU 136  69.118  19.753  10.884
 1013    HA   LEU 136           HA       LEU 136  70.709  17.405  11.354
 1014   1HB   LEU 136           HB2      LEU 136  68.819  18.503   9.401
 1015   2HB   LEU 136           HB1      LEU 136  70.034  17.464   8.656
 1016    HG   LEU 136           HG       LEU 136  67.973  16.242   9.454
 1017   1HD1  LEU 136          HD13      LEU 136  70.205  15.149   9.164
 1018   2HD1  LEU 136          HD12      LEU 136  70.551  15.485  10.861
 1019   3HD1  LEU 136          HD11      LEU 136  69.232  14.396  10.429
 1020   1HD2  LEU 136          HD22      LEU 136  68.555  17.757  11.810
 1021   2HD2  LEU 136          HD21      LEU 136  67.209  16.650  11.534
 1022   3HD2  LEU 136          HD23      LEU 136  68.723  16.047  12.208
 1023    H    MET 137           HN       MET 137  71.104  20.151   9.093
 1024    HA   MET 137           HA       MET 137  73.583  19.175   7.956
 1025   1HB   MET 137           HB2      MET 137  72.266  20.693   6.689
 1026   2HB   MET 137           HB1      MET 137  72.089  21.801   8.050
 1027   1HG   MET 137           HG2      MET 137  73.737  22.568   6.294
 1028   2HG   MET 137           HG1      MET 137  74.409  22.449   7.920
 1029   1HE   MET 137           HE3      MET 137  73.379  20.082   5.135
 1030   2HE   MET 137           HE2      MET 137  74.511  21.096   4.242
 1031   3HE   MET 137           HE1      MET 137  74.892  19.399   4.522
 1032    H    LYS 138           HN       LYS 138  72.753  21.243  10.700
 1033    HA   LYS 138           HA       LYS 138  75.332  22.376  11.188
 1034   1HB   LYS 138           HB2      LYS 138  73.110  23.043  12.161
 1035   2HB   LYS 138           HB1      LYS 138  73.164  21.592  13.162
 1036   1HG   LYS 138           HG2      LYS 138  74.265  22.862  14.677
 1037   2HG   LYS 138           HG1      LYS 138  75.651  22.736  13.593
 1038   1HD   LYS 138           HD2      LYS 138  75.357  24.858  12.740
 1039   2HD   LYS 138           HD1      LYS 138  73.609  24.826  12.981
 1040   1HE   LYS 138           HE2      LYS 138  73.787  25.769  15.042
 1041   2HE   LYS 138           HE1      LYS 138  75.104  24.672  15.506
 1042   1HZ   LYS 138           HZ3      LYS 138  76.551  25.983  13.970
 1043   2HZ   LYS 138           HZ2      LYS 138  75.297  27.121  13.838
 1044   3HZ   LYS 138           HZ1      LYS 138  76.036  26.837  15.341
 1045    H    ASP 139           HN       ASP 139  73.771  19.573  12.805
 1046    HA   ASP 139           HA       ASP 139  76.221  18.750  14.124
 1047   1HB   ASP 139           HB2      ASP 139  73.863  18.348  14.889
 1048   2HB   ASP 139           HB1      ASP 139  73.665  17.214  13.551
 1049    H    GLY 140           HN       GLY 140  74.853  18.191  10.977
 1050   1HA   GLY 140           HA2      GLY 140  76.307  15.707  10.477
 1051   2HA   GLY 140           HA1      GLY 140  75.431  16.655   9.273
 1052    H    ASP 141           HN       ASP 141  77.137  19.002  10.556
 1053    HA   ASP 141           HA       ASP 141  79.269  18.818   8.521
 1054   1HB   ASP 141           HB2      ASP 141  77.673  20.810   9.546
 1055   2HB   ASP 141           HB1      ASP 141  79.187  21.087  10.408
 1056    H    LYS 142           HN       LYS 142  81.104  17.718   9.122
 1057    HA   LYS 142           HA       LYS 142  81.889  17.211  11.843
 1058   1HB   LYS 142           HB2      LYS 142  82.432  16.007   9.607
 1059   2HB   LYS 142           HB1      LYS 142  83.709  17.211   9.434
 1060   1HG   LYS 142           HG2      LYS 142  84.590  16.550  11.671
 1061   2HG   LYS 142           HG1      LYS 142  83.362  15.287  11.753
 1062   1HD   LYS 142           HD2      LYS 142  84.301  14.102   9.920
 1063   2HD   LYS 142           HD1      LYS 142  85.293  15.479   9.438
 1064   1HE   LYS 142           HE2      LYS 142  86.169  15.100  12.003
 1065   2HE   LYS 142           HE1      LYS 142  85.814  13.432  11.509
 1066   1HZ   LYS 142           HZ1      LYS 142  87.392  15.392   9.927
 1067   2HZ   LYS 142           HZ3      LYS 142  88.050  14.112  10.823
 1068   3HZ   LYS 142           HZ2      LYS 142  87.061  13.787   9.481
 1069    H    ASN 143           HN       ASN 143  82.367  19.921   9.725
 1070    HA   ASN 143           HA       ASN 143  84.217  21.132  11.750
 1071   1HB   ASN 143           HB2      ASN 143  85.567  21.982   9.950
 1072   2HB   ASN 143           HB1      ASN 143  85.289  20.276   9.600
 1073   1HD2  ASN 143          HD22      ASN 143  84.453  22.562   6.628
 1074   2HD2  ASN 143          HD21      ASN 143  85.774  22.597   7.694
 1075    H    ASN 144           HN       ASN 144  81.216  21.299  10.510
 1076    HA   ASN 144           HA       ASN 144  79.633  23.032  10.201
 1077   1HB   ASN 144           HB2      ASN 144  81.591  23.971  12.297
 1078   2HB   ASN 144           HB1      ASN 144  80.197  24.961  11.858
 1079   1HD2  ASN 144          HD22      ASN 144  79.616  21.454  13.903
 1080   2HD2  ASN 144          HD21      ASN 144  81.114  21.759  13.164
 1081    H    ASP 145           HN       ASP 145  80.701  23.250   7.929
 1082    HA   ASP 145           HA       ASP 145  81.903  25.990   7.675
 1083   1HB   ASP 145           HB2      ASP 145  83.254  25.103   5.889
 1084   2HB   ASP 145           HB1      ASP 145  83.378  23.965   7.229
 1085    H    GLY 146           HN       GLY 146  79.394  23.808   6.718
 1086   1HA   GLY 146           HA2      GLY 146  77.373  24.901   5.731
 1087   2HA   GLY 146           HA1      GLY 146  78.472  25.805   4.690
 1088    H    ARG 147           HN       ARG 147  80.217  23.746   3.914
 1089    HA   ARG 147           HA       ARG 147  78.417  22.194   2.117
 1090   1HB   ARG 147           HB2      ARG 147  81.418  22.648   2.089
 1091   2HB   ARG 147           HB1      ARG 147  80.463  21.943   0.785
 1092   1HG   ARG 147           HG2      ARG 147  79.121  24.288   1.238
 1093   2HG   ARG 147           HG1      ARG 147  80.788  24.766   1.560
 1094   1HD   ARG 147           HD2      ARG 147  80.332  23.096  -0.870
 1095   2HD   ARG 147           HD1      ARG 147  79.782  24.783  -0.934
 1096    HE   ARG 147           HE       ARG 147  82.585  23.898  -0.543
 1097   1HH1  ARG 147          HH11      ARG 147  80.275  26.405  -0.138
 1098   2HH1  ARG 147          HH12      ARG 147  81.385  27.679  -0.515
 1099   1HH2  ARG 147          HH21      ARG 147  84.012  25.536  -1.242
 1100   2HH2  ARG 147          HH22      ARG 147  83.500  27.188  -1.139
 1101    H    ILE 148           HN       ILE 148  78.712  19.905   1.887
 1102    HA   ILE 148           HA       ILE 148  80.234  18.592   4.111
 1103    HB   ILE 148           HB       ILE 148  77.444  18.261   3.041
 1104   1HG1  ILE 148          HG12      ILE 148  78.743  18.270   5.782
 1105   2HG1  ILE 148          HG11      ILE 148  77.737  19.538   5.080
 1106   1HG2  ILE 148          HG23      ILE 148  79.204  16.085   4.175
 1107   2HG2  ILE 148          HG22      ILE 148  77.452  16.035   4.371
 1108   3HG2  ILE 148          HG21      ILE 148  78.158  16.023   2.756
 1109   1HD1  ILE 148          HD11      ILE 148  75.862  17.841   4.946
 1110   2HD1  ILE 148          HD13      ILE 148  76.876  16.752   5.894
 1111   3HD1  ILE 148          HD12      ILE 148  76.339  18.283   6.585
 1112    H    ASP 149           HN       ASP 149  81.781  17.226   3.321
 1113    HA   ASP 149           HA       ASP 149  81.621  16.405   0.458
 1114   1HB   ASP 149           HB2      ASP 149  84.073  15.846   0.935
 1115   2HB   ASP 149           HB1      ASP 149  83.636  17.550   1.048
 1116    H    TYR 150           HN       TYR 150  83.105  14.153   0.386
 1117    HA   TYR 150           HA       TYR 150  81.321  12.091   1.283
 1118   1HB   TYR 150           HB2      TYR 150  82.809  11.960  -0.679
 1119   2HB   TYR 150           HB1      TYR 150  84.218  12.015   0.380
 1120    HD1  TYR 150           HD2      TYR 150  80.992  10.193   0.863
 1121    HD2  TYR 150           HD1      TYR 150  85.216   9.887   0.135
 1122    HE1  TYR 150           HE2      TYR 150  80.868   7.734   1.162
 1123    HE2  TYR 150           HE1      TYR 150  85.089   7.428   0.435
 1124    HH   TYR 150           HH       TYR 150  82.229   5.871   1.646
 1125    H    ASP 151           HN       ASP 151  84.080  13.633   2.792
 1126    HA   ASP 151           HA       ASP 151  84.565  11.508   4.739
 1127   1HB   ASP 151           HB2      ASP 151  85.364  14.423   4.902
 1128   2HB   ASP 151           HB1      ASP 151  86.220  13.025   5.553
 1129    H    GLU 152           HN       GLU 152  83.431  14.889   5.171
 1130    HA   GLU 152           HA       GLU 152  82.484  14.592   7.826
 1131   1HB   GLU 152           HB2      GLU 152  81.457  16.349   5.573
 1132   2HB   GLU 152           HB1      GLU 152  81.240  16.655   7.296
 1133   1HG   GLU 152           HG2      GLU 152  83.836  16.514   7.416
 1134   2HG   GLU 152           HG1      GLU 152  83.772  16.764   5.671
 1135    H    PHE 153           HN       PHE 153  80.813  14.044   4.726
 1136    HA   PHE 153           HA       PHE 153  78.183  13.633   5.728
 1137   1HB   PHE 153           HB2      PHE 153  78.696  13.916   3.373
 1138   2HB   PHE 153           HB1      PHE 153  79.703  12.469   3.376
 1139    HD1  PHE 153           HD2      PHE 153  78.607  10.222   3.908
 1140    HD2  PHE 153           HD1      PHE 153  76.361  13.772   3.007
 1141    HE1  PHE 153           HE2      PHE 153  76.615   8.834   3.401
 1142    HE2  PHE 153           HE1      PHE 153  74.370  12.383   2.500
 1143    HZ   PHE 153           HZ       PHE 153  74.497   9.915   2.696
 1144    H    LEU 154           HN       LEU 154  80.945  11.414   5.471
 1145    HA   LEU 154           HA       LEU 154  79.702   8.941   5.949
 1146   1HB   LEU 154           HB2      LEU 154  82.315  10.170   6.115
 1147   2HB   LEU 154           HB1      LEU 154  82.103   9.030   7.445
 1148    HG   LEU 154           HG       LEU 154  82.991   7.792   5.579
 1149   1HD1  LEU 154          HD13      LEU 154  80.590   7.182   6.831
 1150   2HD1  LEU 154          HD12      LEU 154  80.220   6.961   5.121
 1151   3HD1  LEU 154          HD11      LEU 154  81.551   6.068   5.857
 1152   1HD2  LEU 154          HD21      LEU 154  80.989   9.420   4.081
 1153   2HD2  LEU 154          HD23      LEU 154  82.624   8.950   3.619
 1154   3HD2  LEU 154          HD22      LEU 154  81.303   7.789   3.489
 1155    H    GLU 155           HN       GLU 155  80.799  11.356   8.352
 1156    HA   GLU 155           HA       GLU 155  79.859   9.802  10.630
 1157   1HB   GLU 155           HB2      GLU 155  81.102  12.435  10.034
 1158   2HB   GLU 155           HB1      GLU 155  80.184  12.341  11.537
 1159   1HG   GLU 155           HG2      GLU 155  81.493  10.162  11.984
 1160   2HG   GLU 155           HG1      GLU 155  82.576  10.703  10.701
 1161    H    PHE 156           HN       PHE 156  78.688  12.768   8.991
 1162    HA   PHE 156           HA       PHE 156  76.457  13.415  10.492
 1163   1HB   PHE 156           HB2      PHE 156  77.223  14.612   8.496
 1164   2HB   PHE 156           HB1      PHE 156  76.753  13.254   7.476
 1165    HD1  PHE 156           HD1      PHE 156  74.634  13.986  10.341
 1166    HD2  PHE 156           HD2      PHE 156  75.302  14.859   6.188
 1167    HE1  PHE 156           HE1      PHE 156  72.338  14.906  10.165
 1168    HE2  PHE 156           HE2      PHE 156  73.006  15.779   6.012
 1169    HZ   PHE 156           HZ       PHE 156  71.524  15.802   8.001
 1170    H    MET 157           HN       MET 157  76.780  10.686   8.245
 1171    HA   MET 157           HA       MET 157  73.945   9.918   8.639
 1172   1HB   MET 157           HB2      MET 157  75.396   9.859   6.470
 1173   2HB   MET 157           HB1      MET 157  76.063   8.373   7.149
 1174   1HG   MET 157           HG2      MET 157  74.155   7.872   5.673
 1175   2HG   MET 157           HG1      MET 157  73.782   7.441   7.342
 1176   1HE   MET 157           HE3      MET 157  73.715   9.605   4.554
 1177   2HE   MET 157           HE2      MET 157  71.989   9.898   4.360
 1178   3HE   MET 157           HE1      MET 157  73.009  11.138   5.085
 1179    H    LYS 158           HN       LYS 158  77.190   8.877   9.602
 1180    HA   LYS 158           HA       LYS 158  76.537   6.289  10.613
 1181   1HB   LYS 158           HB2      LYS 158  78.789   7.563  10.204
 1182   2HB   LYS 158           HB1      LYS 158  78.570   8.127  11.862
 1183   1HG   LYS 158           HG2      LYS 158  78.672   5.945  12.748
 1184   2HG   LYS 158           HG1      LYS 158  78.344   5.199  11.184
 1185   1HD   LYS 158           HD2      LYS 158  80.740   6.877  11.140
 1186   2HD   LYS 158           HD1      LYS 158  80.858   5.556  12.304
 1187   1HE   LYS 158           HE2      LYS 158  81.201   4.084  10.620
 1188   2HE   LYS 158           HE1      LYS 158  79.667   4.565   9.869
 1189   1HZ   LYS 158           HZ3      LYS 158  82.124   6.213   9.692
 1190   2HZ   LYS 158           HZ2      LYS 158  81.725   5.046   8.524
 1191   3HZ   LYS 158           HZ1      LYS 158  80.698   6.373   8.789
 1192    H    GLY 159           HN       GLY 159  76.147   9.512  12.009
 1193   1HA   GLY 159           HA2      GLY 159  74.208   8.670  13.914
 1194   2HA   GLY 159           HA1      GLY 159  75.770   8.760  14.727
 1195    H    VAL 160           HN       VAL 160  73.262  10.480  14.889
 1196    HA   VAL 160           HA       VAL 160  74.682  13.057  14.960
 1197    HB   VAL 160           HB       VAL 160  72.243  13.549  13.529
 1198   1HG1  VAL 160          HG12      VAL 160  74.607  14.707  13.654
 1199   2HG1  VAL 160          HG11      VAL 160  74.957  13.678  12.266
 1200   3HG1  VAL 160          HG13      VAL 160  73.632  14.839  12.190
 1201   1HG2  VAL 160          HG23      VAL 160  72.507  11.159  12.766
 1202   2HG2  VAL 160          HG22      VAL 160  72.605  12.337  11.456
 1203   3HG2  VAL 160          HG21      VAL 160  74.077  11.602  12.092
 1204    H    GLU 161           HN       GLU 161  71.367  11.685  14.969
 1205    HA   GLU 161           HA       GLU 161  70.727  13.401  17.325
 1206   1HB   GLU 161           HB2      GLU 161  69.406  12.588  14.949
 1207   2HB   GLU 161           HB1      GLU 161  68.544  11.825  16.286
 1208   1HG   GLU 161           HG2      GLU 161  67.519  13.805  16.625
 1209   2HG   GLU 161           HG1      GLU 161  69.073  14.421  17.186
   
  No H/Q in entry =        1209