*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   19-DEC-08   2KCD              
*TITLE     SOLUTION NMR STRUCTURE OF SSP0047 FROM STAPHYLOCOCCUS                 
*TITLE    2 SAPROPHYTICUS. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM              
*TITLE    3 TARGET SYR6.                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UNCHARACTERIZED PROTEIN SSP0047;                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS SAPROPHYTICUS SUBSP.             
*SOURCE   3 SAPROPHYTICUS ATCC 15305;                                            
*SOURCE   4 ORGANISM_TAXID: 342451;                                              
*SOURCE   5 STRAIN: DSM 20229;                                                   
*SOURCE   6 ATCC: 15305;                                                         
*SOURCE   7 GENE: SSP0047;                                                       
*SOURCE   8 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   9 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE  10 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)PMGK;                             
*SOURCE  11 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  12 EXPRESSION_SYSTEM_PLASMID: PET21                                     
*KEYWDS    ALPHA BETA, STRUCTURAL GENOMICS, UNKNOWN FUNCTION, PSI-2,             
*KEYWDS   2 PROTEIN STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS          
*KEYWDS   3 CONSORTIUM, NESG                                                     
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    T.A.RAMELOT, K.DING, C.X.CHEN, M.JIANG, C.CICCOSANTI,                 
*AUTHOR   2 R.XIAO, J.LIU, M.C.BARAN, G.SWAPNA, T.B.ACTON, B.ROST,               
*AUTHOR   3 G.T.MONTELIONE, M.A.KENNEDY, NORTHEAST STRUCTURAL GENOMICS           
*AUTHOR   4 CONSORTIUM (NESG)                                                    
*REVDAT   1   10-FEB-09 2KCD    0                                                


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assign (resid   3  and name  HA )(resid   6  and name  HG*  )  1.8 0.0 2.25
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assign (resid   3  and name  HB* )(resid   70  and name  HD1*  )  1.8 0.0 3.2
assign (resid   3  and name  HB* )(resid   80  and name  HD1*  )  1.8 0.0 3.2
assign (resid   3  and name  HB1 )(resid   3  and name  HD1*  )  1.8 0.0 2.12
assign (resid   3  and name  HB1 )(resid   3  and name  HD2*  )  1.8 0.0 2.12
assign (resid   3  and name  HB1 )(resid   4  and name  HN  )  1.8 0.0 2.88
assign (resid   3  and name  HB2 )(resid   3  and name  HD1*  )  1.8 0.0 2.12
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assign (resid   3  and name  HB2 )(resid   4  and name  HN  )  1.8 0.0 2.88
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assign (resid   3  and name  HD1* )(resid   80  and name  HD1*  )  1.8 0.0 2.2
assign (resid   3  and name  HD2* )(resid   80  and name  HD1*  )  1.8 0.0 2.2
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assign (resid   3  and name  HN )(resid   3  and name  HB2  )  1.8 0.0 2.35
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assign (resid   5  and name  HA )(resid   5  and name  HD2*  )  1.8 0.0 2.24
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assign (resid   5  and name  HB2 )(resid   5  and name  HD1*  )  1.8 0.0 2.14
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assign (resid   7  and name  HA )(resid   10  and name  HN  )  1.8 0.0 2.71
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assign (resid   7  and name  HB* )(resid   80  and name  HG2*  )  1.8 0.0 2.51
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assign (resid   7  and name  HB2 )(resid   7  and name  HD1*  )  1.8 0.0 1.83
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assign (resid   7  and name  HD1* )(resid   11  and name  HD1*  )  1.8 0.0 2.02
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assign (resid   7  and name  HD1* )(resid   80  and name  HD1*  )  1.8 0.0 2.59
assign (resid   7  and name  HD1* )(resid   92  and name  HD*  )  1.8 0.0 2.5
assign (resid   7  and name  HD2* )(resid   8  and name  HN  )  1.8 0.0 3.7
assign (resid   7  and name  HD2* )(resid   68  and name  HB*  )  1.8 0.0 2.27
assign (resid   7  and name  HD2* )(resid   70  and name  HG1*  )  1.8 0.0 2.05
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assign (resid   7  and name  HN )(resid   7  and name  HB2  )  1.8 0.0 2.3
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assign (resid   7  and name  HN )(resid   8  and name  HN  )  1.8 0.0 2.5
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assign (resid   8  and name  HA )(resid   11  and name  HN  )  1.8 0.0 2.71
assign (resid   8  and name  HA )(resid   23  and name  HH2  )  1.8 0.0 3.2
assign (resid   8  and name  HA )(resid   23  and name  HZ3  )  1.8 0.0 3.2
assign (resid   8  and name  HB* )(resid   9  and name  HN  )  1.8 0.0 2.41
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assign (resid   8  and name  HN )(resid   8  and name  HD*  )  1.8 0.0 3.54
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assign (resid   10  and name  HA )(resid   10  and name  HD*  )  1.8 0.0 1.86
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assign (resid   10  and name  HB* )(resid   92  and name  HD*  )  1.8 0.0 3.28
assign (resid   10  and name  HB* )(resid   108  and name  HD2*  )  1.8 0.0 1.93
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assign (resid   10  and name  HD* )(resid   11  and name  HD1*  )  1.8 0.0 3.0
assign (resid   10  and name  HD* )(resid   11  and name  HN  )  1.8 0.0 2.5
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assign (resid   10  and name  HD* )(resid   92  and name  HD2*  )  1.8 0.0 3.2
assign (resid   10  and name  HD* )(resid   108  and name  HD2*  )  1.8 0.0 3.2
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assign (resid   10  and name  HE* )(resid   14  and name  HD2*  )  1.8 0.0 3.2
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assign (resid   11  and name  HA )(resid   14  and name  HB*  )  1.8 0.0 1.86
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assign (resid   11  and name  HD1* )(resid   66  and name  HG2*  )  1.8 0.0 3.0
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assign (resid   11  and name  HG1* )(resid   66  and name  HG2*  )  1.8 0.0 3.04
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assign (resid   11  and name  HG2* )(resid   11  and name  HG1*  )  1.8 0.0 1.46
assign (resid   11  and name  HG2* )(resid   15  and name  HD*  )  1.8 0.0 3.2
assign (resid   11  and name  HG2* )(resid   17  and name  HD1*  )  1.8 0.0 2.5 
assign (resid   11  and name  HG2* )(resid   23  and name  HH2  )  1.8 0.0 3.2
assign (resid   11  and name  HG2* )(resid   23  and name  HZ2  )  1.8 0.0 3.2
assign (resid   11  and name  HG2* )(resid   61  and name  HD2*  )  1.8 0.0 2.4
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assign (resid   11  and name  HN )(resid   11  and name  HB  )  1.8 0.0 1.98
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assign (resid   11  and name  HN )(resid   11  and name  HG1*  )  1.8 0.0 2.4
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assign (resid   12  and name  HA )(resid   17  and name  HG  )  1.8 0.0 2.97
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assign (resid   12  and name  HG2* )(resid   23  and name  HZ2  )  1.8 0.0 1.91
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assign (resid   17  and name  HA )(resid   60  and name  HG2*  )  1.8 0.0 2.7
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assign (resid   17  and name  HD1* )(resid   23  and name  HZ2  )  1.8 0.0 3.2
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assign (resid   17  and name  HD1* )(resid   61  and name  HD*  )  1.8 0.0 1.7
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assign (resid   17  and name  HD2* )(resid   60  and name  HG2*  )  1.8 0.0 2.2
assign (resid   17  and name  HD2* )(resid   61  and name  HD*  )  1.8 0.0 2.38
assign (resid   17  and name  HN )(resid   17  and name  HD1*  )  1.8 0.0 2.51
assign (resid   17  and name  HN )(resid   17  and name  HD2*  )  1.8 0.0 2.05
assign (resid   17  and name  HN )(resid   17  and name  HG  )  1.8 0.0 2.6
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assign (resid   19  and name  HN )(resid   19  and name  HD*  )  1.8 0.0 3.2
assign (resid   19  and name  HN )(resid   19  and name  HG*  )  1.8 0.0 2.23
assign (resid   19  and name  HN )(resid   20  and name  HN  )  1.8 0.0 1.75
assign (resid   20  and name  HB* )(resid   21  and name  HN  )  1.8 0.0 2.68
assign (resid   20  and name  HN )(resid   20  and name  HB*  )  1.8 0.0 1.67
assign (resid   20  and name  HN )(resid   21  and name  HN  )  1.8 0.0 1.81
assign (resid   21  and name  HA )(resid   21  and name  HG1  )  1.8 0.0 2.63
assign (resid   21  and name  HA )(resid   21  and name  HG2  )  1.8 0.0 2.63
assign (resid   21  and name  HA )(resid   22  and name  HN  )  1.8 0.0 1.48
assign (resid   21  and name  HG* )(resid   22  and name  HN  )  1.8 0.0 3
assign (resid   21  and name  HN )(resid   21  and name  HB1  )  1.8 0.0 1.86
assign (resid   21  and name  HN )(resid   21  and name  HB2  )  1.8 0.0 1.86
assign (resid   21  and name  HN )(resid   21  and name  HG*  )  1.8 0.0 2.75
assign (resid   22  and name  HA )(resid   22  and name  HD*  )  1.8 0.0 2.76
assign (resid   22  and name  HA )(resid   22  and name  HG*  )  1.8 0.0 1.85
assign (resid   22  and name  HA )(resid   23  and name  HN  )  1.8 0.0 1.38
assign (resid   22  and name  HB* )(resid   22  and name  HD*  )  1.8 0.0 1.71
assign (resid   22  and name  HB* )(resid   23  and name  HN  )  1.8 0.0 2.11
assign (resid   22  and name  HG* )(resid   22  and name  HD*  )  1.8 0.0 0.55
assign (resid   22  and name  HG* )(resid   22  and name  HE*  )  1.8 0.0 1.73
assign (resid   22  and name  HG* )(resid   23  and name  HN  )  1.8 0.0 2.9
assign (resid   22  and name  HN )(resid   22  and name  HB*  )  1.8 0.0 1.37
assign (resid   23  and name  HA )(resid   23  and name  HD1  )  1.8 0.0 2.92
assign (resid   23  and name  HA )(resid   24  and name  HN  )  1.8 0.0 1.61
assign (resid   23  and name  HA )(resid   58  and name  HA  )  1.8 0.0 2.96
assign (resid   23  and name  HA )(resid   58  and name  HB*  )  1.8 0.0 2.66
assign (resid   23  and name  HB* )(resid   24  and name  HN  )  1.8 0.0 2.48
assign (resid   23  and name  HB* )(resid   56  and name  HD*  )  1.8 0.0 2.48
assign (resid   23  and name  HD1 )(resid   58  and name  HB*  )  1.8 0.0 3
assign (resid   23  and name  HN )(resid   23  and name  HB*  )  1.8 0.0 1.84
assign (resid   23  and name  HN )(resid   24  and name  HN  )  1.8 0.0 3.03
assign (resid   23  and name  HZ2 )(resid   61  and name  HD1*  )  1.8 0.0 3.2
assign (resid   23  and name  HZ2 )(resid   61  and name  HD2*  )  1.8 0.0 3.2
assign (resid   24  and name  HA )(resid   24  and name  HG*  )  1.8 0.0 1.89
assign (resid   24  and name  HA )(resid   25  and name  HN  )  1.8 0.0 1.47
assign (resid   24  and name  HB* )(resid   25  and name  HN  )  1.8 0.0 1.95
assign (resid   24  and name  HG* )(resid   25  and name  HN  )  1.8 0.0 2.9
assign (resid   24  and name  HG* )(resid   57  and name  HN  )  1.8 0.0 3.11
assign (resid   24  and name  HN )(resid   24  and name  HB*  )  1.8 0.0 1.83
assign (resid   24  and name  HN )(resid   25  and name  HN  )  1.8 0.0 3.4
assign (resid   24  and name  HN )(resid   57  and name  HN  )  1.8 0.0 2.9
assign (resid   25  and name  HA )(resid   26  and name  HN  )  1.8 0.0 1.59
assign (resid   25  and name  HA )(resid   56  and name  HA  )  1.8 0.0 1.89
assign (resid   25  and name  HB* )(resid   26  and name  HN  )  1.8 0.0 2.64
assign (resid   25  and name  HB1 )(resid   56  and name  HE*  )  1.8 0.0 2.76
assign (resid   25  and name  HB2 )(resid   56  and name  HE*  )  1.8 0.0 2.76
assign (resid   25  and name  HN )(resid   25  and name  HB*  )  1.8 0.0 1.88
assign (resid   26  and name  HA )(resid   26  and name  HG*  )  1.8 0.0 2
assign (resid   26  and name  HA )(resid   27  and name  HN  )  1.8 0.0 1.44
assign (resid   26  and name  HB* )(resid   55  and name  HB  )  1.8 0.0 2.27
assign (resid   26  and name  HB* )(resid   55  and name  HG2*  )  1.8 0.0 3.54
assign (resid   26  and name  HB* )(resid   57  and name  HD*  )  1.8 0.0 1.91
assign (resid   26  and name  HB* )(resid   57  and name  HE*  )  1.8 0.0 2.08
assign (resid   26  and name  HG* )(resid   28  and name  HG2*  )  1.8 0.0 3.2 
assign (resid   26  and name  HN )(resid   26  and name  HB*  )  1.8 0.0 1.58
assign (resid   26  and name  HN )(resid   26  and name  HG*  )  1.8 0.0 2.74
assign (resid   26  and name  HN )(resid   55  and name  HB  )  1.8 0.0 3.01
assign (resid   26  and name  HN )(resid   55  and name  HN  )  1.8 0.0 2.33
assign (resid   26  and name  HN )(resid   56  and name  HA  )  1.8 0.0 2.76
assign (resid   27  and name  HA )(resid   28  and name  HN  )  1.8 0.0 1.49
assign (resid   27  and name  HA )(resid   54  and name  HA  )  1.8 0.0 1.77
assign (resid   27  and name  HA )(resid   55  and name  HN  )  1.8 0.0 3.2
assign (resid   27  and name  HB* )(resid   28  and name  HN  )  1.8 0.0 2.5
assign (resid   27  and name  HB* )(resid   54  and name  HA  )  1.8 0.0 3.41
assign (resid   27  and name  HN )(resid   27  and name  HB1  )  1.8 0.0 2.25
assign (resid   27  and name  HN )(resid   27  and name  HB2  )  1.8 0.0 2.25
assign (resid   27  and name  HN )(resid   28  and name  HN  )  1.8 0.0 2.7
assign (resid   28  and name  HA )(resid   28  and name  HG2*  )  1.8 0.0 1.62
assign (resid   28  and name  HA )(resid   29  and name  HN  )  1.8 0.0 1.41
assign (resid   28  and name  HB )(resid   28  and name  HD1*  )  1.8 0.0 1.72
assign (resid   28  and name  HB )(resid   29  and name  HN  )  1.8 0.0 2.9
assign (resid   28  and name  HG11 )(resid   29  and name  HN  )  1.8 0.0 3.43
assign (resid   28  and name  HG12 )(resid   29  and name  HN  )  1.8 0.0 3.43
assign (resid   28  and name  HG2* )(resid   28  and name  HD1*  )  1.8 0.0 1.62
assign (resid   28  and name  HG2* )(resid   28  and name  HG11  )  1.8 0.0 1.98
assign (resid   28  and name  HG2* )(resid   28  and name  HG12  )  1.8 0.0 1.98
assign (resid   28  and name  HG2* )(resid   29  and name  HN  )  1.8 0.0 2.72
.assign (resid   28  and name  HN )(resid   28  and name  HG12  )  1.8 0.0 2.95
assign (resid   28  and name  HN )(resid   53  and name  HN  )  1.8 0.0 2.8
assign (resid   29  and name  HA )(resid   29  and name  HG1  )  1.8 0.0 2.12
assign (resid   29  and name  HA )(resid   29  and name  HG2  )  1.8 0.0 2.12
assign (resid   29  and name  HA )(resid   30  and name  HN  )  1.8 0.0 1.54
assign (resid   29  and name  HA )(resid   50  and name  HG2*  )  1.8 0.0 3.2
assign (resid   29  and name  HA )(resid   52  and name  HA  )  1.8 0.0 1.87
assign (resid   29  and name  HA )(resid   53  and name  HN  )  1.8 0.0 2.51
assign (resid   29  and name  HB* )(resid   50  and name  HG2*  )  1.8 0.0 1.81
assign (resid   29  and name  HB1 )(resid   30  and name  HN  )  1.8 0.0 2.67
assign (resid   29  and name  HB2 )(resid   30  and name  HN  )  1.8 0.0 2.67
assign (resid   29  and name  HG* )(resid   50  and name  HG2*  )  1.8 0.0 3.11
assign (resid   29  and name  HG1 )(resid   52  and name  HA  )  1.8 0.0 3.05
assign (resid   29  and name  HG2 )(resid   52  and name  HA  )  1.8 0.0 3.05
assign (resid   29  and name  HN )(resid   29  and name  HB1  )  1.8 0.0 2.3
assign (resid   29  and name  HN )(resid   29  and name  HB2  )  1.8 0.0 2.3
assign (resid   29  and name  HN )(resid   29  and name  HG1  )  1.8 0.0 2.75
assign (resid   29  and name  HN )(resid   29  and name  HG2  )  1.8 0.0 2.75
assign (resid   30  and name  HA )(resid   30  and name  HG1  )  1.8 0.0 2.36
assign (resid   30  and name  HA )(resid   30  and name  HG2  )  1.8 0.0 2.36
assign (resid   30  and name  HA )(resid   31  and name  HN  )  1.8 0.0 1.52
assign (resid   30  and name  HB* )(resid   35  and name  HG2*  )  1.8 0.0 2.51
assign (resid   30  and name  HB1 )(resid   31  and name  HN  )  1.8 0.0 2.49
assign (resid   30  and name  HB2 )(resid   31  and name  HN  )  1.8 0.0 2.49
assign (resid   30  and name  HG* )(resid   31  and name  HN  )  1.8 0.0 3.34
assign (resid   30  and name  HG* )(resid   35  and name  HG2*  )  1.8 0.0 3.21
assign (resid   30  and name  HG* )(resid   53  and name  HG2*  )  1.8 0.0 3.2
assign (resid   30  and name  HN )(resid   30  and name  HG*  )  1.8 0.0 2.57
assign (resid   30  and name  HN )(resid   50  and name  HG2*  )  1.8 0.0 3.2
assign (resid   30  and name  HN )(resid   51  and name  HN  )  1.8 0.0 2.18
assign (resid   30  and name  HN )(resid   53  and name  HG2*  )  1.8 0.0 3.4
assign (resid   31  and name  HA )(resid   31  and name  HG1*  )  1.8 0.0 1.57
assign (resid   31  and name  HA )(resid   31  and name  HG2*  )  1.8 0.0 1.62
assign (resid   31  and name  HA )(resid   32  and name  HN  )  1.8 0.0 1.45
assign (resid   31  and name  HA )(resid   50  and name  HA  )  1.8 0.0 1.26
assign (resid   31  and name  HA )(resid   50  and name  HD1*  )  1.8 0.0 2.98
assign (resid   31  and name  HA )(resid   50  and name  HG1*  )  1.8 0.0 2.99
assign (resid   31  and name  HA )(resid   51  and name  HD*  )  1.8 0.0 3.48
assign (resid   31  and name  HA )(resid   51  and name  HN  )  1.8 0.0 1.98
assign (resid   31  and name  HB )(resid   34  and name  HN  )  1.8 0.0 2.29
assign (resid   31  and name  HG* )(resid   33  and name  HB*  )  1.8 0.0 2.75
assign (resid   31  and name  HG* )(resid   33  and name  HN  )  1.8 0.0 1.75
assign (resid   31  and name  HG* )(resid   34  and name  HN  )  1.8 0.0 1.75
assign (resid   31  and name  HG1* )(resid   32  and name  HN  )  1.8 0.0 1.45
assign (resid   31  and name  HG1* )(resid   34  and name  HB*  )  1.8 0.0 3.47
assign (resid   31  and name  HG1* )(resid   48  and name  HA  )  1.8 0.0 2.81
assign (resid   31  and name  HG1* )(resid   48  and name  HB*  )  1.8 0.0 3.7
assign (resid   31  and name  HG1* )(resid   49  and name  HN  )  1.8 0.0 2.15
assign (resid   31  and name  HG1* )(resid   50  and name  HA  )  1.8 0.0 3.06
assign (resid   31  and name  HG2* )(resid   34  and name  HB*  )  1.8 0.0 3.47
assign (resid   31  and name  HG2* )(resid   48  and name  HA  )  1.8 0.0 2.81
assign (resid   31  and name  HG2* )(resid   48  and name  HB*  )  1.8 0.0 3.7
assign (resid   31  and name  HG2* )(resid   50  and name  HA  )  1.8 0.0 1.86
assign (resid   31  and name  HG2* )(resid   50  and name  HG11  )  1.8 0.0 2.82
assign (resid   31  and name  HG2* )(resid   50  and name  HG12  )  1.8 0.0 2.82
assign (resid   31  and name  HN )(resid   31  and name  HB  )  1.8 0.0 1.66
assign (resid   31  and name  HN )(resid   31  and name  HG2*  )  1.8 0.0 1.68
assign (resid   31  and name  HN )(resid   50  and name  HA  )  1.8 0.0 2.9
assign (resid   32  and name  HA )(resid   35  and name  HG2*  )  1.8 0.0 3.2 
assign (resid   32  and name  HA )(resid   36  and name  HB*  )  1.8 0.0 3.7
assign (resid   32  and name  HA )(resid   51  and name  HB*  )  1.8 0.0 2.8
assign (resid   32  and name  HA )(resid   51  and name  HD*  )  1.8 0.0 2.5
assign (resid   32  and name  HA )(resid   71  and name  HD1*  )  1.8 0.0 3.02
assign (resid   32  and name  HB* )(resid   33  and name  HN  )  1.8 0.0 1.76
assign (resid   32  and name  HB* )(resid   36  and name  HB*  )  1.8 0.0 2.55
assign (resid   32  and name  HB* )(resid   36  and name  HD1*  )  1.8 0.0 3.2
assign (resid   32  and name  HB* )(resid   36  and name  HD2*  )  1.8 0.0 4.2
assign (resid   32  and name  HB* )(resid   41  and name  HG1*  )  1.8 0.0 2.18
assign (resid   32  and name  HB* )(resid   41  and name  HG2*  )  1.8 0.0 1.36
assign (resid   32  and name  HB* )(resid   46  and name  HA  )  1.8 0.0 3.17
assign (resid   32  and name  HB* )(resid   47  and name  HA  )  1.8 0.0 4
assign (resid   32  and name  HB* )(resid   49  and name  HN  )  1.8 0.0 2.74
assign (resid   32  and name  HB* )(resid   51  and name  HA  )  1.8 0.0 4.2
assign (resid   32  and name  HB* )(resid   51  and name  HD*  )  1.8 0.0 2
assign (resid   32  and name  HN )(resid   32  and name  HB*  )  1.8 0.0 1.44
assign (resid   32  and name  HN )(resid   33  and name  HN  )  1.8 0.0 2.44
assign (resid   32  and name  HN )(resid   34  and name  HN  )  1.8 0.0 2.97
assign (resid   32  and name  HN )(resid   49  and name  HN  )  1.8 0.0 2.58
assign (resid   32  and name  HN )(resid   50  and name  HA  )  1.8 0.0 2.32
assign (resid   32  and name  HN )(resid   51  and name  HB*  )  1.8 0.0 3.7
assign (resid   32  and name  HN )(resid   51  and name  HD2*  )  1.8 0.0 3.51
assign (resid   33  and name  HA )(resid   41  and name  HB  )  1.8 0.0 2.61
assign (resid   33  and name  HA )(resid   41  and name  HG1*  )  1.8 0.0 1.67
assign (resid   33  and name  HA )(resid   41  and name  HG2*  )  1.8 0.0 1.52
assign (resid   33  and name  HB* )(resid   34  and name  HN  )  1.8 0.0 2.17
assign (resid   33  and name  HB* )(resid   41  and name  HG1*  )  1.8 0.0 3.2
assign (resid   33  and name  HB* )(resid   41  and name  HG2*  )  1.8 0.0 3.2
assign (resid   33  and name  HN )(resid   33  and name  HB*  )  1.8 0.0 1.77
assign (resid   33  and name  HN )(resid   34  and name  HN  )  1.8 0.0 2.1
assign (resid   33  and name  HN )(resid   41  and name  HG1*  )  1.8 0.0 2.86
assign (resid   33  and name  HN )(resid   41  and name  HG2*  )  1.8 0.0 3.05
assign (resid   34  and name  HB* )(resid   35  and name  HG2*  )  1.8 0.0 3.2
assign (resid   34  and name  HB* )(resid   35  and name  HN  )  1.8 0.0 2.36
assign (resid   34  and name  HN )(resid   34  and name  HB*  )  1.8 0.0 1.44
assign (resid   34  and name  HN )(resid   35  and name  HN  )  1.8 0.0 1.46
assign (resid   35  and name  HA )(resid   35  and name  HD1*  )  1.8 0.0 2.47
assign (resid   35  and name  HA )(resid   35  and name  HG2*  )  1.8 0.0 1.74
assign (resid   35  and name  HB )(resid   35  and name  HD1*  )  1.8 0.0 1.5
assign (resid   35  and name  HD1* )(resid   51  and name  HD*  )  1.8 0.0 3.2
assign (resid   35  and name  HD1* )(resid   53  and name  HG2*  )  1.8 0.0 2.8
assign (resid   35  and name  HD1* )(resid   71  and name  HD1*  )  1.8 0.0 2.57
assign (resid   35  and name  HD1* )(resid   71  and name  HD2*  )  1.8 0.0 2.8
assign (resid   35  and name  HD1* )(resid   71  and name  HG  )  1.8 0.0 2.95
assign (resid   35  and name  HD1* )(resid   89  and name  HE*  )  1.8 0.0 4.0
assign (resid   35  and name  HG1* )(resid   36  and name  HN  )  1.8 0.0 2.48
assign (resid   35  and name  HG2* )(resid   35  and name  HD1*  )  1.8 0.0 1.77
assign (resid   35  and name  HG2* )(resid   35  and name  HG11  )  1.8 0.0 2
assign (resid   35  and name  HG2* )(resid   35  and name  HG12  )  1.8 0.0 2
assign (resid   35  and name  HG2* )(resid   36  and name  HN  )  1.8 0.0 2.61
assign (resid   35  and name  HG2* )(resid   53  and name  HG2*  )  1.8 0.0 3.2
assign (resid   35  and name  HN )(resid   35  and name  HB  )  1.8 0.0 2.13
assign (resid   35  and name  HN )(resid   35  and name  HG1*  )  1.8 0.0 2.41
assign (resid   35  and name  HN )(resid   35  and name  HG2*  )  1.8 0.0 1.8
assign (resid   35  and name  HN )(resid   36  and name  HN  )  1.8 0.0 1.51
assign (resid   36  and name  HA )(resid   36  and name  HD1*  )  1.8 0.0 2.3
assign (resid   36  and name  HA )(resid   36  and name  HD2*  )  1.8 0.0 1.5
assign (resid   36  and name  HA )(resid   37  and name  HD*  )  1.8 0.0 1.51
assign (resid   36  and name  HA )(resid   89  and name  HE*  )  1.8 0.0 2.91
assign (resid   36  and name  HB* )(resid   36  and name  HD2*  )  1.8 0.0 1.62
assign (resid   36  and name  HB1 )(resid   36  and name  HD1*  )  1.8 0.0 1.9
assign (resid   36  and name  HB1 )(resid   41  and name  HG2*  )  1.8 0.0 2.14
assign (resid   36  and name  HB2 )(resid   36  and name  HD1*  )  1.8 0.0 1.9
assign (resid   36  and name  HB2 )(resid   41  and name  HG2*  )  1.8 0.0 2.14
assign (resid   36  and name  HD1* )(resid   79  and name  HB*  )  1.8 0.0 2.79
assign (resid   36  and name  HD1* )(resid   94  and name  HD1*  )  1.8 0.0 3.00
assign (resid   36  and name  HD2* )(resid   37  and name  HD*  )  1.8 0.0 1.39
assign (resid   36  and name  HD2* )(resid   40  and name  HD*  )  1.8 0.0 3.2
assign (resid   36  and name  HD2* )(resid   79  and name  HB*  )  1.8 0.0 2.72
assign (resid   36  and name  HD2* )(resid   91  and name  HD*  )  1.8 0.0 2.81
assign (resid   36  and name  HD2* )(resid   91  and name  HE*  )  1.8 0.0 2.33
assign (resid   36  and name  HG )(resid   79  and name  HB*  )  1.8 0.0 3.7
assign (resid   36  and name  HN )(resid   36  and name  HB1  )  1.8 0.0 2.02
assign (resid   36  and name  HN )(resid   36  and name  HB2  )  1.8 0.0 2.02
assign (resid   36  and name  HN )(resid   36  and name  HD1*  )  1.8 0.0 2.36
assign (resid   36  and name  HN )(resid   36  and name  HD2*  )  1.8 0.0 2.81
assign (resid   36  and name  HN )(resid   36  and name  HG  )  1.8 0.0 2.88
assign (resid   36  and name  HN )(resid   41  and name  HG2*  )  1.8 0.0 2.95
assign (resid   37  and name  HA )(resid   38  and name  HN  )  1.8 0.0 1.31
assign (resid   37  and name  HB* )(resid   39  and name  HN  )  1.8 0.0 3.2
assign (resid   37  and name  HB1 )(resid   38  and name  HN  )  1.8 0.0 2.83
assign (resid   37  and name  HB2 )(resid   38  and name  HN  )  1.8 0.0 2.83
assign (resid   37  and name  HD* )(resid   40  and name  HB*  )  1.8 0.0 2.81
assign (resid   37  and name  HD* )(resid   40  and name  HD*  )  1.8 0.0 3.2
assign (resid   37  and name  HD* )(resid   89  and name  HE*  )  1.8 0.0 3.51
assign (resid   37  and name  HD* )(resid   91  and name  HZ   )  1.8 0.0 3.2 
assign (resid   38  and name  HA )(resid   41  and name  HB  )  1.8 0.0 2.56
assign (resid   38  and name  HA )(resid   41  and name  HG1*  )  1.8 0.0 3.2
assign (resid   38  and name  HA )(resid   41  and name  HG2*  )  1.8 0.0 3.2
assign (resid   38  and name  HA )(resid   41  and name  HN  )  1.8 0.0 2.14
assign (resid   38  and name  HB* )(resid   39  and name  HN  )  1.8 0.0 1.98
assign (resid   38  and name  HN )(resid   38  and name  HB*  )  1.8 0.0 1.37
assign (resid   38  and name  HN )(resid   39  and name  HN  )  1.8 0.0 2.27
assign (resid   39  and name  HA )(resid   42  and name  HG*  )  1.8 0.0 3.9
assign (resid   39  and name  HB* )(resid   39  and name  HE2*  )  1.8 0.0 2.43
assign (resid   39  and name  HB* )(resid   40  and name  HN  )  1.8 0.0 1.86
assign (resid   39  and name  HG* )(resid   39  and name  HE2*  )  1.8 0.0 1.34
assign (resid   39  and name  HN )(resid   39  and name  HB1  )  1.8 0.0 1.84
assign (resid   39  and name  HN )(resid   39  and name  HB2  )  1.8 0.0 1.84
assign (resid   39  and name  HN )(resid   39  and name  HG*  )  1.8 0.0 2.78
assign (resid   39  and name  HN )(resid   40  and name  HN  )  1.8 0.0 1.93
assign (resid   40  and name  HA )(resid   40  and name  HD*  )  1.8 0.0 2.2 
assign (resid   40  and name  HA )(resid   101  and name  HD1*  )  1.8 0.0 3.2 
assign (resid   40  and name  HB* )(resid   101  and name  HD1*  )  1.8 0.0 3.2
assign (resid   40  and name  HD* )(resid   94  and name  HD2*  )  1.8 0.0 3.0
assign (resid   40  and name  HD* )(resid   101  and name  HD1*  )  1.8 0.0 2.55
assign (resid   40  and name  HE* )(resid   94  and name  HD2*  )  1.8 0.0 3.0
assign (resid   40  and name  HE* )(resid   101  and name  HD1*  )  1.8 0.0 2.8
assign (resid   40  and name  HN )(resid   40  and name  HB*  )  1.8 0.0 1.57
assign (resid   40  and name  HN )(resid   40  and name  HD*  )  1.8 0.0 2.87
assign (resid   40  and name  HN )(resid   41  and name  HN  )  1.8 0.0 1.4
assign (resid   41  and name  HA )(resid   41  and name  HG1*  )  1.8 0.0 1.39
assign (resid   41  and name  HA )(resid   41  and name  HG2*  )  1.8 0.0 1.68
assign (resid   41  and name  HA )(resid   46  and name  HB*  )  1.8 0.0 2.87
assign (resid   41  and name  HA )(resid   46  and name  HD1*  )  1.8 0.0 3.1
assign (resid   41  and name  HB )(resid   42  and name  HN  )  1.8 0.0 2.72
assign (resid   41  and name  HG1* )(resid   46  and name  HB*  )  1.8 0.0 2.48
assign (resid   41  and name  HG1* )(resid   47  and name  HA  )  1.8 0.0 1.84
assign (resid   41  and name  HG1* )(resid   47  and name  HB*  )  1.8 0.0 2.13
assign (resid   41  and name  HG1* )(resid   47  and name  HN  )  1.8 0.0 2.46
assign (resid   41  and name  HG1* )(resid   48  and name  HN  )  1.8 0.0 3.7
assign (resid   41  and name  HN )(resid   41  and name  HB  )  1.8 0.0 2
assign (resid   41  and name  HN )(resid   41  and name  HG2*  )  1.8 0.0 2.2 
assign (resid   41  and name  HN )(resid   42  and name  HN  )  1.8 0.0 2.2
assign (resid   42  and name  HA )(resid   42  and name  HD*  )  1.8 0.0 2.9
assign (resid   42  and name  HA )(resid   42  and name  HG*  )  1.8 0.0 1.87
assign (resid   42  and name  HA )(resid   43  and name  HN  )  1.8 0.0 1.8
assign (resid   42  and name  HB* )(resid   42  and name  HD*  )  1.8 0.0 1.42
assign (resid   42  and name  HB* )(resid   43  and name  HN  )  1.8 0.0 2.18
assign (resid   42  and name  HG* )(resid   43  and name  HN  )  1.8 0.0 2.81
assign (resid   42  and name  HN )(resid   42  and name  HB*  )  1.8 0.0 1.73
assign (resid   42  and name  HN )(resid   42  and name  HD*  )  1.8 0.0 2.98
assign (resid   42  and name  HN )(resid   42  and name  HG*  )  1.8 0.0 2.46
assign (resid   43  and name  HA )(resid   43  and name  HD1*  )  1.8 0.0 2.34
assign (resid   43  and name  HA )(resid   43  and name  HD2*  )  1.8 0.0 2.34
assign (resid   43  and name  HA )(resid   43  and name  HG  )  1.8 0.0 2.06
assign (resid   43  and name  HB* )(resid   43  and name  HD*  )  1.8 0.0 0.79
assign (resid   43  and name  HB* )(resid   44  and name  HN  )  1.8 0.0 2.2
assign (resid   43  and name  HB1 )(resid   43  and name  HD1*  )  1.8 0.0 1.86
assign (resid   43  and name  HB1 )(resid   43  and name  HD2*  )  1.8 0.0 1.86
assign (resid   43  and name  HB2 )(resid   43  and name  HD1*  )  1.8 0.0 1.86
assign (resid   43  and name  HB2 )(resid   43  and name  HD2*  )  1.8 0.0 1.86
assign (resid   43  and name  HD* )(resid   44  and name  HN  )  1.8 0.0 2.77
assign (resid   43  and name  HD1* )(resid   44  and name  HN  )  1.8 0.0 3.86
assign (resid   43  and name  HD2* )(resid   44  and name  HN  )  1.8 0.0 3.86
assign (resid   43  and name  HN )(resid   43  and name  HD1*  )  1.8 0.0 2.86
assign (resid   43  and name  HN )(resid   43  and name  HD2*  )  1.8 0.0 2.86
assign (resid   43  and name  HN )(resid   43  and name  HG  )  1.8 0.0 2.97
assign (resid   43  and name  HN )(resid   44  and name  HN  )  1.8 0.0 1.81
assign (resid   44  and name  HA1 )(resid   45  and name  HD*  )  1.8 0.0 1.74
assign (resid   44  and name  HA2 )(resid   45  and name  HD*  )  1.8 0.0 1.74
assign (resid   45  and name  HB* )(resid   46  and name  HN  )  1.8 0.0 2.19
assign (resid   45  and name  HD* )(resid   46  and name  HN  )  1.8 0.0 2.56
assign (resid   45  and name  HG* )(resid   46  and name  HN  )  1.8 0.0 3.22
assign (resid   45  and name  HG* )(resid   96  and name  HD2*  )  1.8 0.0 3.7
assign (resid   46  and name  HA )(resid   46  and name  HD1*  )  1.8 0.0 2.7
assign (resid   46  and name  HA )(resid   46  and name  HD2*  )  1.8 0.0 2.2
assign (resid   46  and name  HA )(resid   46  and name  HG  )  1.8 0.0 2.19
assign (resid   46  and name  HA )(resid   49  and name  HB*  )  1.8 0.0 2.56
assign (resid   46  and name  HA )(resid   49  and name  HD*  )  1.8 0.0 3.35
assign (resid   46  and name  HA )(resid   49  and name  HG*  )  1.8 0.0 3.2 
assign (resid   46  and name  HB* )(resid   46  and name  HD2*  )  1.8 0.0 1.33
assign (resid   46  and name  HB* )(resid   47  and name  HN  )  1.8 0.0 1.96
assign (resid   46  and name  HB1 )(resid   46  and name  HD1*  )  1.8 0.0 1.64
assign (resid   46  and name  HB2 )(resid   46  and name  HD1*  )  1.8 0.0 1.64
assign (resid   46  and name  HD1* )(resid   96  and name  HA  )  1.8 0.0 2.41
assign (resid   46  and name  HD1* )(resid   96  and name  HD2*  )  1.8 0.0 2.36
assign (resid   46  and name  HD1* )(resid   97  and name  HN  )  1.8 0.0 3.2
assign (resid   46  and name  HD2* )(resid   78  and name  HD1*  )  1.8 0.0 1.82
assign (resid   46  and name  HD2* )(resid   78  and name  HG2*  )  1.8 0.0 1.82
assign (resid   46  and name  HD2* )(resid   96  and name  HA  )  1.8 0.0 2.3
assign (resid   46  and name  HG )(resid   96  and name  HA  )  1.8 0.0 3.2
assign (resid   46  and name  HG )(resid   96  and name  HB*  )  1.8 0.0 3.71
assign (resid   46  and name  HN )(resid   46  and name  HB*  )  1.8 0.0 1.79
assign (resid   46  and name  HN )(resid   46  and name  HD1*  )  1.8 0.0 2.22
assign (resid   46  and name  HN )(resid   46  and name  HD2*  )  1.8 0.0 2.66
assign (resid   46  and name  HN )(resid   46  and name  HG  )  1.8 0.0 2.22
assign (resid   46  and name  HN )(resid   47  and name  HN  )  1.8 0.0 1.56
assign (resid   47  and name  HA )(resid   48  and name  HN  )  1.8 0.0 1.76
assign (resid   47  and name  HN )(resid   47  and name  HB*  )  1.8 0.0 1.29
assign (resid   48  and name  HA )(resid   48  and name  HD2*  )  1.8 0.0 2.7
assign (resid   48  and name  HA )(resid   49  and name  HN  )  1.8 0.0 1.67
assign (resid   48  and name  HB* )(resid   48  and name  HD2*  )  1.8 0.0 1.57
assign (resid   48  and name  HB* )(resid   49  and name  HN  )  1.8 0.0 2.31
assign (resid   48  and name  HN )(resid   49  and name  HN  )  1.8 0.0 2.2 
assign (resid   49  and name  HA )(resid   49  and name  HD*  )  1.8 0.0 2.64
assign (resid   49  and name  HA )(resid   49  and name  HG*  )  1.8 0.0 1.79
assign (resid   49  and name  HA )(resid   50  and name  HN  )  1.8 0.0 1.34
assign (resid   49  and name  HB* )(resid   50  and name  HN  )  1.8 0.0 2.29
assign (resid   49  and name  HB1 )(resid   49  and name  HE*  )  1.8 0.0 3.07
assign (resid   49  and name  HB2 )(resid   49  and name  HE*  )  1.8 0.0 3.07
assign (resid   49  and name  HD* )(resid   73  and name  HE*  )  1.8 0.0 3.2
assign (resid   49  and name  HE* )(resid   73  and name  HE*  )  1.8 0.0 2.8
assign (resid   49  and name  HE* )(resid   97  and name  HG2*  )  1.8 0.0 3.01
assign (resid   49  and name  HG* )(resid   49  and name  HE*  )  1.8 0.0 1.71
assign (resid   49  and name  HN )(resid   49  and name  HB*  )  1.8 0.0 1.61
assign (resid   49  and name  HN )(resid   49  and name  HD*  )  1.8 0.0 2.95
assign (resid   49  and name  HN )(resid   49  and name  HG*  )  1.8 0.0 2.5
assign (resid   50  and name  HA )(resid   50  and name  HD1*  )  1.8 0.0 2.28
assign (resid   50  and name  HA )(resid   50  and name  HG2*  )  1.8 0.0 1.9
assign (resid   50  and name  HA )(resid   51  and name  HN  )  1.8 0.0 1.49
assign (resid   50  and name  HB )(resid   50  and name  HD1*  )  1.8 0.0 1.68
assign (resid   50  and name  HB )(resid   51  and name  HN  )  1.8 0.0 2.74
assign (resid   50  and name  HD1* )(resid   51  and name  HN  )  1.8 0.0 3.7
assign (resid   50  and name  HG2* )(resid   50  and name  HG11  )  1.8 0.0 1.77
assign (resid   50  and name  HG2* )(resid   50  and name  HG12  )  1.8 0.0 1.77
assign (resid   50  and name  HN )(resid   50  and name  HB  )  1.8 0.0 1.62
assign (resid   50  and name  HN )(resid   50  and name  HG11  )  1.8 0.0 2.9
assign (resid   50  and name  HN )(resid   50  and name  HG12  )  1.8 0.0 2.9
assign (resid   51  and name  HA )(resid   51  and name  HD1*  )  1.8 0.0 2.71
assign (resid   51  and name  HA )(resid   51  and name  HD2*  )  1.8 0.0 2.71
assign (resid   51  and name  HA )(resid   51  and name  HG  )  1.8 0.0 2.4
assign (resid   51  and name  HA )(resid   52  and name  HN  )  1.8 0.0 1.39
assign (resid   51  and name  HA )(resid   73  and name  HD*  )  1.8 0.0 2.31
assign (resid   51  and name  HB* )(resid   51  and name  HD1*  )  1.8 0.0 1.94
assign (resid   51  and name  HB* )(resid   51  and name  HD2*  )  1.8 0.0 1.94
assign (resid   51  and name  HB* )(resid   72  and name  HN  )  1.8 0.0 2.84
assign (resid   51  and name  HB1 )(resid   52  and name  HN  )  1.8 0.0 2.93
assign (resid   51  and name  HB1 )(resid   71  and name  HD2*  )  1.8 0.0 2.59
assign (resid   51  and name  HB2 )(resid   52  and name  HN  )  1.8 0.0 2.93
assign (resid   51  and name  HB2 )(resid   71  and name  HD2*  )  1.8 0.0 2.59
assign (resid   51  and name  HD* )(resid   52  and name  HN  )  1.8 0.0 2.28
assign (resid   51  and name  HD* )(resid   73  and name  HA  )  1.8 0.0 3.04
assign (resid   51  and name  HD* )(resid   73  and name  HD*  )  1.8 0.0 1.87
assign (resid   51  and name  HD* )(resid   78  and name  HB  )  1.8 0.0 2.5
assign (resid   51  and name  HD* )(resid   78  and name  HG1*  )  1.8 0.0 3.48
assign (resid   51  and name  HD* )(resid   78  and name  HG2*  )  1.8 0.0 1.25
assign (resid   51  and name  HG )(resid   52  and name  HN  )  1.8 0.0 3.38
assign (resid   51  and name  HN )(resid   51  and name  HB*  )  1.8 0.0 1.87
assign (resid   51  and name  HN )(resid   51  and name  HD*  )  1.8 0.0 1.6
assign (resid   51  and name  HN )(resid   51  and name  HG  )  1.8 0.0 2.37
assign (resid   52  and name  HA )(resid   52  and name  HG1  )  1.8 0.0 2.3
assign (resid   52  and name  HA )(resid   52  and name  HG2  )  1.8 0.0 2.3
assign (resid   52  and name  HA )(resid   53  and name  HN  )  1.8 0.0 1.63
assign (resid   52  and name  HB* )(resid   72  and name  HN  )  1.8 0.0 2.77
assign (resid   52  and name  HG* )(resid   52  and name  HE2*  )  1.8 0.0 1.36
assign (resid   52  and name  HG* )(resid   53  and name  HN  )  1.8 0.0 3.05
assign (resid   52  and name  HN )(resid   52  and name  HG*  )  1.8 0.0 2.26
assign (resid   52  and name  HN )(resid   72  and name  HN  )  1.8 0.0 2.06
assign (resid   53  and name  HA )(resid   53  and name  HG2*  )  1.8 0.0 1.53
assign (resid   53  and name  HA )(resid   54  and name  HN  )  1.8 0.0 1.73
assign (resid   53  and name  HA )(resid   71  and name  HA  )  1.8 0.0 2.14
assign (resid   53  and name  HA )(resid   71  and name  HD2*  )  1.8 0.0 1.63
assign (resid   53  and name  HA )(resid   72  and name  HN  )  1.8 0.0 2.79
assign (resid   53  and name  HB )(resid   54  and name  HN  )  1.8 0.0 2.61
assign (resid   53  and name  HB )(resid   71  and name  HD2*  )  1.8 0.0 2.89
assign (resid   53  and name  HG2* )(resid   54  and name  HN  )  1.8 0.0 2.46
assign (resid   53  and name  HG2* )(resid   71  and name  HD2*  )  1.8 0.0 1.78
assign (resid   53  and name  HG2* )(resid   71  and name  HG  )  1.8 0.0 3.27
assign (resid   53  and name  HN )(resid   53  and name  HG2*  )  1.8 0.0 2.17
assign (resid   54  and name  HA )(resid   55  and name  HN  )  1.8 0.0 1.58
assign (resid   54  and name  HB* )(resid   56  and name  HE*  )  1.8 0.0 2.76
assign (resid   54  and name  HB* )(resid   69  and name  HA  )  1.8 0.0 3.46
assign (resid   54  and name  HB* )(resid   70  and name  HB  )  1.8 0.0 3.2
assign (resid   54  and name  HB* )(resid   70  and name  HD1*  )  1.8 0.0 3.54
assign (resid   54  and name  HB* )(resid   70  and name  HG1*  )  1.8 0.0 3.54
assign (resid   54  and name  HB* )(resid   70  and name  HN  )  1.8 0.0 2.41
assign (resid   54  and name  HN )(resid   54  and name  HD2*  )  1.8 0.0 2.98
assign (resid   54  and name  HN )(resid   55  and name  HN  )  1.8 0.0 2.64
assign (resid   54  and name  HN )(resid   70  and name  HN  )  1.8 0.0 2.47
assign (resid   54  and name  HN )(resid   71  and name  HA  )  1.8 0.0 2.43
assign (resid   54  and name  HN )(resid   71  and name  HD2*  )  1.8 0.0 1.92
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assign (resid   55  and name  HA )(resid   69  and name  HA  )  1.8 0.0 2.04
assign (resid   55  and name  HA )(resid   70  and name  HN  )  1.8 0.0 2.81
assign (resid   55  and name  HG2* )(resid   56  and name  HN  )  1.8 0.0 1.8
assign (resid   55  and name  HG2* )(resid   67  and name  HB*  )  1.8 0.0 1.77
assign (resid   55  and name  HG2* )(resid   67  and name  HD*  )  1.8 0.0 2.04
assign (resid   55  and name  HG2* )(resid   69  and name  HB*  )  1.8 0.0 4.0
assign (resid   55  and name  HG2* )(resid   83  and name  HG1*  )  1.8 0.0 3.9
assign (resid   55  and name  HN )(resid   55  and name  HB  )  1.8 0.0 2.13
assign (resid   56  and name  HA )(resid   56  and name  HD*  )  1.8 0.0 2.42
assign (resid   56  and name  HA )(resid   56  and name  HE*  )  1.8 0.0 2.92
assign (resid   56  and name  HA )(resid   57  and name  HN  )  1.8 0.0 1.66
assign (resid   56  and name  HB* )(resid   57  and name  HN  )  1.8 0.0 2.27
assign (resid   56  and name  HD* )(resid   57  and name  HN  )  1.8 0.0 3.01
assign (resid   56  and name  HD* )(resid   69  and name  HA  )  1.8 0.0 2.46
assign (resid   56  and name  HE* )(resid   69  and name  HA  )  1.8 0.0 2.87
assign (resid   56  and name  HE* )(resid   70  and name  HB  )  1.8 0.0 2.47
assign (resid   56  and name  HE* )(resid   70  and name  HD1*  )  1.8 0.0 2.13
assign (resid   56  and name  HE* )(resid   70  and name  HG11  )  1.8 0.0 3.7
assign (resid   56  and name  HE* )(resid   70  and name  HG12  )  1.8 0.0 3.7
assign (resid   56  and name  HN )(resid   69  and name  HA  )  1.8 0.0 2.66
assign (resid   57  and name  HA )(resid   57  and name  HD*  )  1.8 0.0 2.14
assign (resid   57  and name  HA )(resid   61  and name  HB*  )  1.8 0.0 2.85
assign (resid   57  and name  HA )(resid   61  and name  HD1*  )  1.8 0.0 2.9
assign (resid   57  and name  HB* )(resid   58  and name  HN  )  1.8 0.0 1.96
assign (resid   57  and name  HD* )(resid   58  and name  HN  )  1.8 0.0 2.93
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assign (resid   58  and name  HA )(resid   59  and name  HN  )  1.8 0.0 1.32
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assign (resid   58  and name  HB* )(resid   59  and name  HN  )  1.8 0.0 2.32
assign (resid   58  and name  HN )(resid   61  and name  HB1  )  1.8 0.0 2.26
assign (resid   58  and name  HN )(resid   61  and name  HB2  )  1.8 0.0 2.26
assign (resid   58  and name  HN )(resid   61  and name  HD1*  )  1.8 0.0 3.24
assign (resid   58  and name  HN )(resid   61  and name  HN  )  1.8 0.0 2.4
assign (resid   58  and name  HN )(resid   62  and name  HN  )  1.8 0.0 2.52
assign (resid   59  and name  HA )(resid   62  and name  HB*  )  1.8 0.0 2.13
assign (resid   59  and name  HA )(resid   62  and name  HN  )  1.8 0.0 3
assign (resid   59  and name  HA )(resid   63  and name  HN  )  1.8 0.0 3
assign (resid   59  and name  HB* )(resid   60  and name  HN  )  1.8 0.0 1.73
assign (resid   59  and name  HN )(resid   59  and name  HB*  )  1.8 0.0 1.49
assign (resid   60  and name  HA )(resid   60  and name  HG2*  )  1.8 0.0 1.42
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assign (resid   60  and name  HA )(resid   63  and name  HD*  )  1.8 0.0 2.2
assign (resid   60  and name  HA )(resid   63  and name  HG*  )  1.8 0.0 2.81
assign (resid   60  and name  HA )(resid   63  and name  HN  )  1.8 0.0 3.13
assign (resid   60  and name  HB )(resid   61  and name  HN  )  1.8 0.0 2.61
assign (resid   60  and name  HN )(resid   60  and name  HG2*  )  1.8 0.0 2.01
assign (resid   60  and name  HN )(resid   61  and name  HN  )  1.8 0.0 2.24
assign (resid   60  and name  HN )(resid   62  and name  HN  )  1.8 0.0 3.08
assign (resid   61  and name  HA )(resid   61  and name  HD*  )  1.8 0.0 1.5
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assign (resid   61  and name  HA )(resid   61  and name  HD2*  )  1.8 0.0 2.55
assign (resid   61  and name  HA )(resid   61  and name  HG  )  1.8 0.0 2.23
assign (resid   61  and name  HA )(resid   66  and name  HB  )  1.8 0.0 2.93
assign (resid   61  and name  HB* )(resid   61  and name  HD1*  )  1.8 0.0 2.25
assign (resid   61  and name  HB* )(resid   61  and name  HD2*  )  1.8 0.0 2.25
assign (resid   61  and name  HB* )(resid   68  and name  HD*  )  1.8 0.0 2.9
assign (resid   61  and name  HB1 )(resid   62  and name  HN  )  1.8 0.0 2.76
assign (resid   61  and name  HB2 )(resid   62  and name  HN  )  1.8 0.0 2.76
assign (resid   61  and name  HD* )(resid   62  and name  HN  )  1.8 0.0 3.19
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assign (resid   65  and name  HB1 )(resid   66  and name  HN  )  1.8 0.0 3.7
assign (resid   65  and name  HB2 )(resid   66  and name  HN  )  1.8 0.0 3.7
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assign (resid   69  and name  HE* )(resid   83  and name  HG1*  )  1.8 0.0 3.2 
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assign (resid   70  and name  HG2* )(resid   77  and name  HD2*  )  1.8 0.0 2.95
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assign (resid   71  and name  HB2 )(resid   71  and name  HD1*  )  1.8 0.0 2.04
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assign (resid   80  and name  HG2* )(resid   93  and name  HB*  )  1.8 0.0 4.2
assign (resid   80  and name  HG2* )(resid   108  and name  HD1*  )  1.8 0.0 3.7
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assign (resid   83  and name  HD1* )(resid   89  and name  HG2  )  1.8 0.0 3.07
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assign (resid   89  and name  HA )(resid   89  and name  HG2  )  1.8 0.0 2.36
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assign (resid   91  and name  HD* )(resid   94  and name  HD2*  )  1.8 0.0 3.2 
assign (resid   91  and name  HD* )(resid   102  and name  HD1*  )  1.8 0.0 3.2
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assign (resid   93  and name  HE* )(resid   103  and name  HA  )  1.8 0.0 3.2
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assign (resid   113  and name  HA )(resid   113  and name  HG  )  1.8 0.0 2
assign (resid   113  and name  HA )(resid   114  and name  HN  )  1.8 0.0 1.91
assign (resid   113  and name  HB1 )(resid   114  and name  HN  )  1.8 0.0 2.62
assign (resid   113  and name  HB2 )(resid   114  and name  HN  )  1.8 0.0 2.62
assign (resid   113  and name  HG )(resid   114  and name  HN  )  1.8 0.0 3.4
assign (resid   113  and name  HN )(resid   113  and name  HB1  )  1.8 0.0 2.33
assign (resid   113  and name  HN )(resid   113  and name  HB2  )  1.8 0.0 2.33
assign (resid   113  and name  HN )(resid   113  and name  HG  )  1.8 0.0 2.85
assign (resid   114  and name  HA )(resid   114  and name  HG1  )  1.8 0.0 2.6
assign (resid   114  and name  HA )(resid   114  and name  HG2  )  1.8 0.0 2.6
assign (resid   114  and name  HN )(resid   114  and name  HB*  )  1.8 0.0 1.51
assign (resid   114  and name  HN )(resid   114  and name  HG*  )  1.8 0.0 2.75
! Dihedral angle restraints for SyR6 derived from Talos

! PHI for LEU 3
assign (resid  2   and name C   )  (resid  3  and name N   )
       (resid  3   and name CA  )  (resid  3  and name C   )  1.0 -61.45 30 2

! PSI for LEU 3
assign (resid  3   and name N   )  (resid  3  and name CA  )
       (resid  3   and name C   )  (resid  4  and name N   )  1.0 -40.95 40 2

! PHI for GLU 4
assign (resid  3   and name C   )  (resid  4  and name N   )
       (resid  4   and name CA  )  (resid  4  and name C   )  1.0 -63.78 30 2

! PSI for GLU 4
assign (resid  4   and name N   )  (resid  4  and name CA  )
       (resid  4   and name C   )  (resid  5  and name N   )  1.0 -37.9 40 2

! PHI for LEU 5
assign (resid  4   and name C   )  (resid  5  and name N   )
       (resid  5   and name CA  )  (resid  5  and name C   )  1.0 -65.58 30 2

! PSI for LEU 5
assign (resid  5   and name N   )  (resid  5  and name CA  )
       (resid  5   and name C   )  (resid  6  and name N   )  1.0 -39.39 40 2

! PHI for GLN 6
assign (resid  5   and name C   )  (resid  6  and name N   )
       (resid  6   and name CA  )  (resid  6  and name C   )  1.0 -64.4 30 2

! PSI for GLN 6
assign (resid  6   and name N   )  (resid  6  and name CA  )
       (resid  6   and name C   )  (resid  7  and name N   )  1.0 -45.78 40 2

! PHI for LEU 7
assign (resid  6   and name C   )  (resid  7  and name N   )
       (resid  7   and name CA  )  (resid  7  and name C   )  1.0 -60.91 30 2

! PSI for LEU 7
assign (resid  7   and name N   )  (resid  7  and name CA  )
       (resid  7   and name C   )  (resid  8  and name N   )  1.0 -41.69 40 2

! PHI for LYS 8
assign (resid  7   and name C   )  (resid  8  and name N   )
       (resid  8   and name CA  )  (resid  8  and name C   )  1.0 -67.23 30 2

! PSI for LYS 8
assign (resid  8   and name N   )  (resid  8  and name CA  )
       (resid  8   and name C   )  (resid  9  and name N   )  1.0 -40.67 40 2

! PHI for HIS 9
assign (resid  8   and name C   )  (resid  9  and name N   )
       (resid  9   and name CA  )  (resid  9  and name C   )  1.0 -66.3 30 2

! PSI for HIS 9
assign (resid  9   and name N   )  (resid  9  and name CA  )
       (resid  9   and name C   )  (resid  10  and name N   )  1.0 -41.94 40 2

! PHI for TYR 10
assign (resid  9   and name C   )  (resid  10  and name N   )
       (resid  10   and name CA  )  (resid  10  and name C   )  1.0 -63.63 30 2

! PSI for TYR 10
assign (resid  10   and name N   )  (resid  10  and name CA  )
       (resid  10   and name C   )  (resid  11  and name N   )  1.0 -43.26 40 2

! PHI for ILE 11
assign (resid  10   and name C   )  (resid  11  and name N   )
       (resid  11   and name CA  )  (resid  11  and name C   )  1.0 -69.81 30 2

! PSI for ILE 11
assign (resid  11   and name N   )  (resid  11  and name CA  )
       (resid  11   and name C   )  (resid  12  and name N   )  1.0 -35.82 40 2

! PHI for THR 12
assign (resid  11   and name C   )  (resid  12  and name N   )
       (resid  12   and name CA  )  (resid  12  and name C   )  1.0 -62.42 30 2

! PSI for THR 12
assign (resid  12   and name N   )  (resid  12  and name CA  )
       (resid  12   and name C   )  (resid  13  and name N   )  1.0 -36.77 40 2

! PHI for ASN 13
assign (resid  12   and name C   )  (resid  13  and name N   )
       (resid  13   and name CA  )  (resid  13  and name C   )  1.0 -64.79 30 2

! PSI for ASN 13
assign (resid  13   and name N   )  (resid  13  and name CA  )
       (resid  13   and name C   )  (resid  14  and name N   )  1.0 -40.9699 40.0001 2

! PHI for LEU 14
assign (resid  13   and name C   )  (resid  14  and name N   )
       (resid  14   and name CA  )  (resid  14  and name C   )  1.0 -70.73 30 2

! PSI for LEU 14
assign (resid  14   and name N   )  (resid  14  and name CA  )
       (resid  14   and name C   )  (resid  15  and name N   )  1.0 -37.34 40 2

! PHI for PHE 15
assign (resid  14   and name C   )  (resid  15  and name N   )
       (resid  15   and name CA  )  (resid  15  and name C   )  1.0 -97.31 30 2

! PSI for PHE 15
assign (resid  15   and name N   )  (resid  15  and name CA  )
       (resid  15   and name C   )  (resid  16  and name N   )  1.0 0.98 40 2

! PHI for ARG 19
assign (resid  18   and name C   )  (resid  19  and name N   )
       (resid  19   and name CA  )  (resid  19  and name C   )  1.0 -64.5 30 2

! PSI for ARG 19
assign (resid  19   and name N   )  (resid  19  and name CA  )
       (resid  19   and name C   )  (resid  20  and name N   )  1.0 -23.14 40 2

! PHI for ASP 20
assign (resid  19   and name C   )  (resid  20  and name N   )
       (resid  20   and name CA  )  (resid  20  and name C   )  1.0 -96.1 30 2

! PSI for ASP 20
assign (resid  20   and name N   )  (resid  20  and name CA  )
       (resid  20   and name C   )  (resid  21  and name N   )  1.0 0.48 40 2

! PHI for GLU 21
assign (resid  20   and name C   )  (resid  21  and name N   )
       (resid  21   and name CA  )  (resid  21  and name C   )  1.0 -87.19 30 2

! PSI for GLU 21
assign (resid  21   and name N   )  (resid  21  and name CA  )
       (resid  21   and name C   )  (resid  22  and name N   )  1.0 135.52 40 2

! PHI for LYS 22
assign (resid  21   and name C   )  (resid  22  and name N   )
       (resid  22   and name CA  )  (resid  22  and name C   )  1.0 -102.79 30 2

! PSI for LYS 22
assign (resid  22   and name N   )  (resid  22  and name CA  )
       (resid  22   and name C   )  (resid  23  and name N   )  1.0 125.6 40 2

! PHI for TRP 23
assign (resid  22   and name C   )  (resid  23  and name N   )
       (resid  23   and name CA  )  (resid  23  and name C   )  1.0 -110.97 30 2

! PSI for TRP 23
assign (resid  23   and name N   )  (resid  23  and name CA  )
       (resid  23   and name C   )  (resid  24  and name N   )  1.0 141.25 40 2

! PHI for GLU 24
assign (resid  23   and name C   )  (resid  24  and name N   )
       (resid  24   and name CA  )  (resid  24  and name C   )  1.0 -139.81 30 2

! PSI for GLU 24
assign (resid  24   and name N   )  (resid  24  and name CA  )
       (resid  24   and name C   )  (resid  25  and name N   )  1.0 155.51 40 2

! PHI for CYS 25
assign (resid  24   and name C   )  (resid  25  and name N   )
       (resid  25   and name CA  )  (resid  25  and name C   )  1.0 -106.91 30 2

! PSI for CYS 25
assign (resid  25   and name N   )  (resid  25  and name CA  )
       (resid  25   and name C   )  (resid  26  and name N   )  1.0 122.84 40 2

! PHI for GLU 26
assign (resid  25   and name C   )  (resid  26  and name N   )
       (resid  26   and name CA  )  (resid  26  and name C   )  1.0 -111.92 30 2

! PSI for GLU 26
assign (resid  26   and name N   )  (resid  26  and name CA  )
       (resid  26   and name C   )  (resid  27  and name N   )  1.0 123.67 40 2

! PHI for SER 27
assign (resid  26   and name C   )  (resid  27  and name N   )
       (resid  27   and name CA  )  (resid  27  and name C   )  1.0 -109.69 30 2

! PSI for SER 27
assign (resid  27   and name N   )  (resid  27  and name CA  )
       (resid  27   and name C   )  (resid  28  and name N   )  1.0 126.54 40 2

! PHI for ILE 28
assign (resid  27   and name C   )  (resid  28  and name N   )
       (resid  28   and name CA  )  (resid  28  and name C   )  1.0 -141.59 30 2

! PSI for ILE 28
assign (resid  28   and name N   )  (resid  28  and name CA  )
       (resid  28   and name C   )  (resid  29  and name N   )  1.0 149.76 40 2

! PHI for GLU 29
assign (resid  28   and name C   )  (resid  29  and name N   )
       (resid  29   and name CA  )  (resid  29  and name C   )  1.0 -108.87 30 2

! PSI for GLU 29
assign (resid  29   and name N   )  (resid  29  and name CA  )
       (resid  29   and name C   )  (resid  30  and name N   )  1.0 139.47 40 2

! PHI for GLU 30
assign (resid  29   and name C   )  (resid  30  and name N   )
       (resid  30   and name CA  )  (resid  30  and name C   )  1.0 -147.35 30 2

! PSI for GLU 30
assign (resid  30   and name N   )  (resid  30  and name CA  )
       (resid  30   and name C   )  (resid  31  and name N   )  1.0 149.56 40 2

! PHI for VAL 31
assign (resid  30   and name C   )  (resid  31  and name N   )
       (resid  31   and name CA  )  (resid  31  and name C   )  1.0 -73.14 30 2

! PSI for VAL 31
assign (resid  31   and name N   )  (resid  31  and name CA  )
       (resid  31   and name C   )  (resid  32  and name N   )  1.0 138.89 40 2

! PHI for ALA 32
assign (resid  31   and name C   )  (resid  32  and name N   )
       (resid  32   and name CA  )  (resid  32  and name C   )  1.0 -59.73 30 2

! PSI for ALA 32
assign (resid  32   and name N   )  (resid  32  and name CA  )
       (resid  32   and name C   )  (resid  33  and name N   )  1.0 -28.56 40 2

! PHI for ASP 33
assign (resid  32   and name C   )  (resid  33  and name N   )
       (resid  33   and name CA  )  (resid  33  and name C   )  1.0 -67.96 30 2

! PSI for ASP 33
assign (resid  33   and name N   )  (resid  33  and name CA  )
       (resid  33   and name C   )  (resid  34  and name N   )  1.0 -15.61 40 2

! PSI for PRO 37
assign (resid  37   and name N   )  (resid  37  and name CA  )
       (resid  37   and name C   )  (resid  38  and name N   )  1.0 141.16 40 2

! PHI for ASP 38
assign (resid  37   and name C   )  (resid  38  and name N   )
       (resid  38   and name CA  )  (resid  38  and name C   )  1.0 -55.87 30 2

! PSI for ASP 38
assign (resid  38   and name N   )  (resid  38  and name CA  )
       (resid  38   and name C   )  (resid  39  and name N   )  1.0 -34.13 40 2

! PHI for GLN 39
assign (resid  38   and name C   )  (resid  39  and name N   )
       (resid  39   and name CA  )  (resid  39  and name C   )  1.0 -67.68 30 2

! PSI for GLN 39
assign (resid  39   and name N   )  (resid  39  and name CA  )
       (resid  39   and name C   )  (resid  40  and name N   )  1.0 -26.79 40 2

! PHI for LEU 46
assign (resid  45   and name C   )  (resid  46  and name N   )
       (resid  46   and name CA  )  (resid  46  and name C   )  1.0 -61.86 30 2

! PSI for LEU 46
assign (resid  46   and name N   )  (resid  46  and name CA  )
       (resid  46   and name C   )  (resid  47  and name N   )  1.0 -27.43 40 2

! PHI for ILE 50
assign (resid  49   and name C   )  (resid  50  and name N   )
       (resid  50   and name CA  )  (resid  50  and name C   )  1.0 -99.32 30 2

! PSI for ILE 50
assign (resid  50   and name N   )  (resid  50  and name CA  )
       (resid  50   and name C   )  (resid  51  and name N   )  1.0 114.65 40 2

! PHI for LEU 51
assign (resid  50   and name C   )  (resid  51  and name N   )
       (resid  51   and name CA  )  (resid  51  and name C   )  1.0 -105.86 30 2

! PSI for LEU 51
assign (resid  51   and name N   )  (resid  51  and name CA  )
       (resid  51   and name C   )  (resid  52  and name N   )  1.0 132.14 40 2

! PHI for GLN 52
assign (resid  51   and name C   )  (resid  52  and name N   )
       (resid  52   and name CA  )  (resid  52  and name C   )  1.0 -98.07 30 2

! PSI for GLN 52
assign (resid  52   and name N   )  (resid  52  and name CA  )
       (resid  52   and name C   )  (resid  53  and name N   )  1.0 122.47 40 2

! PHI for THR 53
assign (resid  52   and name C   )  (resid  53  and name N   )
       (resid  53   and name CA  )  (resid  53  and name C   )  1.0 -109.07 30 2

! PSI for THR 53
assign (resid  53   and name N   )  (resid  53  and name CA  )
       (resid  53   and name C   )  (resid  54  and name N   )  1.0 123.65 40 2

! PHI for ASN 54
assign (resid  53   and name C   )  (resid  54  and name N   )
       (resid  54   and name CA  )  (resid  54  and name C   )  1.0 -118.98 30 2

! PSI for ASN 54
assign (resid  54   and name N   )  (resid  54  and name CA  )
       (resid  54   and name C   )  (resid  55  and name N   )  1.0 122.82 40 2

! PHI for THR 55
assign (resid  54   and name C   )  (resid  55  and name N   )
       (resid  55   and name CA  )  (resid  55  and name C   )  1.0 -113.92 30 2

! PSI for THR 55
assign (resid  55   and name N   )  (resid  55  and name CA  )
       (resid  55   and name C   )  (resid  56  and name N   )  1.0 125.79 40 2

! PHI for TYR 57
assign (resid  56   and name C   )  (resid  57  and name N   )
       (resid  57   and name CA  )  (resid  57  and name C   )  1.0 -143.14 30 2

! PSI for TYR 57
assign (resid  57   and name N   )  (resid  57  and name CA  )
       (resid  57   and name C   )  (resid  58  and name N   )  1.0 156.15 40 2

! PHI for SER 58
assign (resid  57   and name C   )  (resid  58  and name N   )
       (resid  58   and name CA  )  (resid  58  and name C   )  1.0 -105.36 30 2

! PSI for SER 58
assign (resid  58   and name N   )  (resid  58  and name CA  )
       (resid  58   and name C   )  (resid  59  and name N   )  1.0 157.62 40 2

! PHI for ASP 59
assign (resid  58   and name C   )  (resid  59  and name N   )
       (resid  59   and name CA  )  (resid  59  and name C   )  1.0 -60.5 30 2

! PSI for ASP 59
assign (resid  59   and name N   )  (resid  59  and name CA  )
       (resid  59   and name C   )  (resid  60  and name N   )  1.0 -35.36 40 2

! PHI for THR 60
assign (resid  59   and name C   )  (resid  60  and name N   )
       (resid  60   and name CA  )  (resid  60  and name C   )  1.0 -68.54 30 2

! PSI for THR 60
assign (resid  60   and name N   )  (resid  60  and name CA  )
       (resid  60   and name C   )  (resid  61  and name N   )  1.0 -38.67 40 2

! PHI for LEU 61
assign (resid  60   and name C   )  (resid  61  and name N   )
       (resid  61   and name CA  )  (resid  61  and name C   )  1.0 -64.99 30 2

! PSI for LEU 61
assign (resid  61   and name N   )  (resid  61  and name CA  )
       (resid  61   and name C   )  (resid  62  and name N   )  1.0 -40.68 40 2

! PHI for HIS 62
assign (resid  61   and name C   )  (resid  62  and name N   )
       (resid  62   and name CA  )  (resid  62  and name C   )  1.0 -64.69 30 2

! PSI for HIS 62
assign (resid  62   and name N   )  (resid  62  and name CA  )
       (resid  62   and name C   )  (resid  63  and name N   )  1.0 -39.49 40 2

! PHI for LYS 63
assign (resid  62   and name C   )  (resid  63  and name N   )
       (resid  63   and name CA  )  (resid  63  and name C   )  1.0 -67.29 30 2

! PSI for LYS 63
assign (resid  63   and name N   )  (resid  63  and name CA  )
       (resid  63   and name C   )  (resid  64  and name N   )  1.0 -28.92 40 2

! PHI for SER 64
assign (resid  63   and name C   )  (resid  64  and name N   )
       (resid  64   and name CA  )  (resid  64  and name C   )  1.0 -92.28 30 2

! PSI for SER 64
assign (resid  64   and name N   )  (resid  64  and name CA  )
       (resid  64   and name C   )  (resid  65  and name N   )  1.0 -3.31 40 2

! PHI for ILE 66
assign (resid  65   and name C   )  (resid  66  and name N   )
       (resid  66   and name CA  )  (resid  66  and name C   )  1.0 -126.33 30 2

! PSI for ILE 66
assign (resid  66   and name N   )  (resid  66  and name CA  )
       (resid  66   and name C   )  (resid  67  and name N   )  1.0 159.63 40 2

! PSI for PRO 68
assign (resid  68   and name N   )  (resid  68  and name CA  )
       (resid  68   and name C   )  (resid  69  and name N   )  1.0 130.36 40 2

! PHI for PHE 69
assign (resid  68   and name C   )  (resid  69  and name N   )
       (resid  69   and name CA  )  (resid  69  and name C   )  1.0 -129.69 30 2

! PSI for PHE 69
assign (resid  69   and name N   )  (resid  69  and name CA  )
       (resid  69   and name C   )  (resid  70  and name N   )  1.0 147.7 40 2

! PHI for ILE 70
assign (resid  69   and name C   )  (resid  70  and name N   )
       (resid  70   and name CA  )  (resid  70  and name C   )  1.0 -135 30 2

! PSI for ILE 70
assign (resid  70   and name N   )  (resid  70  and name CA  )
       (resid  70   and name C   )  (resid  71  and name N   )  1.0 135.44 40 2

! PHI for LEU 71
assign (resid  70   and name C   )  (resid  71  and name N   )
       (resid  71   and name CA  )  (resid  71  and name C   )  1.0 -112.91 30 2

! PSI for LEU 71
assign (resid  71   and name N   )  (resid  71  and name CA  )
       (resid  71   and name C   )  (resid  72  and name N   )  1.0 134.07 40 2

! PHI for TYR 72
assign (resid  71   and name C   )  (resid  72  and name N   )
       (resid  72   and name CA  )  (resid  72  and name C   )  1.0 -128.57 30 2

! PSI for TYR 72
assign (resid  72   and name N   )  (resid  72  and name CA  )
       (resid  72   and name C   )  (resid  73  and name N   )  1.0 148.65 40 2

! PHI for TYR 73
assign (resid  72   and name C   )  (resid  73  and name N   )
       (resid  73   and name CA  )  (resid  73  and name C   )  1.0 -136.22 30 2

! PSI for TYR 73
assign (resid  73   and name N   )  (resid  73  and name CA  )
       (resid  73   and name C   )  (resid  74  and name N   )  1.0 120.84 40 2

! PHI for ALA 79
assign (resid  78   and name C   )  (resid  79  and name N   )
       (resid  79   and name CA  )  (resid  79  and name C   )  1.0 -139.21 30 2

! PSI for ALA 79
assign (resid  79   and name N   )  (resid  79  and name CA  )
       (resid  79   and name C   )  (resid  80  and name N   )  1.0 155.33 40 2

! PHI for ILE 80
assign (resid  79   and name C   )  (resid  80  and name N   )
       (resid  80   and name CA  )  (resid  80  and name C   )  1.0 -135.02 30 2

! PSI for ILE 80
assign (resid  80   and name N   )  (resid  80  and name CA  )
       (resid  80   and name C   )  (resid  81  and name N   )  1.0 135.54 40 2

! PHI for PHE 82
assign (resid  81   and name C   )  (resid  82  and name N   )
       (resid  82   and name CA  )  (resid  82  and name C   )  1.0 -134.27 30 2

! PSI for PHE 82
assign (resid  82   and name N   )  (resid  82  and name CA  )
       (resid  82   and name C   )  (resid  83  and name N   )  1.0 149.32 40 2

! PHI for ILE 83
assign (resid  82   and name C   )  (resid  83  and name N   )
       (resid  83   and name CA  )  (resid  83  and name C   )  1.0 -113.82 30 2

! PSI for ILE 83
assign (resid  83   and name N   )  (resid  83  and name CA  )
       (resid  83   and name C   )  (resid  84  and name N   )  1.0 127.88 40 2

! PHI for ASP 84
assign (resid  83   and name C   )  (resid  84  and name N   )
       (resid  84   and name CA  )  (resid  84  and name C   )  1.0 -90.78 30 2

! PSI for ASP 84
assign (resid  84   and name N   )  (resid  84  and name CA  )
       (resid  84   and name C   )  (resid  85  and name N   )  1.0 158.44 40 2

! PHI for MET 89
assign (resid  88   and name C   )  (resid  89  and name N   )
       (resid  89   and name CA  )  (resid  89  and name C   )  1.0 -90.34 30 2

! PSI for MET 89
assign (resid  89   and name N   )  (resid  89  and name CA  )
       (resid  89   and name C   )  (resid  90  and name N   )  1.0 132.6 40 2

! PHI for TYR 93
assign (resid  92   and name C   )  (resid  93  and name N   )
       (resid  93   and name CA  )  (resid  93  and name C   )  1.0 -130.19 30 2

! PSI for TYR 93
assign (resid  93   and name N   )  (resid  93  and name CA  )
       (resid  93   and name C   )  (resid  94  and name N   )  1.0 147.18 40 2

! PHI for LEU 94
assign (resid  93   and name C   )  (resid  94  and name N   )
       (resid  94   and name CA  )  (resid  94  and name C   )  1.0 -119.6 30 2

! PSI for LEU 94
assign (resid  94   and name N   )  (resid  94  and name CA  )
       (resid  94   and name C   )  (resid  95  and name N   )  1.0 125.55 40 2

! PHI for HIS 95
assign (resid  94   and name C   )  (resid  95  and name N   )
       (resid  95   and name CA  )  (resid  95  and name C   )  1.0 -118.66 30 2

! PSI for HIS 95
assign (resid  95   and name N   )  (resid  95  and name CA  )
       (resid  95   and name C   )  (resid  96  and name N   )  1.0 143.36 40 2

! PHI for ASN 96
assign (resid  95   and name C   )  (resid  96  and name N   )
       (resid  96   and name CA  )  (resid  96  and name C   )  1.0 -84.18 30 2

! PSI for ASN 96
assign (resid  96   and name N   )  (resid  96  and name CA  )
       (resid  96   and name C   )  (resid  97  and name N   )  1.0 139.22 40 2

! PHI for GLN 104
assign (resid  103   and name C   )  (resid  104  and name N   )
       (resid  104   and name CA  )  (resid  104  and name C   )  1.0 -92.87 30 2

! PSI for GLN 104
assign (resid  104   and name N   )  (resid  104  and name CA  )
       (resid  104   and name C   )  (resid  105  and name N   )  1.0 156.5 40 2

! PHI for ARG 105
assign (resid  104   and name C   )  (resid  105  and name N   )
       (resid  105   and name CA  )  (resid  105  and name C   )  1.0 -59.33 30 2

! PSI for ARG 105
assign (resid  105   and name N   )  (resid  105  and name CA  )
       (resid  105   and name C   )  (resid  106  and name N   )  1.0 -33.15 40 2

! PHI for TYR 106
assign (resid  105   and name C   )  (resid  106  and name N   )
       (resid  106   and name CA  )  (resid  106  and name C   )  1.0 -64.74 30 2

! PSI for TYR 106
assign (resid  106   and name N   )  (resid  106  and name CA  )
       (resid  106   and name C   )  (resid  107  and name N   )  1.0 -31.47 40 2

! PHI for LEU 107
assign (resid  106   and name C   )  (resid  107  and name N   )
       (resid  107   and name CA  )  (resid  107  and name C   )  1.0 -61.89 30 2

! PSI for LEU 107
assign (resid  107   and name N   )  (resid  107  and name CA  )
       (resid  107   and name C   )  (resid  108  and name N   )  1.0 -34.17 40 2

! PHI for LEU 108
assign (resid  107   and name C   )  (resid  108  and name N   )
       (resid  108   and name CA  )  (resid  108  and name C   )  1.0 -65.63 30 2

! PSI for LEU 108
assign (resid  108   and name N   )  (resid  108  and name CA  )
       (resid  108   and name C   )  (resid  109  and name N   )  1.0 -29.17 40 2

! PHI for THR 109
assign (resid  108   and name C   )  (resid  109  and name N   )
       (resid  109   and name CA  )  (resid  109  and name C   )  1.0 -102.82 30 2

! PSI for THR 109
assign (resid  109   and name N   )  (resid  109  and name CA  )
       (resid  109   and name C   )  (resid  110  and name N   )  1.0 2.44 40 2

! Hydrogen Bond restraints used in SyR6 refinement
! Identification of hydrogen bonds from Rosetta refined structures
! Restraint range is HN-O 1.7-2.3 Ang, N-O 2.7-3.3 Ang
assign (resid   6  and name HN )(resid  2  and name O ) 1.7  0.0  0.6
assign (resid   6  and name N  )(resid  2  and name O ) 2.7  0.0  0.6
assign (resid   7  and name HN )(resid  3  and name O ) 1.7  0.0  0.6
assign (resid   7  and name N  )(resid  3  and name O ) 2.7  0.0  0.6
assign (resid   8  and name HN )(resid  4  and name O ) 1.7  0.0  0.6
assign (resid   8  and name N  )(resid  4  and name O ) 2.7  0.0  0.6
assign (resid   9  and name HN )(resid  5  and name O ) 1.7  0.0  0.6
assign (resid   9  and name N  )(resid  5  and name O ) 2.7  0.0  0.6
assign (resid   10  and name HN )(resid  6  and name O ) 1.7  0.0  0.6
assign (resid   10  and name N  )(resid  6  and name O ) 2.7  0.0  0.6
assign (resid   11  and name HN )(resid  7  and name O ) 1.7  0.0  0.6
assign (resid   11  and name N  )(resid  7  and name O ) 2.7  0.0  0.6
assign (resid   12  and name HN )(resid  8  and name O ) 1.7  0.0  0.6
assign (resid   12  and name N  )(resid  8  and name O ) 2.7  0.0  0.6
assign (resid   13  and name HN )(resid  9  and name O ) 1.7  0.0  0.6
assign (resid   13  and name N  )(resid  9  and name O ) 2.7  0.0  0.6
assign (resid   14  and name HN )(resid  10  and name O ) 1.7  0.0  0.6
assign (resid   14  and name N  )(resid  10  and name O ) 2.7  0.0  0.6
assign (resid   15  and name HN )(resid  11  and name O ) 1.7  0.0  0.6
assign (resid   15  and name N  )(resid  11  and name O ) 2.7  0.0  0.6
assign (resid   17  and name HN )(resid  12  and name O ) 1.7  0.0  0.6
assign (resid   17  and name N  )(resid  12  and name O ) 2.7  0.0  0.6
assign (resid   24    and name HN     )(resid  57     and name O      ) 1.7  0.0  0.6
assign (resid   24    and name N      )(resid  57     and name O      ) 2.7  0.0  0.6
assign (resid   26  and name HN )(resid  55  and name O ) 1.7  0.0  0.6
assign (resid   26  and name N  )(resid  55  and name O ) 2.7  0.0  0.6
assign (resid   30  and name HN )(resid  51  and name O ) 1.7  0.0  0.6
assign (resid   30  and name N  )(resid  51  and name O ) 2.7  0.0  0.6
assign (resid   32  and name HN )(resid  49  and name O ) 1.7  0.0  0.6
assign (resid   32  and name N  )(resid  49  and name O ) 2.7  0.0  0.6
assign (resid   47  and name HN )(resid  44  and name O ) 1.7  0.0  0.6
assign (resid   47  and name N  )(resid  44  and name O ) 2.7  0.0  0.6
assign (resid   51  and name HN )(resid  30  and name O ) 1.7  0.0  0.6
assign (resid   51  and name N  )(resid  30  and name O ) 2.7  0.0  0.6
assign (resid   52  and name HN )(resid  72  and name O ) 1.7  0.0  0.6
assign (resid   52  and name N  )(resid  72  and name O ) 2.7  0.0  0.6
assign (resid   53  and name HN )(resid  28  and name O ) 1.7  0.0  0.6
assign (resid   53  and name N  )(resid  28  and name O ) 2.7  0.0  0.6
assign (resid   54    and name HN     )(resid  70     and name O      ) 1.7  0.0  0.6
assign (resid   54    and name N      )(resid  70     and name O      ) 2.7  0.0  0.6
assign (resid   55    and name HN     )(resid  26     and name O      ) 1.7  0.0  0.6
assign (resid   55    and name N      )(resid  26     and name O      ) 2.7  0.0  0.6
assign (resid   56  and name HN )(resid  68  and name O ) 1.7  0.0  0.6
assign (resid   56  and name N  )(resid  68  and name O ) 2.7  0.0  0.6
assign (resid   57  and name HN )(resid  24  and name O ) 1.7  0.0  0.6
assign (resid   57  and name N  )(resid  24  and name O ) 2.7  0.0  0.6
assign (resid   62  and name HN )(resid  58  and name O ) 1.7  0.0  0.6
assign (resid   62  and name N  )(resid  58  and name O ) 2.7  0.0  0.6
assign (resid   63  and name HN )(resid  59  and name O ) 1.7  0.0  0.6
assign (resid   63  and name N  )(resid  59  and name O ) 2.7  0.0  0.6
assign (resid   64  and name HN )(resid  60  and name O ) 1.7  0.0  0.6
assign (resid   64  and name N  )(resid  60  and name O ) 2.7  0.0  0.6
assign (resid   67  and name HN )(resid  83  and name O ) 1.7  0.0  0.6
assign (resid   67  and name N  )(resid  83  and name O ) 2.7  0.0  0.6
assign (resid   69  and name HN )(resid  81  and name O ) 1.7  0.0  0.6
assign (resid   69  and name N  )(resid  81  and name O ) 2.7  0.0  0.6
assign (resid   70    and name HN     )(resid  54     and name O      ) 1.7  0.0  0.6
assign (resid   70    and name N      )(resid  54     and name O      ) 2.7  0.0  0.6
assign (resid   71  and name HN )(resid  79  and name O ) 1.7  0.0  0.6
assign (resid   71  and name N  )(resid  79  and name O ) 2.7  0.0  0.6
assign (resid   72  and name HN )(resid  52  and name O ) 1.7  0.0  0.6
assign (resid   72  and name N  )(resid  52  and name O ) 2.7  0.0  0.6
assign (resid   73  and name HN )(resid  76  and name O ) 1.7  0.0  0.6
assign (resid   73  and name N  )(resid  76  and name O ) 2.7  0.0  0.6
assign (resid   78  and name HN )(resid  71  and name O ) 1.7  0.0  0.6
assign (resid   78  and name N  )(resid  71  and name O ) 2.7  0.0  0.6
assign (resid   80  and name HN )(resid  93  and name O ) 1.7  0.0  0.6
assign (resid   80  and name N  )(resid  93  and name O ) 2.7  0.0  0.6
assign (resid   81  and name HN )(resid  69  and name O ) 1.7  0.0  0.6
assign (resid   81  and name N  )(resid  69  and name O ) 2.7  0.0  0.6
assign (resid   82    and name HN     )(resid  90     and name O      ) 1.7  0.0  0.6
assign (resid   82    and name N      )(resid  90     and name O      ) 2.7  0.0  0.6
assign (resid   83  and name HN )(resid  67  and name O ) 1.7  0.0  0.6
assign (resid   83  and name N  )(resid  67  and name O ) 2.7  0.0  0.6
assign (resid   87  and name HN )(resid  84  and name O ) 1.7  0.0  0.6
assign (resid   87  and name N  )(resid  84  and name O ) 2.7  0.0  0.6
assign (resid   90  and name HN )(resid  82  and name O ) 1.7  0.0  0.6
assign (resid   90  and name N  )(resid  82  and name O ) 2.7  0.0  0.6
assign (resid   95  and name HN )(resid  78  and name O ) 1.7  0.0  0.6
assign (resid   95  and name N  )(resid  78  and name O ) 2.7  0.0  0.6
assign (resid   108  and name HN )(resid  104  and name O ) 1.7  0.0  0.6
assign (resid   108  and name N  )(resid  104  and name O ) 2.7  0.0  0.6
assign (resid   109  and name HN )(resid  105  and name O ) 1.7  0.0  0.6
assign (resid   109  and name N  )(resid  105  and name O ) 2.7  0.0  0.6
! CACB shifts for Xplor-NIH structure calculation of SyR6
! created by  AutoStructure/RPF Version 2.2.1 Copyright(C) 2007

! THR 2
 assign (resid   1 and name C ) (resid   2 and name N ) (resid   2 and name CA )
        (resid   2 and name C ) (resid   3 and name N ) 61.1 70.34
! LEU 3
 assign (resid   2 and name C ) (resid   3 and name N ) (resid   3 and name CA )
        (resid   3 and name C ) (resid   4 and name N ) 57.8 41.6
! GLU 4
 assign (resid   3 and name C ) (resid   4 and name N ) (resid   4 and name CA )
        (resid   4 and name C ) (resid   5 and name N ) 60 29.2
! LEU 5
 assign (resid   4 and name C ) (resid   5 and name N ) (resid   5 and name CA )
        (resid   5 and name C ) (resid   6 and name N ) 56.9 41.14
! GLN 6
 assign (resid   5 and name C ) (resid   6 and name N ) (resid   6 and name CA )
        (resid   6 and name C ) (resid   7 and name N ) 59.1 29.2
! LEU 7
 assign (resid   6 and name C ) (resid   7 and name N ) (resid   7 and name CA )
        (resid   7 and name C ) (resid   8 and name N ) 57.8 41.7
! LYS 8
 assign (resid   7 and name C ) (resid   8 and name N ) (resid   8 and name CA )
        (resid   8 and name C ) (resid   9 and name N ) 59.11 32.35
! HIS 9
 assign (resid   8 and name C ) (resid   9 and name N ) (resid   9 and name CA )
        (resid   9 and name C ) (resid  10 and name N ) 59.33 29.83
! TYR 10
 assign (resid   9 and name C ) (resid  10 and name N ) (resid  10 and name CA )
        (resid  10 and name C ) (resid  11 and name N ) 61.75 39.41
! ILE 11
 assign (resid  10 and name C ) (resid  11 and name N ) (resid  11 and name CA )
        (resid  11 and name C ) (resid  12 and name N ) 61.44 36.2
! THR 12
 assign (resid  11 and name C ) (resid  12 and name N ) (resid  12 and name CA )
        (resid  12 and name C ) (resid  13 and name N ) 66.47 68.24
! ASN 13
 assign (resid  12 and name C ) (resid  13 and name N ) (resid  13 and name CA )
        (resid  13 and name C ) (resid  14 and name N ) 55.9 38.6
! LEU 14
 assign (resid  13 and name C ) (resid  14 and name N ) (resid  14 and name CA )
        (resid  14 and name C ) (resid  15 and name N ) 57.6 42.6
! PHE 15
 assign (resid  14 and name C ) (resid  15 and name N ) (resid  15 and name CA )
        (resid  15 and name C ) (resid  16 and name N ) 57.9 38.85
! ASN 16
 assign (resid  15 and name C ) (resid  16 and name N ) (resid  16 and name CA )
        (resid  16 and name C ) (resid  17 and name N ) 54.1 36.5
! LEU 17
 assign (resid  16 and name C ) (resid  17 and name N ) (resid  17 and name CA )
        (resid  17 and name C ) (resid  18 and name N ) 52.3 41.05
! PRO 18
 assign (resid  17 and name C ) (resid  18 and name N ) (resid  18 and name CA )
        (resid  18 and name C ) (resid  19 and name N ) 63.1 31.8
! ARG 19
 assign (resid  18 and name C ) (resid  19 and name N ) (resid  19 and name CA )
        (resid  19 and name C ) (resid  20 and name N ) 58.1 30.25
! ASP 20
 assign (resid  19 and name C ) (resid  20 and name N ) (resid  20 and name CA )
        (resid  20 and name C ) (resid  21 and name N ) 52.94 40.4
! GLU 21
 assign (resid  20 and name C ) (resid  21 and name N ) (resid  21 and name CA )
        (resid  21 and name C ) (resid  22 and name N ) 56.43 31.6
! LYS 22
 assign (resid  21 and name C ) (resid  22 and name N ) (resid  22 and name CA )
        (resid  22 and name C ) (resid  23 and name N ) 57.14 33
! TRP 23
 assign (resid  22 and name C ) (resid  23 and name N ) (resid  23 and name CA )
        (resid  23 and name C ) (resid  24 and name N ) 54.6 31.1
! GLU 24
 assign (resid  23 and name C ) (resid  24 and name N ) (resid  24 and name CA )
        (resid  24 and name C ) (resid  25 and name N ) 54.2 31.6
! CYS 25
 assign (resid  24 and name C ) (resid  25 and name N ) (resid  25 and name CA )
        (resid  25 and name C ) (resid  26 and name N ) 57.2 30.2
! GLU 26
 assign (resid  25 and name C ) (resid  26 and name N ) (resid  26 and name CA )
        (resid  26 and name C ) (resid  27 and name N ) 55.1 31.77
! SER 27
 assign (resid  26 and name C ) (resid  27 and name N ) (resid  27 and name CA )
        (resid  27 and name C ) (resid  28 and name N ) 56.7 64.2
! ILE 28
 assign (resid  27 and name C ) (resid  28 and name N ) (resid  28 and name CA )
        (resid  28 and name C ) (resid  29 and name N ) 59.75 42.75
! GLU 29
 assign (resid  28 and name C ) (resid  29 and name N ) (resid  29 and name CA )
        (resid  29 and name C ) (resid  30 and name N ) 55.55 31.15
! GLU 30
 assign (resid  29 and name C ) (resid  30 and name N ) (resid  30 and name CA )
        (resid  30 and name C ) (resid  31 and name N ) 54.7 34.4
! VAL 31
 assign (resid  30 and name C ) (resid  31 and name N ) (resid  31 and name CA )
        (resid  31 and name C ) (resid  32 and name N ) 62.55 31.93
! ALA 32
 assign (resid  31 and name C ) (resid  32 and name N ) (resid  32 and name CA )
        (resid  32 and name C ) (resid  33 and name N ) 55.92 19.46
! ASP 33
 assign (resid  32 and name C ) (resid  33 and name N ) (resid  33 and name CA )
        (resid  33 and name C ) (resid  34 and name N ) 54.6 39.2
! ASP 34
 assign (resid  33 and name C ) (resid  34 and name N ) (resid  34 and name CA )
        (resid  34 and name C ) (resid  35 and name N ) 55.1 40.94
! ILE 35
 assign (resid  34 and name C ) (resid  35 and name N ) (resid  35 and name CA )
        (resid  35 and name C ) (resid  36 and name N ) 60.7 40.6
! LEU 36
 assign (resid  35 and name C ) (resid  36 and name N ) (resid  36 and name CA )
        (resid  36 and name C ) (resid  37 and name N ) 52.2 42.7
! PRO 37
 assign (resid  36 and name C ) (resid  37 and name N ) (resid  37 and name CA )
        (resid  37 and name C ) (resid  38 and name N ) 63.1 32.7
! ASP 38
 assign (resid  37 and name C ) (resid  38 and name N ) (resid  38 and name CA )
        (resid  38 and name C ) (resid  39 and name N ) 57.83 42.2
! GLN 39
 assign (resid  38 and name C ) (resid  39 and name N ) (resid  39 and name CA )
        (resid  39 and name C ) (resid  40 and name N ) 58 27.25
! TYR 40
 assign (resid  39 and name C ) (resid  40 and name N ) (resid  40 and name CA )
        (resid  40 and name C ) (resid  41 and name N ) 57.06 39.4
! VAL 41
 assign (resid  40 and name C ) (resid  41 and name N ) (resid  41 and name CA )
        (resid  41 and name C ) (resid  42 and name N ) 62.85 34.3
! ARG 42
 assign (resid  41 and name C ) (resid  42 and name N ) (resid  42 and name CA )
        (resid  42 and name C ) (resid  43 and name N ) 58.42 29.64
! LEU 43
 assign (resid  42 and name C ) (resid  43 and name N ) (resid  43 and name CA )
        (resid  43 and name C ) (resid  44 and name N ) 55.81 40.17
! GLY 44
 assign (resid  43 and name C ) (resid  44 and name N ) (resid  44 and name CA )
        (resid  44 and name C ) (resid  45 and name N ) 44.8  $noexpectation
! PRO 45
 assign (resid  44 and name C ) (resid  45 and name N ) (resid  45 and name CA )
        (resid  45 and name C ) (resid  46 and name N ) 64.4 31.9
! LEU 46
 assign (resid  45 and name C ) (resid  46 and name N ) (resid  46 and name CA )
        (resid  46 and name C ) (resid  47 and name N ) 55.9 43.5
! SER 47
 assign (resid  46 and name C ) (resid  47 and name N ) (resid  47 and name CA )
        (resid  47 and name C ) (resid  48 and name N ) 59.1 62.7
! ASN 48
 assign (resid  47 and name C ) (resid  48 and name N ) (resid  48 and name CA )
        (resid  48 and name C ) (resid  49 and name N ) 55.2 38.3
! LYS 49
 assign (resid  48 and name C ) (resid  49 and name N ) (resid  49 and name CA )
        (resid  49 and name C ) (resid  50 and name N ) 56.1 33.2
! ILE 50
 assign (resid  49 and name C ) (resid  50 and name N ) (resid  50 and name CA )
        (resid  50 and name C ) (resid  51 and name N ) 61.15 36.9
! LEU 51
 assign (resid  50 and name C ) (resid  51 and name N ) (resid  51 and name CA )
        (resid  51 and name C ) (resid  52 and name N ) 52.5 42.74
! GLN 52
 assign (resid  51 and name C ) (resid  52 and name N ) (resid  52 and name CA )
        (resid  52 and name C ) (resid  53 and name N ) 56.8 29.14
! THR 53
 assign (resid  52 and name C ) (resid  53 and name N ) (resid  53 and name CA )
        (resid  53 and name C ) (resid  54 and name N ) 60.57 69.72
! ASN 54
 assign (resid  53 and name C ) (resid  54 and name N ) (resid  54 and name CA )
        (resid  54 and name C ) (resid  55 and name N ) 52.31 40.9
! THR 55
 assign (resid  54 and name C ) (resid  55 and name N ) (resid  55 and name CA )
        (resid  55 and name C ) (resid  56 and name N ) 61.4 69.7
! TYR 56
 assign (resid  55 and name C ) (resid  56 and name N ) (resid  56 and name CA )
        (resid  56 and name C ) (resid  57 and name N ) 57.5 41.4
! TYR 57
 assign (resid  56 and name C ) (resid  57 and name N ) (resid  57 and name CA )
        (resid  57 and name C ) (resid  58 and name N ) 56.65 41.7
! SER 58
 assign (resid  57 and name C ) (resid  58 and name N ) (resid  58 and name CA )
        (resid  58 and name C ) (resid  59 and name N ) 56.6 65.66
! ASP 59
 assign (resid  58 and name C ) (resid  59 and name N ) (resid  59 and name CA )
        (resid  59 and name C ) (resid  60 and name N ) 58.55 40.4
! THR 60
 assign (resid  59 and name C ) (resid  60 and name N ) (resid  60 and name CA )
        (resid  60 and name C ) (resid  61 and name N ) 67.12 67.15
! LEU 61
 assign (resid  60 and name C ) (resid  61 and name N ) (resid  61 and name CA )
        (resid  61 and name C ) (resid  62 and name N ) 58.6 39.5
! HIS 62
 assign (resid  61 and name C ) (resid  62 and name N ) (resid  62 and name CA )
        (resid  62 and name C ) (resid  63 and name N ) 58.6 29.32
! LYS 63
 assign (resid  62 and name C ) (resid  63 and name N ) (resid  63 and name CA )
        (resid  63 and name C ) (resid  64 and name N ) 59.2 32.4
! SER 64
 assign (resid  63 and name C ) (resid  64 and name N ) (resid  64 and name CA )
        (resid  64 and name C ) (resid  65 and name N ) 59.3 63.52
! ASN 65
 assign (resid  64 and name C ) (resid  65 and name N ) (resid  65 and name CA )
        (resid  65 and name C ) (resid  66 and name N ) 54.3 37.5
! ILE 66
 assign (resid  65 and name C ) (resid  66 and name N ) (resid  66 and name CA )
        (resid  66 and name C ) (resid  67 and name N ) 58.14 40.2
! TYR 67
 assign (resid  66 and name C ) (resid  67 and name N ) (resid  67 and name CA )
        (resid  67 and name C ) (resid  68 and name N ) 54.1 39.4
! PRO 68
 assign (resid  67 and name C ) (resid  68 and name N ) (resid  68 and name CA )
        (resid  68 and name C ) (resid  69 and name N ) 61.5 32.2
! PHE 69
 assign (resid  68 and name C ) (resid  69 and name N ) (resid  69 and name CA )
        (resid  69 and name C ) (resid  70 and name N ) 56.3 42.9
! ILE 70
 assign (resid  69 and name C ) (resid  70 and name N ) (resid  70 and name CA )
        (resid  70 and name C ) (resid  71 and name N ) 61.9 42.95
! LEU 71
 assign (resid  70 and name C ) (resid  71 and name N ) (resid  71 and name CA )
        (resid  71 and name C ) (resid  72 and name N ) 52.4 43.7
! TYR 72
 assign (resid  71 and name C ) (resid  72 and name N ) (resid  72 and name CA )
        (resid  72 and name C ) (resid  73 and name N ) 57.35 44.29
! TYR 73
 assign (resid  72 and name C ) (resid  73 and name N ) (resid  73 and name CA )
        (resid  73 and name C ) (resid  74 and name N ) 56.5 40.4
! GLN 74
 assign (resid  73 and name C ) (resid  74 and name N ) (resid  74 and name CA )
        (resid  74 and name C ) (resid  75 and name N ) 57.2 25.43
! LYS 75
 assign (resid  74 and name C ) (resid  75 and name N ) (resid  75 and name CA )
        (resid  75 and name C ) (resid  76 and name N ) 57.3 30.81
! GLN 76
 assign (resid  75 and name C ) (resid  76 and name N ) (resid  76 and name CA )
        (resid  76 and name C ) (resid  77 and name N ) 54.7 29.9
! LEU 77
 assign (resid  76 and name C ) (resid  77 and name N ) (resid  77 and name CA )
        (resid  77 and name C ) (resid  78 and name N ) 56.6 41.89
! ILE 78
 assign (resid  77 and name C ) (resid  78 and name N ) (resid  78 and name CA )
        (resid  78 and name C ) (resid  79 and name N ) 58.25 38.15
! ALA 79
 assign (resid  78 and name C ) (resid  79 and name N ) (resid  79 and name CA )
        (resid  79 and name C ) (resid  80 and name N ) 51.68 24.05
! ILE 80
 assign (resid  79 and name C ) (resid  80 and name N ) (resid  80 and name CA )
        (resid  80 and name C ) (resid  81 and name N ) 60.3 42.89
! GLY 81
 assign (resid  80 and name C ) (resid  81 and name N ) (resid  81 and name CA )
        (resid  81 and name C ) (resid  82 and name N ) 46.65  $noexpectation
! PHE 82
 assign (resid  81 and name C ) (resid  82 and name N ) (resid  82 and name CA )
        (resid  82 and name C ) (resid  83 and name N ) 56.3 40.16
! ILE 83
 assign (resid  82 and name C ) (resid  83 and name N ) (resid  83 and name CA )
        (resid  83 and name C ) (resid  84 and name N ) 60.46 39.56
! ASP 84
 assign (resid  83 and name C ) (resid  84 and name N ) (resid  84 and name CA )
        (resid  84 and name C ) (resid  85 and name N ) 52.2 42.33
! GLU 85
 assign (resid  84 and name C ) (resid  85 and name N ) (resid  85 and name CA )
        (resid  85 and name C ) (resid  86 and name N ) 58.31 28.7
! ASN 86
 assign (resid  85 and name C ) (resid  86 and name N ) (resid  86 and name CA )
        (resid  86 and name C ) (resid  87 and name N ) 52.8 39.09
! HIS 87
 assign (resid  86 and name C ) (resid  87 and name N ) (resid  87 and name CA )
        (resid  87 and name C ) (resid  88 and name N ) 56.99 26.7
! ASP 88
 assign (resid  87 and name C ) (resid  88 and name N ) (resid  88 and name CA )
        (resid  88 and name C ) (resid  89 and name N ) 53.9 41.42
! MET 89
 assign (resid  88 and name C ) (resid  89 and name N ) (resid  89 and name CA )
        (resid  89 and name C ) (resid  90 and name N ) 55.8 34.7
! ASP 90
 assign (resid  89 and name C ) (resid  90 and name N ) (resid  90 and name CA )
        (resid  90 and name C ) (resid  91 and name N ) 52.3 41.73
! PHE 91
 assign (resid  90 and name C ) (resid  91 and name N ) (resid  91 and name CA )
        (resid  91 and name C ) (resid  92 and name N ) 58.2 41.4
! LEU 92
 assign (resid  91 and name C ) (resid  92 and name N ) (resid  92 and name CA )
        (resid  92 and name C ) (resid  93 and name N ) 55.2 43.5
! TYR 93
 assign (resid  92 and name C ) (resid  93 and name N ) (resid  93 and name CA )
        (resid  93 and name C ) (resid  94 and name N ) 57.55 42.5
! LEU 94
 assign (resid  93 and name C ) (resid  94 and name N ) (resid  94 and name CA )
        (resid  94 and name C ) (resid  95 and name N ) 54.83 44.63
! HIS 95
 assign (resid  94 and name C ) (resid  95 and name N ) (resid  95 and name CA )
        (resid  95 and name C ) (resid  96 and name N ) 55.5 35.9
! ASN 96
 assign (resid  95 and name C ) (resid  96 and name N ) (resid  96 and name CA )
        (resid  96 and name C ) (resid  97 and name N ) 50.93 38.5
! THR 97
 assign (resid  96 and name C ) (resid  97 and name N ) (resid  97 and name CA )
        (resid  97 and name C ) (resid  98 and name N ) 67 68.3
! VAL 98
 assign (resid  97 and name C ) (resid  98 and name N ) (resid  98 and name CA )
        (resid  98 and name C ) (resid  99 and name N ) 64.4 33.1
! MET 99
 assign (resid  98 and name C ) (resid  99 and name N ) (resid  99 and name CA )
        (resid  99 and name C ) (resid 100 and name N ) 52.4 34.04
! PRO 100
 assign (resid  99 and name C ) (resid 100 and name N ) (resid 100 and name CA )
        (resid 100 and name C ) (resid 101 and name N ) 62.15 30.87
! LEU 101
 assign (resid 100 and name C ) (resid 101 and name N ) (resid 101 and name CA )
        (resid 101 and name C ) (resid 102 and name N ) 55 42.8
! LEU 102
 assign (resid 101 and name C ) (resid 102 and name N ) (resid 102 and name CA )
        (resid 102 and name C ) (resid 103 and name N ) 54.9 45.3
! ASP 103
 assign (resid 102 and name C ) (resid 103 and name N ) (resid 103 and name CA )
        (resid 103 and name C ) (resid 104 and name N ) 54.9 41.08
! GLN 104
 assign (resid 103 and name C ) (resid 104 and name N ) (resid 104 and name CA )
        (resid 104 and name C ) (resid 105 and name N ) 54.1 28.68
! ARG 105
 assign (resid 104 and name C ) (resid 105 and name N ) (resid 105 and name CA )
        (resid 105 and name C ) (resid 106 and name N ) 60.2 29.4
! TYR 106
 assign (resid 105 and name C ) (resid 106 and name N ) (resid 106 and name CA )
        (resid 106 and name C ) (resid 107 and name N ) 58.6 36
! LEU 107
 assign (resid 106 and name C ) (resid 107 and name N ) (resid 107 and name CA )
        (resid 107 and name C ) (resid 108 and name N ) 56.6 41.85
! LEU 108
 assign (resid 107 and name C ) (resid 108 and name N ) (resid 108 and name CA )
        (resid 108 and name C ) (resid 109 and name N ) 55.4 41.56
! THR 109
 assign (resid 108 and name C ) (resid 109 and name N ) (resid 109 and name CA )
        (resid 109 and name C ) (resid 110 and name N ) 61.65 69.43
! GLY 110
 assign (resid 109 and name C ) (resid 110 and name N ) (resid 110 and name CA )
        (resid 110 and name C ) (resid 111 and name N ) 45.4  $noexpectation
! GLY 111
 assign (resid 110 and name C ) (resid 111 and name N ) (resid 111 and name CA )
        (resid 111 and name C ) (resid 112 and name N ) 45.4  $noexpectation
! GLN 112
 assign (resid 111 and name C ) (resid 112 and name N ) (resid 112 and name CA )
        (resid 112 and name C ) (resid 113 and name N ) 55.6 29.2
! LEU 113
 assign (resid 112 and name C ) (resid 113 and name N ) (resid 113 and name CA )
        (resid 113 and name C ) (resid 114 and name N ) 55.17 42.1
! GLU 114
 assign (resid 113 and name C ) (resid 114 and name N ) (resid 114 and name CA )
        (resid 114 and name C ) (resid 115 and name N ) 56.41 30.2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1 -15.608  -7.887  22.092
    2    H2   MET   1           HT2      MET   1 -14.122  -8.417  22.721
    3    H3   MET   1           HT3      MET   1 -14.444  -8.559  21.059
    4    HA   MET   1           HA       MET   1 -14.790  -5.947  21.349
    5    HB2  MET   1           HB2      MET   1 -12.758  -6.865  23.409
    6    HB3  MET   1           HB1      MET   1 -12.812  -5.217  22.781
    7    HG2  MET   1           HG2      MET   1 -15.127  -4.968  23.574
    8    HG3  MET   1           HG1      MET   1 -15.121  -6.634  24.151
    9    HE1  MET   1           HE1      MET   1 -12.948  -2.976  25.739
   10    HE2  MET   1           HE2      MET   1 -13.616  -3.280  24.138
   11    HE3  MET   1           HE3      MET   1 -12.028  -3.916  24.558
   12    H    THR   2           HN       THR   2 -13.601  -8.527  20.058
   13    HA   THR   2           HA       THR   2 -10.937  -7.898  19.179
   14    HB   THR   2           HB       THR   2 -12.962  -9.645  17.743
   15    HG1  THR   2           HG1      THR   2 -12.846 -10.433  19.781
   16   HG21  THR   2          HG21      THR   2 -10.923 -10.820  16.980
   17   HG22  THR   2          HG22      THR   2  -9.931  -9.647  17.847
   18   HG23  THR   2          HG23      THR   2 -10.915  -9.129  16.479
   19    H    LEU   3           HN       LEU   3 -10.210  -6.732  17.510
   20    HA   LEU   3           HA       LEU   3 -11.830  -4.753  16.239
   21    HB2  LEU   3           HB2      LEU   3  -9.066  -5.823  15.581
   22    HB3  LEU   3           HB1      LEU   3  -9.782  -4.434  14.772
   23    HG   LEU   3           HG       LEU   3  -9.440  -4.614  17.783
   24   HD11  LEU   3          HD11      LEU   3  -7.696  -3.063  15.853
   25   HD12  LEU   3          HD12      LEU   3  -7.253  -4.652  16.476
   26   HD13  LEU   3          HD13      LEU   3  -7.447  -3.293  17.583
   27   HD21  LEU   3          HD21      LEU   3 -11.042  -2.952  17.401
   28   HD22  LEU   3          HD22      LEU   3 -10.353  -2.488  15.846
   29   HD23  LEU   3          HD23      LEU   3  -9.560  -2.007  17.342
   30    H    GLU   4           HN       GLU   4 -10.593  -7.877  15.114
   31    HA   GLU   4           HA       GLU   4 -11.494  -7.662  12.404
   32    HB2  GLU   4           HB2      GLU   4  -9.842  -9.349  13.192
   33    HB3  GLU   4           HB1      GLU   4 -11.122 -10.165  14.089
   34    HG2  GLU   4           HG2      GLU   4 -12.351 -10.589  12.016
   35    HG3  GLU   4           HG1      GLU   4 -11.145  -9.693  11.094
   36    H    LEU   5           HN       LEU   5 -13.043  -8.879  15.351
   37    HA   LEU   5           HA       LEU   5 -15.363  -9.983  14.103
   38    HB2  LEU   5           HB2      LEU   5 -14.804 -10.495  16.417
   39    HB3  LEU   5           HB1      LEU   5 -14.991  -8.804  16.876
   40    HG   LEU   5           HG       LEU   5 -17.368  -9.910  15.468
   41   HD11  LEU   5          HD11      LEU   5 -18.153 -11.223  17.398
   42   HD12  LEU   5          HD12      LEU   5 -16.596 -10.988  18.193
   43   HD13  LEU   5          HD13      LEU   5 -16.691 -11.922  16.700
   44   HD21  LEU   5          HD21      LEU   5 -17.282  -7.698  16.621
   45   HD22  LEU   5          HD22      LEU   5 -17.014  -8.527  18.151
   46   HD23  LEU   5          HD23      LEU   5 -18.535  -8.745  17.286
   47    H    GLN   6           HN       GLN   6 -14.670  -6.745  15.384
   48    HA   GLN   6           HA       GLN   6 -17.283  -5.656  14.935
   49    HB2  GLN   6           HB2      GLN   6 -14.547  -4.332  15.061
   50    HB3  GLN   6           HB1      GLN   6 -16.064  -3.435  14.977
   51    HG2  GLN   6           HG2      GLN   6 -16.830  -4.483  17.058
   52    HG3  GLN   6           HG1      GLN   6 -15.357  -5.447  17.137
   53   HE21  GLN   6          HE21      GLN   6 -16.746  -2.650  18.343
   54   HE22  GLN   6          HE22      GLN   6 -15.336  -1.801  18.757
   55    H    LEU   7           HN       LEU   7 -14.394  -5.953  12.933
   56    HA   LEU   7           HA       LEU   7 -15.252  -4.331  10.761
   57    HB2  LEU   7           HB2      LEU   7 -12.919  -5.113  11.014
   58    HB3  LEU   7           HB1      LEU   7 -13.439  -6.775  10.734
   59    HG   LEU   7           HG       LEU   7 -14.258  -6.121   8.476
   60   HD11  LEU   7          HD11      LEU   7 -13.272  -3.784   7.728
   61   HD12  LEU   7          HD12      LEU   7 -13.368  -3.414   9.449
   62   HD13  LEU   7          HD13      LEU   7 -14.823  -3.860   8.556
   63   HD21  LEU   7          HD21      LEU   7 -12.060  -7.008   8.486
   64   HD22  LEU   7          HD22      LEU   7 -11.385  -5.544   9.201
   65   HD23  LEU   7          HD23      LEU   7 -11.949  -5.531   7.529
   66    H    LYS   8           HN       LYS   8 -15.624  -7.809  11.390
   67    HA   LYS   8           HA       LYS   8 -16.950  -8.439   8.928
   68    HB2  LYS   8           HB2      LYS   8 -15.949 -10.138  10.477
   69    HB3  LYS   8           HB1      LYS   8 -17.255  -9.819  11.619
   70    HG2  LYS   8           HG2      LYS   8 -18.916 -10.499   9.943
   71    HG3  LYS   8           HG1      LYS   8 -17.633 -10.778   8.767
   72    HD2  LYS   8           HD2      LYS   8 -16.661 -12.511  10.234
   73    HD3  LYS   8           HD1      LYS   8 -17.951 -12.239  11.407
   74    HE2  LYS   8           HE2      LYS   8 -18.714 -14.098  10.167
   75    HE3  LYS   8           HE1      LYS   8 -19.568 -12.738   9.441
   76    HZ1  LYS   8           HZ1      LYS   8 -17.263 -12.800   8.043
   77    HZ2  LYS   8           HZ2      LYS   8 -18.724 -13.508   7.540
   78    HZ3  LYS   8           HZ3      LYS   8 -17.542 -14.451   8.317
   79    H    HIS   9           HN       HIS   9 -18.156  -7.622  12.164
   80    HA   HIS   9           HA       HIS   9 -20.939  -7.823  11.514
   81    HB2  HIS   9           HB2      HIS   9 -19.455  -6.331  13.694
   82    HB3  HIS   9           HB1      HIS   9 -21.215  -6.385  13.595
   83    HD1  HIS   9           HD1      HIS   9 -20.519  -7.679  16.046
   84    HD2  HIS   9           HD2      HIS   9 -20.069  -9.774  12.470
   85    HE1  HIS   9           HE1      HIS   9 -20.437 -10.135  16.658
   86    H    TYR  10           HN       TYR  10 -18.626  -5.143  11.462
   87    HA   TYR  10           HA       TYR  10 -20.475  -3.047  10.906
   88    HB2  TYR  10           HB2      TYR  10 -18.174  -2.567  11.580
   89    HB3  TYR  10           HB1      TYR  10 -17.553  -3.340  10.121
   90    HD1  TYR  10           HD1      TYR  10 -19.425  -0.432  11.441
   91    HD2  TYR  10           HD2      TYR  10 -17.647  -2.236   7.972
   92    HE1  TYR  10           HE1      TYR  10 -19.668   1.704  10.205
   93    HE2  TYR  10           HE2      TYR  10 -17.894  -0.102   6.735
   94    HH   TYR  10           HH       TYR  10 -19.857   2.259   7.511
   95    H    ILE  11           HN       ILE  11 -18.527  -5.076   8.723
   96    HA   ILE  11           HA       ILE  11 -19.452  -3.914   6.279
   97    HB   ILE  11           HB       ILE  11 -18.359  -6.682   6.894
   98   HG12  ILE  11          HG12      ILE  11 -17.036  -4.321   5.526
   99   HG13  ILE  11          HG11      ILE  11 -16.881  -4.642   7.252
  100   HG21  ILE  11          HG21      ILE  11 -19.102  -5.339   4.291
  101   HG22  ILE  11          HG22      ILE  11 -19.542  -6.949   4.859
  102   HG23  ILE  11          HG23      ILE  11 -17.888  -6.618   4.349
  103   HD11  ILE  11          HD11      ILE  11 -14.992  -5.584   5.886
  104   HD12  ILE  11          HD12      ILE  11 -16.159  -6.640   5.090
  105   HD13  ILE  11          HD13      ILE  11 -15.862  -6.802   6.820
  106    H    THR  12           HN       THR  12 -20.558  -6.747   8.127
  107    HA   THR  12           HA       THR  12 -22.591  -7.570   6.277
  108    HB   THR  12           HB       THR  12 -23.529  -8.794   8.277
  109    HG1  THR  12           HG1      THR  12 -23.046  -7.609   9.997
  110   HG21  THR  12          HG21      THR  12 -20.589  -8.972   7.608
  111   HG22  THR  12          HG22      THR  12 -21.907  -9.980   7.009
  112   HG23  THR  12          HG23      THR  12 -21.377 -10.126   8.685
  113    H    ASN  13           HN       ASN  13 -22.636  -5.452   9.124
  114    HA   ASN  13           HA       ASN  13 -25.462  -4.953   9.112
  115    HB2  ASN  13           HB2      ASN  13 -23.089  -3.435  10.234
  116    HB3  ASN  13           HB1      ASN  13 -24.739  -2.838  10.400
  117   HD21  ASN  13          HD21      ASN  13 -23.130  -3.650  12.673
  118   HD22  ASN  13          HD22      ASN  13 -23.868  -5.012  13.367
  119    H    LEU  14           HN       LEU  14 -22.699  -3.428   7.516
  120    HA   LEU  14           HA       LEU  14 -24.021  -1.121   6.558
  121    HB2  LEU  14           HB2      LEU  14 -21.449  -1.947   6.441
  122    HB3  LEU  14           HB1      LEU  14 -21.930  -2.430   4.819
  123    HG   LEU  14           HG       LEU  14 -21.071  -0.166   4.693
  124   HD11  LEU  14          HD11      LEU  14 -23.261  -0.838   3.470
  125   HD12  LEU  14          HD12      LEU  14 -22.877   0.875   3.578
  126   HD13  LEU  14          HD13      LEU  14 -24.072   0.178   4.662
  127   HD21  LEU  14          HD21      LEU  14 -21.478   1.469   6.251
  128   HD22  LEU  14          HD22      LEU  14 -21.929   0.126   7.293
  129   HD23  LEU  14          HD23      LEU  14 -23.173   1.034   6.438
  130    H    PHE  15           HN       PHE  15 -23.568  -4.299   5.008
  131    HA   PHE  15           HA       PHE  15 -25.527  -3.492   2.893
  132    HB2  PHE  15           HB2      PHE  15 -23.497  -5.733   3.067
  133    HB3  PHE  15           HB1      PHE  15 -24.733  -5.654   1.809
  134    HD1  PHE  15           HD1      PHE  15 -24.762  -3.801   0.177
  135    HD2  PHE  15           HD2      PHE  15 -21.631  -4.185   3.092
  136    HE1  PHE  15           HE1      PHE  15 -23.375  -2.193  -1.103
  137    HE2  PHE  15           HE2      PHE  15 -20.243  -2.578   1.811
  138    HZ   PHE  15           HZ       PHE  15 -21.114  -1.582  -0.286
  139    H    ASN  16           HN       ASN  16 -25.601  -4.843   5.857
  140    HA   ASN  16           HA       ASN  16 -27.113  -6.199   7.001
  141    HB2  ASN  16           HB2      ASN  16 -28.664  -4.608   5.772
  142    HB3  ASN  16           HB1      ASN  16 -28.880  -5.878   4.567
  143   HD21  ASN  16          HD21      ASN  16 -29.116  -5.366   8.133
  144   HD22  ASN  16          HD22      ASN  16 -30.397  -6.459   8.353
  145    H    LEU  17           HN       LEU  17 -25.121  -7.521   5.540
  146    HA   LEU  17           HA       LEU  17 -26.402  -9.761   4.163
  147    HB2  LEU  17           HB2      LEU  17 -23.485  -9.250   4.784
  148    HB3  LEU  17           HB1      LEU  17 -24.089 -10.555   3.769
  149    HG   LEU  17           HG       LEU  17 -24.795  -7.677   3.173
  150   HD11  LEU  17          HD11      LEU  17 -22.321  -7.849   3.286
  151   HD12  LEU  17          HD12      LEU  17 -22.885  -7.578   1.638
  152   HD13  LEU  17          HD13      LEU  17 -22.375  -9.189   2.141
  153   HD21  LEU  17          HD21      LEU  17 -26.101  -9.293   1.950
  154   HD22  LEU  17          HD22      LEU  17 -24.672 -10.251   1.567
  155   HD23  LEU  17          HD23      LEU  17 -24.894  -8.667   0.833
  156    HA   PRO  18           HA       PRO  18 -26.874 -12.557   7.565
  157    HB2  PRO  18           HB2      PRO  18 -25.176 -14.420   5.927
  158    HB3  PRO  18           HB1      PRO  18 -26.725 -14.732   6.739
  159    HG2  PRO  18           HG2      PRO  18 -26.567 -14.316   4.092
  160    HG3  PRO  18           HG1      PRO  18 -27.952 -13.768   5.053
  161    HD2  PRO  18           HD2      PRO  18 -25.802 -12.155   3.800
  162    HD3  PRO  18           HD1      PRO  18 -27.440 -11.680   4.303
  163    H    ARG  19           HN       ARG  19 -25.790 -12.564   9.422
  164    HA   ARG  19           HA       ARG  19 -22.861 -12.145   9.444
  165    HB2  ARG  19           HB2      ARG  19 -24.952 -12.134  11.649
  166    HB3  ARG  19           HB1      ARG  19 -23.233 -11.835  11.908
  167    HG2  ARG  19           HG2      ARG  19 -23.324  -9.930  10.340
  168    HG3  ARG  19           HG1      ARG  19 -25.044 -10.220  10.088
  169    HD2  ARG  19           HD2      ARG  19 -23.832  -9.646  12.808
  170    HD3  ARG  19           HD1      ARG  19 -24.527  -8.399  11.771
  171    HE   ARG  19           HE       ARG  19 -26.455 -10.467  12.056
  172   HH11  ARG  19          HH21      ARG  19 -24.827  -8.024  13.918
  173   HH12  ARG  19          HH22      ARG  19 -26.123  -7.868  15.057
  174   HH21  ARG  19          HH11      ARG  19 -28.128 -10.243  13.533
  175   HH22  ARG  19          HH12      ARG  19 -27.982  -9.115  14.840
  176    H    ASP  20           HN       ASP  20 -25.103 -14.683   9.649
  177    HA   ASP  20           HA       ASP  20 -23.446 -16.414  11.367
  178    HB2  ASP  20           HB2      ASP  20 -25.219 -18.113  10.862
  179    HB3  ASP  20           HB1      ASP  20 -25.859 -16.628  11.560
  180    H    GLU  21           HN       GLU  21 -23.163 -15.373   8.294
  181    HA   GLU  21           HA       GLU  21 -22.312 -17.985   7.135
  182    HB2  GLU  21           HB2      GLU  21 -22.707 -15.234   5.919
  183    HB3  GLU  21           HB1      GLU  21 -22.033 -16.602   5.033
  184    HG2  GLU  21           HG2      GLU  21 -24.730 -16.643   6.413
  185    HG3  GLU  21           HG1      GLU  21 -24.506 -16.314   4.694
  186    H    LYS  22           HN       LYS  22 -20.294 -18.529   7.518
  187    HA   LYS  22           HA       LYS  22 -18.253 -16.565   8.250
  188    HB2  LYS  22           HB2      LYS  22 -18.397 -18.801   9.337
  189    HB3  LYS  22           HB1      LYS  22 -17.989 -19.551   7.793
  190    HG2  LYS  22           HG2      LYS  22 -15.852 -18.336   7.745
  191    HG3  LYS  22           HG1      LYS  22 -16.263 -17.531   9.259
  192    HD2  LYS  22           HD2      LYS  22 -16.351 -19.731  10.392
  193    HD3  LYS  22           HD1      LYS  22 -15.911 -20.521   8.879
  194    HE2  LYS  22           HE2      LYS  22 -13.784 -19.273   8.835
  195    HE3  LYS  22           HE1      LYS  22 -14.223 -18.467  10.341
  196    HZ1  LYS  22           HZ1      LYS  22 -13.757 -20.282  11.550
  197    HZ2  LYS  22           HZ2      LYS  22 -12.810 -20.730  10.213
  198    HZ3  LYS  22           HZ3      LYS  22 -14.378 -21.359  10.396
  199    H    TRP  23           HN       TRP  23 -16.469 -16.020   7.069
  200    HA   TRP  23           HA       TRP  23 -16.589 -16.607   4.144
  201    HB2  TRP  23           HB2      TRP  23 -14.897 -14.513   5.531
  202    HB3  TRP  23           HB1      TRP  23 -15.331 -14.599   3.827
  203    HD1  TRP  23           HD1      TRP  23 -18.480 -15.391   4.718
  204    HE1  TRP  23           HE1      TRP  23 -20.006 -13.410   5.327
  205    HE3  TRP  23           HE3      TRP  23 -14.953 -11.824   5.688
  206    HZ2  TRP  23           HZ2      TRP  23 -19.769 -10.674   6.119
  207    HZ3  TRP  23           HZ3      TRP  23 -15.634  -9.540   6.368
  208    HH2  TRP  23           HH2      TRP  23 -18.034  -8.964   6.584
  209    H    GLU  24           HN       GLU  24 -14.255 -16.495   3.166
  210    HA   GLU  24           HA       GLU  24 -12.572 -18.454   4.698
  211    HB2  GLU  24           HB2      GLU  24 -12.856 -17.932   1.726
  212    HB3  GLU  24           HB1      GLU  24 -11.640 -19.002   2.427
  213    HG2  GLU  24           HG2      GLU  24 -13.385 -20.380   3.441
  214    HG3  GLU  24           HG1      GLU  24 -14.629 -19.288   2.834
  215    H    CYS  25           HN       CYS  25 -10.836 -17.622   5.566
  216    HA   CYS  25           HA       CYS  25  -9.785 -15.019   4.779
  217    HB2  CYS  25           HB2      CYS  25  -8.377 -16.893   6.677
  218    HB3  CYS  25           HB1      CYS  25  -8.490 -15.132   6.725
  219    HG   CYS  25           HG       CYS  25 -10.407 -15.457   8.248
  220    H    GLU  26           HN       GLU  26  -7.997 -14.599   3.649
  221    HA   GLU  26           HA       GLU  26  -6.318 -16.882   2.674
  222    HB2  GLU  26           HB2      GLU  26  -7.866 -16.088   0.898
  223    HB3  GLU  26           HB1      GLU  26  -7.208 -14.461   1.067
  224    HG2  GLU  26           HG2      GLU  26  -4.973 -15.284   0.453
  225    HG3  GLU  26           HG1      GLU  26  -5.598 -16.928   0.332
  226    H    SER  27           HN       SER  27  -4.326 -16.626   3.378
  227    HA   SER  27           HA       SER  27  -3.342 -13.927   4.150
  228    HB2  SER  27           HB2      SER  27  -2.270 -16.709   4.702
  229    HB3  SER  27           HB1      SER  27  -1.508 -15.217   5.249
  230    HG   SER  27           HG       SER  27  -3.902 -14.887   6.002
  231    H    ILE  28           HN       ILE  28  -2.215 -12.853   2.726
  232    HA   ILE  28           HA       ILE  28  -0.123 -14.181   1.112
  233    HB   ILE  28           HB       ILE  28  -2.100 -14.173  -0.365
  234   HG12  ILE  28          HG12      ILE  28  -0.166 -11.996  -1.207
  235   HG13  ILE  28          HG11      ILE  28   0.254 -13.708  -1.208
  236   HG21  ILE  28          HG21      ILE  28  -3.215 -12.137  -0.995
  237   HG22  ILE  28          HG22      ILE  28  -2.048 -11.153  -0.112
  238   HG23  ILE  28          HG23      ILE  28  -3.182 -12.177   0.768
  239   HD11  ILE  28          HD11      ILE  28  -1.989 -12.408  -2.782
  240   HD12  ILE  28          HD12      ILE  28  -1.689 -14.145  -2.716
  241   HD13  ILE  28          HD13      ILE  28  -0.492 -13.071  -3.440
  242    H    GLU  29           HN       GLU  29   1.519 -12.766   0.475
  243    HA   GLU  29           HA       GLU  29   1.721 -10.306   2.104
  244    HB2  GLU  29           HB2      GLU  29   3.713 -11.803   0.371
  245    HB3  GLU  29           HB1      GLU  29   4.089 -10.312   1.236
  246    HG2  GLU  29           HG2      GLU  29   3.550 -11.364   3.370
  247    HG3  GLU  29           HG1      GLU  29   3.054 -12.842   2.547
  248    H    GLU  30           HN       GLU  30   1.377  -8.342   1.275
  249    HA   GLU  30           HA       GLU  30   1.703  -7.903  -1.658
  250    HB2  GLU  30           HB2      GLU  30  -0.737  -7.189  -0.004
  251    HB3  GLU  30           HB1      GLU  30  -0.425  -6.567  -1.626
  252    HG2  GLU  30           HG2      GLU  30  -0.598  -9.514  -0.937
  253    HG3  GLU  30           HG1      GLU  30  -1.924  -8.575  -1.617
  254    H    VAL  31           HN       VAL  31   2.008  -5.726  -2.240
  255    HA   VAL  31           HA       VAL  31   3.433  -4.167  -0.195
  256    HB   VAL  31           HB       VAL  31   3.020  -3.721  -3.170
  257   HG11  VAL  31          HG11      VAL  31   3.346  -1.569  -2.154
  258   HG12  VAL  31          HG12      VAL  31   4.908  -2.051  -2.816
  259   HG13  VAL  31          HG13      VAL  31   4.600  -2.197  -1.085
  260   HG21  VAL  31          HG21      VAL  31   5.543  -4.460  -1.663
  261   HG22  VAL  31          HG22      VAL  31   5.273  -4.508  -3.406
  262   HG23  VAL  31          HG23      VAL  31   4.466  -5.673  -2.356
  263    H    ALA  32           HN       ALA  32   2.683  -2.386   0.756
  264    HA   ALA  32           HA       ALA  32  -0.057  -1.746   0.891
  265    HB1  ALA  32           HB1      ALA  32   0.791   0.459   1.866
  266    HB2  ALA  32           HB2      ALA  32   2.420  -0.116   1.511
  267    HB3  ALA  32           HB3      ALA  32   1.399  -1.002   2.644
  268    H    ASP  33           HN       ASP  33   2.511  -0.253  -1.053
  269    HA   ASP  33           HA       ASP  33   0.922   1.861  -2.147
  270    HB2  ASP  33           HB2      ASP  33   3.421   1.785  -2.207
  271    HB3  ASP  33           HB1      ASP  33   3.330   0.488  -3.397
  272    H    ASP  34           HN       ASP  34   1.556  -1.454  -3.243
  273    HA   ASP  34           HA       ASP  34   0.290  -1.261  -5.798
  274    HB2  ASP  34           HB2      ASP  34   0.747  -3.591  -3.911
  275    HB3  ASP  34           HB1      ASP  34   0.004  -3.794  -5.496
  276    H    ILE  35           HN       ILE  35  -0.944  -2.097  -2.579
  277    HA   ILE  35           HA       ILE  35  -3.689  -2.439  -3.601
  278    HB   ILE  35           HB       ILE  35  -2.534  -2.569  -0.790
  279   HG12  ILE  35          HG12      ILE  35  -3.518  -4.808  -2.587
  280   HG13  ILE  35          HG11      ILE  35  -1.820  -4.347  -2.458
  281   HG21  ILE  35          HG21      ILE  35  -5.294  -3.149  -1.887
  282   HG22  ILE  35          HG22      ILE  35  -4.860  -1.985  -0.638
  283   HG23  ILE  35          HG23      ILE  35  -4.742  -3.713  -0.311
  284   HD11  ILE  35          HD11      ILE  35  -3.430  -4.985   0.016
  285   HD12  ILE  35          HD12      ILE  35  -1.680  -5.017  -0.204
  286   HD13  ILE  35          HD13      ILE  35  -2.684  -6.269  -0.935
  287    H    LEU  36           HN       LEU  36  -2.519  -0.638  -0.753
  288    HA   LEU  36           HA       LEU  36  -4.621   1.222  -0.737
  289    HB2  LEU  36           HB2      LEU  36  -1.797   1.681   0.273
  290    HB3  LEU  36           HB1      LEU  36  -3.238   2.533   0.811
  291    HG   LEU  36           HG       LEU  36  -2.726  -0.438   1.123
  292   HD11  LEU  36          HD11      LEU  36  -1.383   0.719   2.715
  293   HD12  LEU  36          HD12      LEU  36  -2.839   0.256   3.594
  294   HD13  LEU  36          HD13      LEU  36  -2.646   1.909   3.026
  295   HD21  LEU  36          HD21      LEU  36  -5.112   1.327   1.664
  296   HD22  LEU  36          HD22      LEU  36  -4.827  -0.089   2.676
  297   HD23  LEU  36          HD23      LEU  36  -5.062  -0.281   0.945
  298    HA   PRO  37           HA       PRO  37  -3.655   3.915  -4.099
  299    HB2  PRO  37           HB2      PRO  37  -4.776   6.270  -3.196
  300    HB3  PRO  37           HB1      PRO  37  -5.718   4.907  -3.829
  301    HG2  PRO  37           HG2      PRO  37  -5.193   5.688  -0.996
  302    HG3  PRO  37           HG1      PRO  37  -6.679   5.069  -1.741
  303    HD2  PRO  37           HD2      PRO  37  -5.017   3.496  -0.266
  304    HD3  PRO  37           HD1      PRO  37  -5.992   2.864  -1.608
  305    H    ASP  38           HN       ASP  38  -2.346   5.704  -4.721
  306    HA   ASP  38           HA       ASP  38   0.044   6.056  -3.174
  307    HB2  ASP  38           HB2      ASP  38  -1.062   7.512  -5.597
  308    HB3  ASP  38           HB1      ASP  38   0.523   7.861  -4.910
  309    H    GLN  39           HN       GLN  39  -3.012   7.608  -3.126
  310    HA   GLN  39           HA       GLN  39  -2.329  10.238  -2.270
  311    HB2  GLN  39           HB2      GLN  39  -4.629   9.563  -2.932
  312    HB3  GLN  39           HB1      GLN  39  -4.743   8.560  -1.486
  313    HG2  GLN  39           HG2      GLN  39  -4.517  10.507  -0.050
  314    HG3  GLN  39           HG1      GLN  39  -4.217  11.546  -1.443
  315   HE21  GLN  39          HE21      GLN  39  -6.397  12.047   0.352
  316   HE22  GLN  39          HE22      GLN  39  -7.851  11.782  -0.485
  317    H    TYR  40           HN       TYR  40  -2.802   7.216  -0.477
  318    HA   TYR  40           HA       TYR  40  -2.073   8.568   2.070
  319    HB2  TYR  40           HB2      TYR  40  -3.940   7.122   2.332
  320    HB3  TYR  40           HB1      TYR  40  -3.192   5.840   1.379
  321    HD1  TYR  40           HD1      TYR  40  -2.586   7.884   4.468
  322    HD2  TYR  40           HD2      TYR  40  -2.097   4.100   2.502
  323    HE1  TYR  40           HE1      TYR  40  -1.593   6.940   6.534
  324    HE2  TYR  40           HE2      TYR  40  -1.112   3.149   4.570
  325    HH   TYR  40           HH       TYR  40  -1.466   4.253   7.441
  326    H    VAL  41           HN       VAL  41  -0.577   6.963  -0.478
  327    HA   VAL  41           HA       VAL  41   1.801   6.359   1.247
  328    HB   VAL  41           HB       VAL  41   1.158   4.735  -1.222
  329   HG11  VAL  41          HG11      VAL  41   3.430   4.794  -0.022
  330   HG12  VAL  41          HG12      VAL  41   2.717   3.201  -0.280
  331   HG13  VAL  41          HG13      VAL  41   2.624   3.964   1.308
  332   HG21  VAL  41          HG21      VAL  41   0.262   3.011   0.449
  333   HG22  VAL  41          HG22      VAL  41  -0.803   4.374   0.108
  334   HG23  VAL  41          HG23      VAL  41   0.131   4.337   1.603
  335    H    ARG  42           HN       ARG  42   1.285   8.782  -0.093
  336    HA   ARG  42           HA       ARG  42   2.483   8.950  -2.690
  337    HB2  ARG  42           HB2      ARG  42   1.111  10.774  -1.815
  338    HB3  ARG  42           HB1      ARG  42   2.238  11.027  -0.490
  339    HG2  ARG  42           HG2      ARG  42   3.994  11.705  -2.034
  340    HG3  ARG  42           HG1      ARG  42   2.986  11.279  -3.416
  341    HD2  ARG  42           HD2      ARG  42   2.941  13.704  -3.053
  342    HD3  ARG  42           HD1      ARG  42   1.351  13.011  -2.735
  343    HE   ARG  42           HE       ARG  42   1.629  13.502  -0.423
  344   HH11  ARG  42          HH21      ARG  42   4.521  14.043  -2.258
  345   HH12  ARG  42          HH22      ARG  42   5.325  14.874  -0.968
  346   HH21  ARG  42          HH11      ARG  42   2.673  14.585   1.243
  347   HH22  ARG  42          HH12      ARG  42   4.282  15.179   1.006
  348    H    LEU  43           HN       LEU  43   3.791   9.356   0.585
  349    HA   LEU  43           HA       LEU  43   6.471   8.605  -0.392
  350    HB2  LEU  43           HB2      LEU  43   7.590  10.582   0.277
  351    HB3  LEU  43           HB1      LEU  43   6.169  11.163  -0.584
  352    HG   LEU  43           HG       LEU  43   6.499  10.976   2.432
  353   HD11  LEU  43          HD11      LEU  43   6.252  13.287   0.504
  354   HD12  LEU  43          HD12      LEU  43   7.625  12.896   1.541
  355   HD13  LEU  43          HD13      LEU  43   6.109  13.444   2.255
  356   HD21  LEU  43          HD21      LEU  43   4.208  12.163   2.335
  357   HD22  LEU  43          HD22      LEU  43   4.215  10.432   2.011
  358   HD23  LEU  43          HD23      LEU  43   4.117  11.578   0.679
  359    H    GLY  44           HN       GLY  44   4.097   8.159   1.706
  360    HA2  GLY  44           HA2      GLY  44   5.174   8.278   4.313
  361    HA3  GLY  44           HA1      GLY  44   3.921   7.149   3.795
  362    HA   PRO  45           HA       PRO  45   8.110   5.033   4.612
  363    HB2  PRO  45           HB2      PRO  45   7.348   3.699   6.930
  364    HB3  PRO  45           HB1      PRO  45   8.206   5.251   6.907
  365    HG2  PRO  45           HG2      PRO  45   5.306   4.699   7.327
  366    HG3  PRO  45           HG1      PRO  45   6.346   5.920   8.082
  367    HD2  PRO  45           HD2      PRO  45   4.584   6.516   6.070
  368    HD3  PRO  45           HD1      PRO  45   6.095   7.417   6.327
  369    H    LEU  46           HN       LEU  46   4.762   4.211   4.480
  370    HA   LEU  46           HA       LEU  46   5.123   1.329   4.190
  371    HB2  LEU  46           HB2      LEU  46   2.739   3.074   3.478
  372    HB3  LEU  46           HB1      LEU  46   2.733   1.317   3.621
  373    HG   LEU  46           HG       LEU  46   3.387   3.244   5.872
  374   HD11  LEU  46          HD11      LEU  46   1.198   2.291   6.788
  375   HD12  LEU  46          HD12      LEU  46   0.903   1.666   5.166
  376   HD13  LEU  46          HD13      LEU  46   1.045   3.404   5.429
  377   HD21  LEU  46          HD21      LEU  46   2.966   0.980   7.163
  378   HD22  LEU  46          HD22      LEU  46   4.532   1.272   6.420
  379   HD23  LEU  46          HD23      LEU  46   3.355   0.237   5.611
  380    H    SER  47           HN       SER  47   6.290   3.600   2.369
  381    HA   SER  47           HA       SER  47   5.401   3.590  -0.225
  382    HB2  SER  47           HB2      SER  47   7.860   3.555  -0.907
  383    HB3  SER  47           HB1      SER  47   7.415   4.779   0.276
  384    HG   SER  47           HG       SER  47   8.006   2.913   1.810
  385    H    ASN  48           HN       ASN  48   8.199   1.556   0.058
  386    HA   ASN  48           HA       ASN  48   6.772  -0.581  -1.460
  387    HB2  ASN  48           HB2      ASN  48   9.729   0.008  -1.091
  388    HB3  ASN  48           HB1      ASN  48   9.099  -1.387  -1.964
  389   HD21  ASN  48          HD21      ASN  48   6.770   0.262  -3.027
  390   HD22  ASN  48          HD22      ASN  48   7.445   1.215  -4.256
  391    H    LYS  49           HN       LYS  49   6.091  -0.572   1.169
  392    HA   LYS  49           HA       LYS  49   7.797  -2.592   2.529
  393    HB2  LYS  49           HB2      LYS  49   5.508  -0.841   3.443
  394    HB3  LYS  49           HB1      LYS  49   6.122  -2.167   4.427
  395    HG2  LYS  49           HG2      LYS  49   8.078  -0.176   3.290
  396    HG3  LYS  49           HG1      LYS  49   7.131   0.271   4.706
  397    HD2  LYS  49           HD2      LYS  49   8.512  -2.405   4.702
  398    HD3  LYS  49           HD1      LYS  49   9.474  -0.959   4.989
  399    HE2  LYS  49           HE2      LYS  49   7.956  -0.316   6.828
  400    HE3  LYS  49           HE1      LYS  49   6.994  -1.766   6.543
  401    HZ1  LYS  49           HZ1      LYS  49   9.256  -2.951   6.818
  402    HZ2  LYS  49           HZ2      LYS  49   8.406  -2.440   8.198
  403    HZ3  LYS  49           HZ3      LYS  49   9.717  -1.529   7.618
  404    H    ILE  50           HN       ILE  50   7.130  -4.613   2.935
  405    HA   ILE  50           HA       ILE  50   4.749  -5.577   1.460
  406    HB   ILE  50           HB       ILE  50   7.067  -6.998   2.807
  407   HG12  ILE  50          HG12      ILE  50   7.535  -7.659   0.431
  408   HG13  ILE  50          HG11      ILE  50   6.209  -6.618  -0.081
  409   HG21  ILE  50          HG21      ILE  50   6.013  -9.011   1.572
  410   HG22  ILE  50          HG22      ILE  50   4.540  -8.041   1.528
  411   HG23  ILE  50          HG23      ILE  50   5.257  -8.490   3.077
  412   HD11  ILE  50          HD11      ILE  50   8.338  -5.420   1.665
  413   HD12  ILE  50          HD12      ILE  50   7.364  -4.671   0.400
  414   HD13  ILE  50          HD13      ILE  50   8.711  -5.718  -0.032
  415    H    LEU  51           HN       LEU  51   2.958  -5.288   2.627
  416    HA   LEU  51           HA       LEU  51   2.959  -5.978   5.535
  417    HB2  LEU  51           HB2      LEU  51   1.183  -4.261   3.798
  418    HB3  LEU  51           HB1      LEU  51   0.625  -4.847   5.363
  419    HG   LEU  51           HG       LEU  51   2.674  -3.854   6.411
  420   HD11  LEU  51          HD11      LEU  51   4.257  -3.664   4.678
  421   HD12  LEU  51          HD12      LEU  51   3.729  -2.001   4.906
  422   HD13  LEU  51          HD13      LEU  51   3.095  -2.949   3.561
  423   HD21  LEU  51          HD21      LEU  51   1.835  -1.570   6.358
  424   HD22  LEU  51          HD22      LEU  51   0.466  -2.682   6.327
  425   HD23  LEU  51          HD23      LEU  51   0.988  -1.883   4.843
  426    H    GLN  52           HN       GLN  52   1.750  -7.607   6.296
  427    HA   GLN  52           HA       GLN  52   0.736  -9.593   4.433
  428    HB2  GLN  52           HB2      GLN  52   0.637  -9.387   7.460
  429    HB3  GLN  52           HB1      GLN  52   0.020 -10.769   6.551
  430    HG2  GLN  52           HG2      GLN  52   2.229 -11.174   5.591
  431    HG3  GLN  52           HG1      GLN  52   2.869  -9.741   6.396
  432   HE21  GLN  52          HE21      GLN  52   2.611 -13.085   6.717
  433   HE22  GLN  52          HE22      GLN  52   2.838 -13.204   8.395
  434    H    THR  53           HN       THR  53  -1.117  -9.322   3.435
  435    HA   THR  53           HA       THR  53  -3.335  -7.842   4.778
  436    HB   THR  53           HB       THR  53  -2.441  -7.016   2.562
  437    HG1  THR  53           HG1      THR  53  -4.870  -7.263   3.439
  438   HG21  THR  53          HG21      THR  53  -2.177  -9.452   1.720
  439   HG22  THR  53          HG22      THR  53  -2.767  -8.236   0.589
  440   HG23  THR  53          HG23      THR  53  -3.899  -9.350   1.352
  441    H    ASN  54           HN       ASN  54  -5.008  -8.990   5.479
  442    HA   ASN  54           HA       ASN  54  -5.347 -11.808   4.552
  443    HB2  ASN  54           HB2      ASN  54  -5.139 -11.422   6.982
  444    HB3  ASN  54           HB1      ASN  54  -6.546 -10.359   6.935
  445   HD21  ASN  54          HD21      ASN  54  -6.552 -12.735   8.515
  446   HD22  ASN  54          HD22      ASN  54  -7.660 -13.830   7.843
  447    H    THR  55           HN       THR  55  -6.504 -11.651   2.695
  448    HA   THR  55           HA       THR  55  -8.914  -9.937   2.546
  449    HB   THR  55           HB       THR  55  -7.704 -11.793   0.469
  450    HG1  THR  55           HG1      THR  55  -7.495  -9.165  -0.018
  451   HG21  THR  55          HG21      THR  55  -9.795  -9.602   0.308
  452   HG22  THR  55          HG22      THR  55 -10.055 -11.325   0.030
  453   HG23  THR  55          HG23      THR  55  -9.067 -10.389  -1.092
  454    H    TYR  56           HN       TYR  56 -10.927 -10.676   2.747
  455    HA   TYR  56           HA       TYR  56 -11.345 -13.623   3.105
  456    HB2  TYR  56           HB2      TYR  56 -13.159 -11.390   4.052
  457    HB3  TYR  56           HB1      TYR  56 -13.194 -13.088   4.524
  458    HD1  TYR  56           HD2      TYR  56 -11.416  -9.880   4.903
  459    HD2  TYR  56           HD1      TYR  56 -11.557 -14.011   6.074
  460    HE1  TYR  56           HE2      TYR  56  -9.821  -9.412   6.746
  461    HE2  TYR  56           HE1      TYR  56  -9.962 -13.543   7.914
  462    HH   TYR  56           HH       TYR  56  -8.166 -10.688   8.109
  463    H    TYR  57           HN       TYR  57 -12.766 -14.637   1.803
  464    HA   TYR  57           HA       TYR  57 -14.534 -13.020   0.019
  465    HB2  TYR  57           HB2      TYR  57 -13.925 -14.410  -1.894
  466    HB3  TYR  57           HB1      TYR  57 -12.488 -13.621  -1.250
  467    HD1  TYR  57           HD2      TYR  57 -10.995 -14.938   0.360
  468    HD2  TYR  57           HD1      TYR  57 -14.058 -16.776  -2.028
  469    HE1  TYR  57           HE2      TYR  57  -9.923 -17.151   0.681
  470    HE2  TYR  57           HE1      TYR  57 -12.980 -18.987  -1.706
  471    HH   TYR  57           HH       TYR  57 -11.045 -20.008  -1.041
  472    H    SER  58           HN       SER  58 -16.525 -13.748   0.063
  473    HA   SER  58           HA       SER  58 -17.072 -16.635   0.527
  474    HB2  SER  58           HB2      SER  58 -18.446 -16.304   2.354
  475    HB3  SER  58           HB1      SER  58 -17.304 -14.992   2.624
  476    HG   SER  58           HG       SER  58 -19.560 -14.383   2.699
  477    H    ASP  59           HN       ASP  59 -19.619 -16.861   0.302
  478    HA   ASP  59           HA       ASP  59 -20.262 -16.286  -2.416
  479    HB2  ASP  59           HB2      ASP  59 -21.946 -17.173  -0.054
  480    HB3  ASP  59           HB1      ASP  59 -22.607 -17.007  -1.680
  481    H    THR  60           HN       THR  60 -21.315 -14.784   0.630
  482    HA   THR  60           HA       THR  60 -23.129 -12.885  -0.544
  483    HB   THR  60           HB       THR  60 -22.744 -11.640   1.654
  484    HG1  THR  60           HG1      THR  60 -21.326 -13.886   2.515
  485   HG21  THR  60          HG21      THR  60 -23.696 -13.501   3.061
  486   HG22  THR  60          HG22      THR  60 -23.413 -14.592   1.704
  487   HG23  THR  60          HG23      THR  60 -24.539 -13.246   1.533
  488    H    LEU  61           HN       LEU  61 -19.744 -12.620   0.517
  489    HA   LEU  61           HA       LEU  61 -19.320  -9.900  -0.231
  490    HB2  LEU  61           HB2      LEU  61 -17.543 -12.285   0.250
  491    HB3  LEU  61           HB1      LEU  61 -16.832 -10.809  -0.402
  492    HG   LEU  61           HG       LEU  61 -17.658  -9.526   1.497
  493   HD11  LEU  61          HD11      LEU  61 -18.909 -12.160   2.314
  494   HD12  LEU  61          HD12      LEU  61 -19.733 -10.637   1.988
  495   HD13  LEU  61          HD13      LEU  61 -18.715 -10.799   3.416
  496   HD21  LEU  61          HD21      LEU  61 -16.288 -12.101   2.339
  497   HD22  LEU  61          HD22      LEU  61 -16.330 -10.616   3.289
  498   HD23  LEU  61          HD23      LEU  61 -15.486 -10.650   1.740
  499    H    HIS  62           HN       HIS  62 -18.803 -12.928  -2.015
  500    HA   HIS  62           HA       HIS  62 -17.664 -11.710  -4.355
  501    HB2  HIS  62           HB2      HIS  62 -17.426 -14.120  -3.844
  502    HB3  HIS  62           HB1      HIS  62 -19.159 -14.342  -4.087
  503    HD1  HIS  62           HD1      HIS  62 -16.082 -13.192  -6.007
  504    HD2  HIS  62           HD2      HIS  62 -19.880 -14.743  -6.744
  505    HE1  HIS  62           HE1      HIS  62 -16.211 -13.612  -8.501
  506    H    LYS  63           HN       LYS  63 -20.983 -12.620  -3.469
  507    HA   LYS  63           HA       LYS  63 -22.191 -11.963  -5.985
  508    HB2  LYS  63           HB2      LYS  63 -23.305 -13.322  -4.220
  509    HB3  LYS  63           HB1      LYS  63 -23.439 -11.876  -3.217
  510    HG2  LYS  63           HG2      LYS  63 -24.811 -10.782  -4.895
  511    HG3  LYS  63           HG1      LYS  63 -24.595 -12.135  -6.005
  512    HD2  LYS  63           HD2      LYS  63 -25.733 -13.625  -4.389
  513    HD3  LYS  63           HD1      LYS  63 -25.978 -12.251  -3.309
  514    HE2  LYS  63           HE2      LYS  63 -27.011 -12.390  -6.157
  515    HE3  LYS  63           HE1      LYS  63 -27.981 -12.751  -4.729
  516    HZ1  LYS  63           HZ1      LYS  63 -27.729 -10.546  -3.949
  517    HZ2  LYS  63           HZ2      LYS  63 -28.177 -10.430  -5.584
  518    HZ3  LYS  63           HZ3      LYS  63 -26.561 -10.179  -5.123
  519    H    SER  64           HN       SER  64 -21.658 -10.084  -3.021
  520    HA   SER  64           HA       SER  64 -22.907  -7.682  -4.123
  521    HB2  SER  64           HB2      SER  64 -21.218  -8.087  -1.636
  522    HB3  SER  64           HB1      SER  64 -22.094  -6.613  -2.038
  523    HG   SER  64           HG       SER  64 -23.917  -7.553  -1.519
  524    H    ASN  65           HN       ASN  65 -19.997  -9.194  -4.646
  525    HA   ASN  65           HA       ASN  65 -18.002  -8.549  -5.659
  526    HB2  ASN  65           HB2      ASN  65 -19.672  -7.470  -7.219
  527    HB3  ASN  65           HB1      ASN  65 -19.435  -5.968  -6.325
  528   HD21  ASN  65          HD21      ASN  65 -18.008  -4.658  -7.459
  529   HD22  ASN  65          HD22      ASN  65 -16.612  -5.195  -8.263
  530    H    ILE  66           HN       ILE  66 -18.179  -8.174  -2.925
  531    HA   ILE  66           HA       ILE  66 -16.699  -5.604  -2.468
  532    HB   ILE  66           HB       ILE  66 -18.235  -7.326  -0.498
  533   HG12  ILE  66          HG12      ILE  66 -18.793  -4.517  -1.504
  534   HG13  ILE  66          HG11      ILE  66 -19.583  -5.956  -2.145
  535   HG21  ILE  66          HG21      ILE  66 -16.385  -6.314   0.643
  536   HG22  ILE  66          HG22      ILE  66 -17.782  -5.300   0.990
  537   HG23  ILE  66          HG23      ILE  66 -16.602  -4.792  -0.217
  538   HD11  ILE  66          HD11      ILE  66 -19.749  -4.846   0.662
  539   HD12  ILE  66          HD12      ILE  66 -20.284  -6.476   0.255
  540   HD13  ILE  66          HD13      ILE  66 -21.065  -5.081  -0.487
  541    H    TYR  67           HN       TYR  67 -14.641  -5.738  -1.897
  542    HA   TYR  67           HA       TYR  67 -13.502  -8.406  -1.143
  543    HB2  TYR  67           HB2      TYR  67 -12.274  -6.137  -2.713
  544    HB3  TYR  67           HB1      TYR  67 -11.379  -7.540  -2.129
  545    HD1  TYR  67           HD1      TYR  67 -12.321  -9.888  -2.754
  546    HD2  TYR  67           HD2      TYR  67 -13.403  -6.257  -4.780
  547    HE1  TYR  67           HE1      TYR  67 -13.076 -11.206  -4.714
  548    HE2  TYR  67           HE2      TYR  67 -14.159  -7.575  -6.739
  549    HH   TYR  67           HH       TYR  67 -14.942 -10.586  -6.740
  550    HA   PRO  68           HA       PRO  68 -12.572  -5.651   2.416
  551    HB2  PRO  68           HB2      PRO  68 -13.314  -7.326   4.392
  552    HB3  PRO  68           HB1      PRO  68 -14.508  -6.406   3.453
  553    HG2  PRO  68           HG2      PRO  68 -13.749  -9.277   3.248
  554    HG3  PRO  68           HG1      PRO  68 -15.334  -8.512   3.043
  555    HD2  PRO  68           HD2      PRO  68 -13.605  -9.278   0.958
  556    HD3  PRO  68           HD1      PRO  68 -14.984  -8.171   0.794
  557    H    PHE  69           HN       PHE  69 -10.679  -5.621   3.620
  558    HA   PHE  69           HA       PHE  69  -9.177  -8.096   4.097
  559    HB2  PHE  69           HB2      PHE  69  -7.163  -7.350   2.917
  560    HB3  PHE  69           HB1      PHE  69  -8.512  -7.521   1.796
  561    HD1  PHE  69           HD1      PHE  69  -6.336  -5.137   3.573
  562    HD2  PHE  69           HD2      PHE  69  -9.562  -5.570   0.772
  563    HE1  PHE  69           HE1      PHE  69  -6.069  -2.765   2.900
  564    HE2  PHE  69           HE2      PHE  69  -9.296  -3.197   0.099
  565    HZ   PHE  69           HZ       PHE  69  -7.549  -1.795   1.163
  566    H    ILE  70           HN       ILE  70  -7.377  -7.803   5.471
  567    HA   ILE  70           HA       ILE  70  -7.364  -5.224   7.003
  568    HB   ILE  70           HB       ILE  70  -7.081  -8.061   8.046
  569   HG12  ILE  70          HG12      ILE  70  -9.119  -5.923   8.732
  570   HG13  ILE  70          HG11      ILE  70  -9.404  -7.166   7.514
  571   HG21  ILE  70          HG21      ILE  70  -7.093  -6.697  10.283
  572   HG22  ILE  70          HG22      ILE  70  -6.564  -5.357   9.269
  573   HG23  ILE  70          HG23      ILE  70  -5.592  -6.819   9.370
  574   HD11  ILE  70          HD11      ILE  70 -10.277  -7.686   9.858
  575   HD12  ILE  70          HD12      ILE  70  -8.589  -7.834  10.350
  576   HD13  ILE  70          HD13      ILE  70  -9.251  -8.921   9.129
  577    H    LEU  71           HN       LEU  71  -5.446  -4.308   7.205
  578    HA   LEU  71           HA       LEU  71  -3.033  -5.749   6.204
  579    HB2  LEU  71           HB2      LEU  71  -3.553  -2.782   6.623
  580    HB3  LEU  71           HB1      LEU  71  -2.068  -3.473   5.972
  581    HG   LEU  71           HG       LEU  71  -4.815  -3.798   4.723
  582   HD11  LEU  71          HD11      LEU  71  -2.470  -1.998   4.066
  583   HD12  LEU  71          HD12      LEU  71  -4.125  -1.509   4.438
  584   HD13  LEU  71          HD13      LEU  71  -3.768  -2.339   2.923
  585   HD21  LEU  71          HD21      LEU  71  -2.072  -4.824   4.053
  586   HD22  LEU  71          HD22      LEU  71  -3.227  -4.505   2.757
  587   HD23  LEU  71          HD23      LEU  71  -3.625  -5.654   4.024
  588    H    TYR  72           HN       TYR  72  -1.453  -6.267   7.539
  589    HA   TYR  72           HA       TYR  72  -1.108  -4.821  10.086
  590    HB2  TYR  72           HB2      TYR  72  -0.969  -7.020  11.322
  591    HB3  TYR  72           HB1      TYR  72  -2.589  -6.534  10.827
  592    HD1  TYR  72           HD1      TYR  72  -3.482  -7.452   8.597
  593    HD2  TYR  72           HD2      TYR  72  -0.092  -9.105  10.645
  594    HE1  TYR  72           HE1      TYR  72  -3.752  -9.568   7.329
  595    HE2  TYR  72           HE2      TYR  72  -0.354 -11.221   9.377
  596    HH   TYR  72           HH       TYR  72  -2.801 -11.539   6.823
  597    H    TYR  73           HN       TYR  73   0.921  -5.161  11.037
  598    HA   TYR  73           HA       TYR  73   2.964  -6.564   9.368
  599    HB2  TYR  73           HB2      TYR  73   3.067  -4.192   8.784
  600    HB3  TYR  73           HB1      TYR  73   3.144  -3.746  10.488
  601    HD1  TYR  73           HD1      TYR  73   4.914  -5.791   7.898
  602    HD2  TYR  73           HD2      TYR  73   5.235  -3.573  11.564
  603    HE1  TYR  73           HE1      TYR  73   7.378  -6.067   7.850
  604    HE2  TYR  73           HE2      TYR  73   7.700  -3.848  11.515
  605    HH   TYR  73           HH       TYR  73   9.467  -4.261   9.606
  606    H    GLN  74           HN       GLN  74   4.052  -7.927  10.575
  607    HA   GLN  74           HA       GLN  74   4.965  -9.031  12.404
  608    HB2  GLN  74           HB2      GLN  74   5.274  -6.174  13.351
  609    HB3  GLN  74           HB1      GLN  74   6.046  -7.564  14.107
  610    HG2  GLN  74           HG2      GLN  74   6.404  -6.775  11.199
  611    HG3  GLN  74           HG1      GLN  74   7.541  -6.381  12.486
  612   HE21  GLN  74          HE21      GLN  74   7.777  -8.715  13.937
  613   HE22  GLN  74          HE22      GLN  74   8.313  -9.988  12.949
  614    H    LYS  75           HN       LYS  75   2.311  -9.218  12.445
  615    HA   LYS  75           HA       LYS  75   0.468  -9.633  13.818
  616    HB2  LYS  75           HB2      LYS  75   2.543  -9.582  16.029
  617    HB3  LYS  75           HB1      LYS  75   0.964 -10.364  16.081
  618    HG2  LYS  75           HG2      LYS  75   3.174 -11.085  14.129
  619    HG3  LYS  75           HG1      LYS  75   2.818 -11.973  15.610
  620    HD2  LYS  75           HD2      LYS  75   0.412 -12.181  14.685
  621    HD3  LYS  75           HD1      LYS  75   1.104 -11.693  13.137
  622    HE2  LYS  75           HE2      LYS  75   2.687 -13.562  13.223
  623    HE3  LYS  75           HE1      LYS  75   2.037 -14.053  14.786
  624    HZ1  LYS  75           HZ1      LYS  75  -0.067 -13.740  12.934
  625    HZ2  LYS  75           HZ2      LYS  75   0.413 -15.137  13.775
  626    HZ3  LYS  75           HZ3      LYS  75   1.110 -14.764  12.270
  627    H    GLN  76           HN       GLN  76   0.762  -7.022  13.111
  628    HA   GLN  76           HA       GLN  76  -0.490  -5.677  15.426
  629    HB2  GLN  76           HB2      GLN  76   1.969  -5.180  15.538
  630    HB3  GLN  76           HB1      GLN  76   1.831  -4.407  13.958
  631    HG2  GLN  76           HG2      GLN  76   0.180  -2.832  14.835
  632    HG3  GLN  76           HG1      GLN  76   0.228  -3.630  16.407
  633   HE21  GLN  76          HE21      GLN  76   0.917  -0.839  16.023
  634   HE22  GLN  76          HE22      GLN  76   2.563  -0.659  16.399
  635    H    LEU  77           HN       LEU  77  -2.211  -4.638  14.759
  636    HA   LEU  77           HA       LEU  77  -3.035  -4.513  12.033
  637    HB2  LEU  77           HB2      LEU  77  -4.563  -4.552  14.031
  638    HB3  LEU  77           HB1      LEU  77  -4.085  -2.894  14.385
  639    HG   LEU  77           HG       LEU  77  -4.886  -2.226  12.105
  640   HD11  LEU  77          HD11      LEU  77  -6.576  -4.066  11.180
  641   HD12  LEU  77          HD12      LEU  77  -5.479  -5.172  11.995
  642   HD13  LEU  77          HD13      LEU  77  -4.877  -4.099  10.733
  643   HD21  LEU  77          HD21      LEU  77  -7.049  -3.646  13.679
  644   HD22  LEU  77          HD22      LEU  77  -7.212  -2.194  12.691
  645   HD23  LEU  77          HD23      LEU  77  -6.317  -2.130  14.208
  646    H    ILE  78           HN       ILE  78  -2.606  -3.070  10.513
  647    HA   ILE  78           HA       ILE  78  -1.283  -0.487  11.248
  648    HB   ILE  78           HB       ILE  78  -1.256  -2.117   8.681
  649   HG12  ILE  78          HG12      ILE  78   0.189  -2.979  10.489
  650   HG13  ILE  78          HG11      ILE  78   1.158  -2.328   9.173
  651   HG21  ILE  78          HG21      ILE  78  -1.242   0.197   8.030
  652   HG22  ILE  78          HG22      ILE  78   0.431  -0.357   7.957
  653   HG23  ILE  78          HG23      ILE  78  -0.117   0.612   9.323
  654   HD11  ILE  78          HD11      ILE  78   0.795  -1.320  11.953
  655   HD12  ILE  78          HD12      ILE  78   0.961  -0.095  10.703
  656   HD13  ILE  78          HD13      ILE  78   2.224  -1.293  10.933
  657    H    ALA  79           HN       ALA  79  -3.673  -1.936   9.058
  658    HA   ALA  79           HA       ALA  79  -5.416   0.375   9.335
  659    HB1  ALA  79           HB1      ALA  79  -5.360   1.143   7.062
  660    HB2  ALA  79           HB2      ALA  79  -4.278  -0.168   6.586
  661    HB3  ALA  79           HB3      ALA  79  -3.695   1.119   7.641
  662    H    ILE  80           HN       ILE  80  -7.426   0.087   8.191
  663    HA   ILE  80           HA       ILE  80  -7.983  -2.686   7.226
  664    HB   ILE  80           HB       ILE  80  -9.652  -1.116   9.226
  665   HG12  ILE  80          HG12      ILE  80  -8.248  -3.786   9.530
  666   HG13  ILE  80          HG11      ILE  80  -7.583  -2.259  10.111
  667   HG21  ILE  80          HG21      ILE  80 -11.102  -2.332   7.708
  668   HG22  ILE  80          HG22      ILE  80 -11.030  -3.227   9.222
  669   HG23  ILE  80          HG23      ILE  80 -10.093  -3.772   7.832
  670   HD11  ILE  80          HD11      ILE  80  -8.863  -3.627  11.841
  671   HD12  ILE  80          HD12      ILE  80 -10.322  -3.263  10.923
  672   HD13  ILE  80          HD13      ILE  80  -9.393  -1.956  11.653
  673    H    GLY  81           HN       GLY  81  -9.597  -2.791   5.641
  674    HA2  GLY  81           HA2      GLY  81 -11.338  -0.622   4.956
  675    HA3  GLY  81           HA1      GLY  81  -9.906  -0.545   3.935
  676    H    PHE  82           HN       PHE  82 -12.355  -0.940   2.809
  677    HA   PHE  82           HA       PHE  82 -12.015  -3.609   1.595
  678    HB2  PHE  82           HB2      PHE  82 -14.361  -4.207   1.818
  679    HB3  PHE  82           HB1      PHE  82 -13.708  -3.899   3.425
  680    HD1  PHE  82           HD2      PHE  82 -14.286  -1.837   4.651
  681    HD2  PHE  82           HD1      PHE  82 -16.001  -2.729   0.815
  682    HE1  PHE  82           HE2      PHE  82 -16.036  -0.123   5.034
  683    HE2  PHE  82           HE1      PHE  82 -17.753  -1.016   1.200
  684    HZ   PHE  82           HZ       PHE  82 -17.770   0.287   3.310
  685    H    ILE  83           HN       ILE  83 -13.036  -3.770  -0.464
  686    HA   ILE  83           HA       ILE  83 -13.470  -1.098  -1.746
  687    HB   ILE  83           HB       ILE  83 -12.849  -3.691  -3.175
  688   HG12  ILE  83          HG12      ILE  83 -10.932  -1.670  -1.971
  689   HG13  ILE  83          HG11      ILE  83 -11.038  -3.385  -1.582
  690   HG21  ILE  83          HG21      ILE  83 -12.204  -0.831  -3.919
  691   HG22  ILE  83          HG22      ILE  83 -13.734  -1.595  -4.352
  692   HG23  ILE  83          HG23      ILE  83 -12.216  -2.247  -4.969
  693   HD11  ILE  83          HD11      ILE  83  -9.221  -3.279  -3.083
  694   HD12  ILE  83          HD12      ILE  83 -10.021  -2.089  -4.110
  695   HD13  ILE  83          HD13      ILE  83 -10.568  -3.768  -4.113
  696    H    ASP  84           HN       ASP  84 -15.465  -0.633  -2.333
  697    HA   ASP  84           HA       ASP  84 -17.551  -2.723  -2.337
  698    HB2  ASP  84           HB2      ASP  84 -19.126  -0.862  -2.452
  699    HB3  ASP  84           HB1      ASP  84 -17.954  -0.575  -1.169
  700    H    GLU  85           HN       GLU  85 -19.337  -2.071  -4.092
  701    HA   GLU  85           HA       GLU  85 -18.333  -2.972  -6.598
  702    HB2  GLU  85           HB2      GLU  85 -20.753  -3.051  -5.599
  703    HB3  GLU  85           HB1      GLU  85 -20.935  -1.452  -6.319
  704    HG2  GLU  85           HG2      GLU  85 -20.036  -3.914  -7.846
  705    HG3  GLU  85           HG1      GLU  85 -21.692  -3.314  -7.824
  706    H    ASN  86           HN       ASN  86 -18.948   0.243  -5.316
  707    HA   ASN  86           HA       ASN  86 -18.619   1.602  -7.874
  708    HB2  ASN  86           HB2      ASN  86 -19.942   2.524  -5.939
  709    HB3  ASN  86           HB1      ASN  86 -18.423   2.770  -5.077
  710   HD21  ASN  86          HD21      ASN  86 -18.413   5.091  -5.124
  711   HD22  ASN  86          HD22      ASN  86 -18.325   5.983  -6.566
  712    H    HIS  87           HN       HIS  87 -16.481  -0.182  -6.388
  713    HA   HIS  87           HA       HIS  87 -14.155  -0.301  -6.314
  714    HB2  HIS  87           HB2      HIS  87 -14.409   0.342  -8.703
  715    HB3  HIS  87           HB1      HIS  87 -14.302   2.040  -8.238
  716    HD1  HIS  87           HD1      HIS  87 -11.998   2.879  -7.289
  717    HD2  HIS  87           HD2      HIS  87 -11.949  -1.045  -8.695
  718    HE1  HIS  87           HE1      HIS  87  -9.561   2.218  -7.481
  719    H    ASP  88           HN       ASP  88 -15.875   2.152  -5.031
  720    HA   ASP  88           HA       ASP  88 -13.861   4.071  -4.299
  721    HB2  ASP  88           HB2      ASP  88 -16.294   4.541  -4.199
  722    HB3  ASP  88           HB1      ASP  88 -16.453   3.382  -2.879
  723    H    MET  89           HN       MET  89 -12.474   4.114  -2.631
  724    HA   MET  89           HA       MET  89 -12.074   1.624  -1.105
  725    HB2  MET  89           HB2      MET  89 -10.470   4.205  -1.173
  726    HB3  MET  89           HB1      MET  89  -9.992   2.729  -0.340
  727    HG2  MET  89           HG2      MET  89 -10.494   2.953  -3.322
  728    HG3  MET  89           HG1      MET  89  -8.905   2.921  -2.566
  729    HE1  MET  89           HE1      MET  89  -9.301   0.499  -0.185
  730    HE2  MET  89           HE2      MET  89  -8.050   1.303  -1.128
  731    HE3  MET  89           HE3      MET  89  -8.276  -0.436  -1.282
  732    H    ASP  90           HN       ASP  90 -12.945   1.335   0.796
  733    HA   ASP  90           HA       ASP  90 -13.864   3.686   2.397
  734    HB2  ASP  90           HB2      ASP  90 -14.717   0.783   2.338
  735    HB3  ASP  90           HB1      ASP  90 -15.227   1.906   3.600
  736    H    PHE  91           HN       PHE  91 -12.527   4.245   3.960
  737    HA   PHE  91           HA       PHE  91 -10.793   2.190   5.270
  738    HB2  PHE  91           HB2      PHE  91 -10.608   5.203   5.041
  739    HB3  PHE  91           HB1      PHE  91  -9.609   4.273   6.159
  740    HD1  PHE  91           HD2      PHE  91  -8.115   2.451   5.264
  741    HD2  PHE  91           HD1      PHE  91 -10.106   5.270   2.708
  742    HE1  PHE  91           HE2      PHE  91  -6.551   1.886   3.425
  743    HE2  PHE  91           HE1      PHE  91  -8.541   4.705   0.867
  744    HZ   PHE  91           HZ       PHE  91  -6.763   3.014   1.227
  745    H    LEU  92           HN       LEU  92 -11.441   1.483   7.175
  746    HA   LEU  92           HA       LEU  92 -13.357   3.099   8.807
  747    HB2  LEU  92           HB2      LEU  92 -12.572   0.185   9.139
  748    HB3  LEU  92           HB1      LEU  92 -13.933   1.020   9.882
  749    HG   LEU  92           HG       LEU  92 -13.577   0.578   6.907
  750   HD11  LEU  92          HD11      LEU  92 -15.541  -0.673   8.854
  751   HD12  LEU  92          HD12      LEU  92 -14.121  -1.488   8.198
  752   HD13  LEU  92          HD13      LEU  92 -15.433  -1.000   7.125
  753   HD21  LEU  92          HD21      LEU  92 -15.622   2.028   8.587
  754   HD22  LEU  92          HD22      LEU  92 -16.084   1.325   7.038
  755   HD23  LEU  92          HD23      LEU  92 -14.831   2.556   7.101
  756    H    TYR  93           HN       TYR  93 -10.117   1.803   8.750
  757    HA   TYR  93           HA       TYR  93  -9.495   3.279  11.218
  758    HB2  TYR  93           HB2      TYR  93 -10.188   1.125  12.133
  759    HB3  TYR  93           HB1      TYR  93  -9.089   0.282  11.039
  760    HD1  TYR  93           HD2      TYR  93  -9.206   2.770  13.821
  761    HD2  TYR  93           HD1      TYR  93  -6.795   0.009  11.581
  762    HE1  TYR  93           HE2      TYR  93  -7.358   3.060  15.451
  763    HE2  TYR  93           HE1      TYR  93  -4.949   0.299  13.210
  764    HH   TYR  93           HH       TYR  93  -5.377   1.777  16.227
  765    H    LEU  94           HN       LEU  94  -7.811   4.412  10.602
  766    HA   LEU  94           HA       LEU  94  -5.711   3.143   8.890
  767    HB2  LEU  94           HB2      LEU  94  -6.908   5.069   7.846
  768    HB3  LEU  94           HB1      LEU  94  -6.388   6.091   9.184
  769    HG   LEU  94           HG       LEU  94  -4.016   5.598   8.604
  770   HD11  LEU  94          HD11      LEU  94  -3.817   4.635   6.143
  771   HD12  LEU  94          HD12      LEU  94  -5.365   3.889   6.524
  772   HD13  LEU  94          HD13      LEU  94  -3.945   3.537   7.511
  773   HD21  LEU  94          HD21      LEU  94  -3.921   7.104   6.764
  774   HD22  LEU  94          HD22      LEU  94  -5.401   7.535   7.616
  775   HD23  LEU  94          HD23      LEU  94  -5.480   6.569   6.143
  776    H    HIS  95           HN       HIS  95  -3.850   2.794   9.875
  777    HA   HIS  95           HA       HIS  95  -2.903   4.626  11.991
  778    HB2  HIS  95           HB2      HIS  95  -4.052   2.906  13.262
  779    HB3  HIS  95           HB1      HIS  95  -3.191   1.641  12.383
  780    HD1  HIS  95           HD1      HIS  95  -0.872   4.321  12.853
  781    HD2  HIS  95           HD2      HIS  95  -2.292   1.262  15.304
  782    HE1  HIS  95           HE1      HIS  95   0.785   4.107  14.758
  783    H    ASN  96           HN       ASN  96  -1.133   5.292  10.969
  784    HA   ASN  96           HA       ASN  96   0.518   3.620   9.284
  785    HB2  ASN  96           HB2      ASN  96   0.273   6.161   9.157
  786    HB3  ASN  96           HB1      ASN  96   1.321   6.237  10.574
  787   HD21  ASN  96          HD21      ASN  96   3.053   7.259   9.323
  788   HD22  ASN  96          HD22      ASN  96   3.968   6.369   8.203
  789    H    THR  97           HN       THR  97   2.854   3.312   9.753
  790    HA   THR  97           HA       THR  97   3.255   1.786  12.117
  791    HB   THR  97           HB       THR  97   5.302   3.035  10.247
  792    HG1  THR  97           HG1      THR  97   3.981   0.534  10.344
  793   HG21  THR  97          HG21      THR  97   5.512   0.933  12.408
  794   HG22  THR  97          HG22      THR  97   6.434   2.430  12.264
  795   HG23  THR  97          HG23      THR  97   6.717   1.106  11.131
  796    H    VAL  98           HN       VAL  98   4.277   5.084  11.273
  797    HA   VAL  98           HA       VAL  98   5.585   5.532  13.832
  798    HB   VAL  98           HB       VAL  98   4.739   7.438  11.620
  799   HG11  VAL  98          HG11      VAL  98   6.315   7.868  14.165
  800   HG12  VAL  98          HG12      VAL  98   4.884   8.741  13.619
  801   HG13  VAL  98          HG13      VAL  98   6.423   8.964  12.789
  802   HG21  VAL  98          HG21      VAL  98   7.205   7.462  11.171
  803   HG22  VAL  98          HG22      VAL  98   6.483   5.871  10.926
  804   HG23  VAL  98          HG23      VAL  98   7.405   6.206  12.391
  805    H    MET  99           HN       MET  99   2.951   7.489  12.424
  806    HA   MET  99           HA       MET  99   1.466   7.234  14.989
  807    HB2  MET  99           HB2      MET  99   1.044   9.635  15.048
  808    HB3  MET  99           HB1      MET  99   2.782   9.337  15.034
  809    HG2  MET  99           HG2      MET  99   2.634   9.606  12.475
  810    HG3  MET  99           HG1      MET  99   1.030  10.281  12.757
  811    HE1  MET  99           HE1      MET  99   1.568  12.813  11.834
  812    HE2  MET  99           HE2      MET  99   2.846  11.771  11.213
  813    HE3  MET  99           HE3      MET  99   3.257  13.335  11.912
  814    HA   PRO 100           HA       PRO 100  -1.968   6.684  12.219
  815    HB2  PRO 100           HB2      PRO 100  -4.048   7.223  13.927
  816    HB3  PRO 100           HB1      PRO 100  -3.094   5.730  14.012
  817    HG2  PRO 100           HG2      PRO 100  -2.871   8.206  15.666
  818    HG3  PRO 100           HG1      PRO 100  -2.769   6.505  16.160
  819    HD2  PRO 100           HD2      PRO 100  -0.557   8.069  15.799
  820    HD3  PRO 100           HD1      PRO 100  -0.555   6.310  15.528
  821    H    LEU 101           HN       LEU 101  -3.278   7.882  10.870
  822    HA   LEU 101           HA       LEU 101  -3.169  10.852  11.213
  823    HB2  LEU 101           HB2      LEU 101  -3.993   9.247   8.769
  824    HB3  LEU 101           HB1      LEU 101  -3.638  10.972   8.842
  825    HG   LEU 101           HG       LEU 101  -1.648   8.752   9.391
  826   HD11  LEU 101          HD11      LEU 101  -1.698  10.712   7.087
  827   HD12  LEU 101          HD12      LEU 101  -2.419   9.105   6.981
  828   HD13  LEU 101          HD13      LEU 101  -0.686   9.279   7.266
  829   HD21  LEU 101          HD21      LEU 101  -0.930  10.593  10.680
  830   HD22  LEU 101          HD22      LEU 101  -1.512  11.768   9.498
  831   HD23  LEU 101          HD23      LEU 101  -0.066  10.817   9.161
  832    H    LEU 102           HN       LEU 102  -5.437   8.308  10.138
  833    HA   LEU 102           HA       LEU 102  -7.698   9.991  11.183
  834    HB2  LEU 102           HB2      LEU 102  -7.752   8.009   8.885
  835    HB3  LEU 102           HB1      LEU 102  -9.079   9.041   9.421
  836    HG   LEU 102           HG       LEU 102  -6.414  10.047   8.377
  837   HD11  LEU 102          HD11      LEU 102  -9.120  10.253   7.045
  838   HD12  LEU 102          HD12      LEU 102  -8.005   8.930   6.709
  839   HD13  LEU 102          HD13      LEU 102  -7.537  10.592   6.347
  840   HD21  LEU 102          HD21      LEU 102  -7.180  11.754   9.777
  841   HD22  LEU 102          HD22      LEU 102  -8.879  11.370   9.501
  842   HD23  LEU 102          HD23      LEU 102  -7.948  12.203   8.259
  843    H    ASP 103           HN       ASP 103  -8.807   9.120  12.770
  844    HA   ASP 103           HA       ASP 103  -9.245   6.222  12.936
  845    HB2  ASP 103           HB2      ASP 103  -8.384   6.043  15.239
  846    HB3  ASP 103           HB1      ASP 103  -7.103   6.472  14.110
  847    H    GLN 104           HN       GLN 104 -11.418   6.626  12.773
  848    HA   GLN 104           HA       GLN 104 -12.691   8.156  15.022
  849    HB2  GLN 104           HB2      GLN 104 -13.575   7.803  12.146
  850    HB3  GLN 104           HB1      GLN 104 -14.624   8.433  13.418
  851    HG2  GLN 104           HG2      GLN 104 -13.028  10.245  13.867
  852    HG3  GLN 104           HG1      GLN 104 -11.944   9.612  12.628
  853   HE21  GLN 104          HE21      GLN 104 -13.615  12.223  12.843
  854   HE22  GLN 104          HE22      GLN 104 -14.431  12.297  11.356
  855    H    ARG 105           HN       ARG 105 -13.572   6.813  16.415
  856    HA   ARG 105           HA       ARG 105 -14.061   4.028  15.941
  857    HB2  ARG 105           HB2      ARG 105 -14.968   5.923  18.127
  858    HB3  ARG 105           HB1      ARG 105 -15.327   4.195  18.144
  859    HG2  ARG 105           HG2      ARG 105 -12.911   3.695  18.021
  860    HG3  ARG 105           HG1      ARG 105 -12.556   5.423  18.028
  861    HD2  ARG 105           HD2      ARG 105 -13.670   5.635  20.226
  862    HD3  ARG 105           HD1      ARG 105 -13.984   3.899  20.228
  863    HE   ARG 105           HE       ARG 105 -11.384   5.194  20.691
  864   HH11  ARG 105          HH21      ARG 105 -13.154   2.316  19.906
  865   HH12  ARG 105          HH22      ARG 105 -11.882   1.255  20.412
  866   HH21  ARG 105          HH11      ARG 105  -9.741   3.814  21.346
  867   HH22  ARG 105          HH12      ARG 105  -9.957   2.100  21.223
  868    H    TYR 106           HN       TYR 106 -16.092   6.904  15.845
  869    HA   TYR 106           HA       TYR 106 -18.650   5.683  15.747
  870    HB2  TYR 106           HB2      TYR 106 -17.776   8.215  14.302
  871    HB3  TYR 106           HB1      TYR 106 -19.423   7.779  14.754
  872    HD1  TYR 106           HD1      TYR 106 -20.027   7.572  17.199
  873    HD2  TYR 106           HD2      TYR 106 -16.292   9.238  15.882
  874    HE1  TYR 106           HE1      TYR 106 -19.704   8.611  19.427
  875    HE2  TYR 106           HE2      TYR 106 -15.968  10.276  18.112
  876    HH   TYR 106           HH       TYR 106 -16.883  10.679  20.105
  877    H    LEU 107           HN       LEU 107 -16.425   6.557  13.114
  878    HA   LEU 107           HA       LEU 107 -18.086   5.643  10.979
  879    HB2  LEU 107           HB2      LEU 107 -16.157   7.136  10.604
  880    HB3  LEU 107           HB1      LEU 107 -15.054   5.870  11.143
  881    HG   LEU 107           HG       LEU 107 -15.775   4.435   9.266
  882   HD11  LEU 107          HD11      LEU 107 -17.992   4.964   8.777
  883   HD12  LEU 107          HD12      LEU 107 -17.164   5.785   7.459
  884   HD13  LEU 107          HD13      LEU 107 -17.710   6.704   8.861
  885   HD21  LEU 107          HD21      LEU 107 -14.724   5.683   7.484
  886   HD22  LEU 107          HD22      LEU 107 -13.908   6.094   8.992
  887   HD23  LEU 107          HD23      LEU 107 -15.074   7.212   8.285
  888    H    LEU 108           HN       LEU 108 -15.612   4.094  12.963
  889    HA   LEU 108           HA       LEU 108 -15.441   1.648  11.518
  890    HB2  LEU 108           HB2      LEU 108 -14.040   2.649  13.587
  891    HB3  LEU 108           HB1      LEU 108 -15.140   1.633  14.516
  892    HG   LEU 108           HG       LEU 108 -13.403   0.701  12.214
  893   HD11  LEU 108          HD11      LEU 108 -13.205   0.314  15.207
  894   HD12  LEU 108          HD12      LEU 108 -12.038   1.113  14.153
  895   HD13  LEU 108          HD13      LEU 108 -12.287  -0.629  14.035
  896   HD21  LEU 108          HD21      LEU 108 -15.543  -0.619  13.872
  897   HD22  LEU 108          HD22      LEU 108 -14.198  -1.586  13.269
  898   HD23  LEU 108          HD23      LEU 108 -15.241  -0.733  12.138
  899    H    THR 109           HN       THR 109 -17.511   2.632  14.242
  900    HA   THR 109           HA       THR 109 -18.980   0.048  14.080
  901    HB   THR 109           HB       THR 109 -20.050   0.727  16.145
  902    HG1  THR 109           HG1      THR 109 -20.033   3.035  15.368
  903   HG21  THR 109          HG21      THR 109 -17.145   1.565  16.308
  904   HG22  THR 109          HG22      THR 109 -17.678  -0.115  16.229
  905   HG23  THR 109          HG23      THR 109 -18.136   0.891  17.603
  906    H    GLY 110           HN       GLY 110 -19.051   3.013  12.619
  907    HA2  GLY 110           HA2      GLY 110 -20.625   3.860  11.090
  908    HA3  GLY 110           HA1      GLY 110 -21.736   2.573  11.558
  909    H    GLY 111           HN       GLY 111 -20.552   5.767  12.346
  910    HA2  GLY 111           HA2      GLY 111 -22.111   6.256  14.686
  911    HA3  GLY 111           HA1      GLY 111 -21.456   7.498  13.622
  912    H    GLN 112           HN       GLN 112 -23.990   7.582  14.876
  913    HA   GLN 112           HA       GLN 112 -26.152   6.805  13.199
  914    HB2  GLN 112           HB2      GLN 112 -25.890   9.053  15.215
  915    HB3  GLN 112           HB1      GLN 112 -27.409   8.624  14.424
  916    HG2  GLN 112           HG2      GLN 112 -27.265   6.349  15.321
  917    HG3  GLN 112           HG1      GLN 112 -25.714   6.725  16.072
  918   HE21  GLN 112          HE21      GLN 112 -28.968   6.489  16.772
  919   HE22  GLN 112          HE22      GLN 112 -29.041   7.537  18.106
  920    H    LEU 113           HN       LEU 113 -27.648   8.613  12.310
  921    HA   LEU 113           HA       LEU 113 -26.127   9.976  10.189
  922    HB2  LEU 113           HB2      LEU 113 -29.068   9.474  10.722
  923    HB3  LEU 113           HB1      LEU 113 -28.549  10.604   9.470
  924    HG   LEU 113           HG       LEU 113 -27.177   8.814   8.440
  925   HD11  LEU 113          HD11      LEU 113 -27.773   6.432   9.247
  926   HD12  LEU 113          HD12      LEU 113 -28.332   7.214  10.726
  927   HD13  LEU 113          HD13      LEU 113 -26.646   7.362  10.234
  928   HD21  LEU 113          HD21      LEU 113 -29.372   9.105   7.516
  929   HD22  LEU 113          HD22      LEU 113 -30.125   8.270   8.874
  930   HD23  LEU 113          HD23      LEU 113 -29.149   7.367   7.716
  931    H    GLU 114           HN       GLU 114 -27.013  10.736  13.290
  932    HA   GLU 114           HA       GLU 114 -26.373  13.522  12.963
  933    HB2  GLU 114           HB2      GLU 114 -28.486  14.543  13.477
  934    HB3  GLU 114           HB1      GLU 114 -28.748  13.460  12.114
  935    HG2  GLU 114           HG2      GLU 114 -30.546  12.905  13.505
  936    HG3  GLU 114           HG1      GLU 114 -29.355  11.692  13.965
  937    H    HIS 115           HN       HIS 115 -25.580  14.249  14.848
  938    HA   HIS 115           HA       HIS 115 -26.533  13.145  17.425
  939    HB2  HIS 115           HB2      HIS 115 -24.687  11.632  16.662
  940    HB3  HIS 115           HB1      HIS 115 -23.605  13.024  16.634
  941    HD1  HIS 115           HD1      HIS 115 -22.566  13.713  18.824
  942    HD2  HIS 115           HD2      HIS 115 -25.758  11.084  19.358
  943    HE1  HIS 115           HE1      HIS 115 -22.605  13.122  21.288
  944    H    HIS 116           HN       HIS 116 -26.027  15.730  15.674
  945    HA   HIS 116           HA       HIS 116 -24.290  17.425  17.205
  946    HB2  HIS 116           HB2      HIS 116 -26.585  17.980  15.308
  947    HB3  HIS 116           HB1      HIS 116 -25.650  19.273  16.060
  948    HD1  HIS 116           HD1      HIS 116 -25.263  16.343  13.695
  949    HD2  HIS 116           HD2      HIS 116 -23.101  19.676  14.954
  950    HE1  HIS 116           HE1      HIS 116 -23.242  16.500  12.177
  951    H    HIS 117           HN       HIS 117 -27.784  16.802  17.323
  952    HA   HIS 117           HA       HIS 117 -27.838  17.934  20.079
  953    HB2  HIS 117           HB2      HIS 117 -29.692  18.734  17.816
  954    HB3  HIS 117           HB1      HIS 117 -29.998  19.092  19.516
  955    HD1  HIS 117           HD1      HIS 117 -27.664  19.946  16.684
  956    HD2  HIS 117           HD2      HIS 117 -28.380  21.139  20.614
  957    HE1  HIS 117           HE1      HIS 117 -26.311  22.056  17.051
  958    H    HIS 118           HN       HIS 118 -29.243  16.918  21.424
  959    HA   HIS 118           HA       HIS 118 -31.289  15.069  20.402
  960    HB2  HIS 118           HB2      HIS 118 -30.308  13.197  21.860
  961    HB3  HIS 118           HB1      HIS 118 -29.468  13.538  20.349
  962    HD1  HIS 118           HD1      HIS 118 -29.235  15.042  23.868
  963    HD2  HIS 118           HD2      HIS 118 -26.769  13.543  20.858
  964    HE1  HIS 118           HE1      HIS 118 -26.854  15.299  24.695
  965    H    HIS 119           HN       HIS 119 -29.828  16.972  22.868
  966    HA   HIS 119           HA       HIS 119 -31.272  16.112  25.172
  967    HB2  HIS 119           HB2      HIS 119 -29.333  17.653  25.263
  968    HB3  HIS 119           HB1      HIS 119 -30.288  18.901  24.463
  969    HD1  HIS 119           HD1      HIS 119 -30.363  16.788  27.632
  970    HD2  HIS 119           HD2      HIS 119 -31.819  20.423  26.202
  971    HE1  HIS 119           HE1      HIS 119 -31.494  17.927  29.592
  972    H    HIS 120           HN       HIS 120 -32.017  18.558  22.708
  973    HA   HIS 120           HA       HIS 120 -33.972  19.828  22.358
  974    HB2  HIS 120           HB2      HIS 120 -35.006  16.994  22.649
  975    HB3  HIS 120           HB1      HIS 120 -35.926  18.325  21.946
  976    HD1  HIS 120           HD1      HIS 120 -35.441  16.128  20.019
  977    HD2  HIS 120           HD2      HIS 120 -32.592  19.113  20.621
  978    HE1  HIS 120           HE1      HIS 120 -33.981  16.154  17.950
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1 -12.002  -5.052  23.304
    2    H2   MET   1           HT2      MET   1 -11.908  -6.309  22.165
    3    H3   MET   1           HT3      MET   1 -13.396  -5.926  22.892
    4    HA   MET   1           HA       MET   1 -13.773  -4.751  21.041
    5    HB2  MET   1           HB2      MET   1 -11.707  -2.942  22.334
    6    HB3  MET   1           HB1      MET   1 -12.976  -2.440  21.216
    7    HG2  MET   1           HG2      MET   1 -13.927  -1.954  23.307
    8    HG3  MET   1           HG1      MET   1 -14.599  -3.545  22.954
    9    HE1  MET   1           HE1      MET   1 -14.178  -2.245  26.152
   10    HE2  MET   1           HE2      MET   1 -14.256  -3.935  26.644
   11    HE3  MET   1           HE3      MET   1 -15.227  -3.375  25.285
   12    H    THR   2           HN       THR   2 -12.625  -6.416  19.707
   13    HA   THR   2           HA       THR   2  -9.953  -5.618  18.699
   14    HB   THR   2           HB       THR   2 -10.163  -7.771  17.399
   15    HG1  THR   2           HG1      THR   2 -11.917  -9.121  18.240
   16   HG21  THR   2          HG21      THR   2 -10.481  -7.761  20.407
   17   HG22  THR   2          HG22      THR   2  -8.984  -7.857  19.478
   18   HG23  THR   2          HG23      THR   2 -10.101  -9.221  19.494
   19    H    LEU   3           HN       LEU   3  -9.638  -4.724  16.715
   20    HA   LEU   3           HA       LEU   3 -11.795  -3.485  15.308
   21    HB2  LEU   3           HB2      LEU   3  -8.884  -3.980  14.722
   22    HB3  LEU   3           HB1      LEU   3  -9.920  -3.311  13.465
   23    HG   LEU   3           HG       LEU   3 -10.556  -1.457  14.931
   24   HD11  LEU   3          HD11      LEU   3  -9.256  -1.246  17.123
   25   HD12  LEU   3          HD12      LEU   3  -8.843  -2.948  16.928
   26   HD13  LEU   3          HD13      LEU   3 -10.531  -2.466  17.093
   27   HD21  LEU   3          HD21      LEU   3  -8.515  -0.260  14.833
   28   HD22  LEU   3          HD22      LEU   3  -8.344  -1.484  13.576
   29   HD23  LEU   3          HD23      LEU   3  -7.550  -1.704  15.136
   30    H    GLU   4           HN       GLU   4  -9.985  -6.477  14.709
   31    HA   GLU   4           HA       GLU   4 -11.084  -7.129  12.181
   32    HB2  GLU   4           HB2      GLU   4  -9.201  -8.341  13.268
   33    HB3  GLU   4           HB1      GLU   4 -10.336  -9.019  14.433
   34    HG2  GLU   4           HG2      GLU   4 -11.573 -10.121  12.623
   35    HG3  GLU   4           HG1      GLU   4 -10.484  -9.408  11.431
   36    H    LEU   5           HN       LEU   5 -12.250  -7.945  15.452
   37    HA   LEU   5           HA       LEU   5 -14.558  -9.398  14.599
   38    HB2  LEU   5           HB2      LEU   5 -13.619  -9.458  16.906
   39    HB3  LEU   5           HB1      LEU   5 -14.155  -7.798  17.145
   40    HG   LEU   5           HG       LEU   5 -16.502  -8.525  16.716
   41   HD11  LEU   5          HD11      LEU   5 -15.107 -11.165  16.328
   42   HD12  LEU   5          HD12      LEU   5 -16.441 -10.461  15.415
   43   HD13  LEU   5          HD13      LEU   5 -16.735 -11.153  17.006
   44   HD21  LEU   5          HD21      LEU   5 -16.664  -9.925  18.858
   45   HD22  LEU   5          HD22      LEU   5 -15.858  -8.363  19.004
   46   HD23  LEU   5          HD23      LEU   5 -14.903  -9.843  18.919
   47    H    GLN   6           HN       GLN   6 -14.105  -5.976  15.471
   48    HA   GLN   6           HA       GLN   6 -16.850  -5.221  15.106
   49    HB2  GLN   6           HB2      GLN   6 -14.295  -3.597  14.977
   50    HB3  GLN   6           HB1      GLN   6 -15.913  -2.894  14.952
   51    HG2  GLN   6           HG2      GLN   6 -16.409  -3.934  17.129
   52    HG3  GLN   6           HG1      GLN   6 -14.797  -4.653  17.158
   53   HE21  GLN   6          HE21      GLN   6 -13.619  -3.474  18.687
   54   HE22  GLN   6          HE22      GLN   6 -13.551  -1.780  18.756
   55    H    LEU   7           HN       LEU   7 -14.094  -5.419  12.908
   56    HA   LEU   7           HA       LEU   7 -15.234  -3.994  10.723
   57    HB2  LEU   7           HB2      LEU   7 -12.854  -4.628  10.810
   58    HB3  LEU   7           HB1      LEU   7 -13.296  -6.330  10.701
   59    HG   LEU   7           HG       LEU   7 -14.272  -5.960   8.477
   60   HD11  LEU   7          HD11      LEU   7 -15.102  -3.772   8.419
   61   HD12  LEU   7          HD12      LEU   7 -13.642  -3.615   7.448
   62   HD13  LEU   7          HD13      LEU   7 -13.641  -3.087   9.132
   63   HD21  LEU   7          HD21      LEU   7 -11.458  -4.949   8.924
   64   HD22  LEU   7          HD22      LEU   7 -12.115  -5.247   7.314
   65   HD23  LEU   7          HD23      LEU   7 -11.964  -6.574   8.465
   66    H    LYS   8           HN       LYS   8 -15.385  -7.437  11.606
   67    HA   LYS   8           HA       LYS   8 -16.871  -8.296   9.317
   68    HB2  LYS   8           HB2      LYS   8 -16.880  -9.395  12.149
   69    HB3  LYS   8           HB1      LYS   8 -17.477 -10.246  10.727
   70    HG2  LYS   8           HG2      LYS   8 -14.644  -9.211  10.852
   71    HG3  LYS   8           HG1      LYS   8 -15.069 -10.781  11.529
   72    HD2  LYS   8           HD2      LYS   8 -16.037 -11.408   9.291
   73    HD3  LYS   8           HD1      LYS   8 -15.402  -9.895   8.646
   74    HE2  LYS   8           HE2      LYS   8 -13.693 -11.976  10.026
   75    HE3  LYS   8           HE1      LYS   8 -13.885 -11.865   8.276
   76    HZ1  LYS   8           HZ1      LYS   8 -12.340 -10.300   8.246
   77    HZ2  LYS   8           HZ2      LYS   8 -12.168 -10.399   9.934
   78    HZ3  LYS   8           HZ3      LYS   8 -13.286  -9.316   9.253
   79    H    HIS   9           HN       HIS   9 -17.886  -7.131  12.512
   80    HA   HIS   9           HA       HIS   9 -20.705  -7.454  12.048
   81    HB2  HIS   9           HB2      HIS   9 -19.089  -5.770  13.967
   82    HB3  HIS   9           HB1      HIS   9 -20.852  -5.716  13.945
   83    HD1  HIS   9           HD1      HIS   9 -17.964  -7.908  14.875
   84    HD2  HIS   9           HD2      HIS   9 -22.126  -8.141  14.799
   85    HE1  HIS   9           HE1      HIS   9 -18.593  -9.973  16.201
   86    H    TYR  10           HN       TYR  10 -18.487  -4.708  11.599
   87    HA   TYR  10           HA       TYR  10 -20.455  -2.769  10.913
   88    HB2  TYR  10           HB2      TYR  10 -18.155  -2.137  11.431
   89    HB3  TYR  10           HB1      TYR  10 -17.569  -3.011  10.016
   90    HD1  TYR  10           HD2      TYR  10 -19.607  -0.126  11.143
   91    HD2  TYR  10           HD1      TYR  10 -17.707  -2.064   7.815
   92    HE1  TYR  10           HE2      TYR  10 -20.002   1.886   9.749
   93    HE2  TYR  10           HE1      TYR  10 -18.101  -0.051   6.419
   94    HH   TYR  10           HH       TYR  10 -20.227   2.184   6.980
   95    H    ILE  11           HN       ILE  11 -18.493  -4.863   8.769
   96    HA   ILE  11           HA       ILE  11 -19.696  -3.939   6.341
   97    HB   ILE  11           HB       ILE  11 -18.321  -6.555   7.020
   98   HG12  ILE  11          HG12      ILE  11 -17.336  -4.159   5.446
   99   HG13  ILE  11          HG11      ILE  11 -17.026  -4.381   7.169
  100   HG21  ILE  11          HG21      ILE  11 -19.297  -5.426   4.385
  101   HG22  ILE  11          HG22      ILE  11 -19.657  -7.004   5.084
  102   HG23  ILE  11          HG23      ILE  11 -18.038  -6.658   4.477
  103   HD11  ILE  11          HD11      ILE  11 -16.292  -6.426   5.060
  104   HD12  ILE  11          HD12      ILE  11 -15.829  -6.437   6.762
  105   HD13  ILE  11          HD13      ILE  11 -15.170  -5.212   5.677
  106    H    THR  12           HN       THR  12 -20.437  -6.716   8.436
  107    HA   THR  12           HA       THR  12 -22.525  -7.779   6.804
  108    HB   THR  12           HB       THR  12 -23.240  -8.903   8.954
  109    HG1  THR  12           HG1      THR  12 -22.286  -8.344  10.776
  110   HG21  THR  12          HG21      THR  12 -21.689 -10.133   7.684
  111   HG22  THR  12          HG22      THR  12 -20.905 -10.011   9.259
  112   HG23  THR  12          HG23      THR  12 -20.401  -8.957   7.941
  113    H    ASN  13           HN       ASN  13 -22.676  -5.576   9.620
  114    HA   ASN  13           HA       ASN  13 -25.530  -5.315   9.570
  115    HB2  ASN  13           HB2      ASN  13 -23.360  -3.499  10.648
  116    HB3  ASN  13           HB1      ASN  13 -25.081  -3.219  10.904
  117   HD21  ASN  13          HD21      ASN  13 -25.655  -6.181  11.106
  118   HD22  ASN  13          HD22      ASN  13 -25.070  -6.643  12.629
  119    H    LEU  14           HN       LEU  14 -22.932  -3.400   8.074
  120    HA   LEU  14           HA       LEU  14 -24.603  -1.333   7.047
  121    HB2  LEU  14           HB2      LEU  14 -22.165  -1.107   7.130
  122    HB3  LEU  14           HB1      LEU  14 -21.986  -2.426   5.975
  123    HG   LEU  14           HG       LEU  14 -23.123  -1.118   4.246
  124   HD11  LEU  14          HD11      LEU  14 -23.494   1.406   4.904
  125   HD12  LEU  14          HD12      LEU  14 -23.591   0.773   6.547
  126   HD13  LEU  14          HD13      LEU  14 -24.724   0.215   5.314
  127   HD21  LEU  14          HD21      LEU  14 -21.387   0.449   3.834
  128   HD22  LEU  14          HD22      LEU  14 -20.630  -0.821   4.795
  129   HD23  LEU  14          HD23      LEU  14 -21.096   0.701   5.555
  130    H    PHE  15           HN       PHE  15 -23.514  -4.388   5.589
  131    HA   PHE  15           HA       PHE  15 -25.303  -3.901   3.260
  132    HB2  PHE  15           HB2      PHE  15 -23.111  -5.902   3.839
  133    HB3  PHE  15           HB1      PHE  15 -24.181  -6.059   2.443
  134    HD1  PHE  15           HD2      PHE  15 -24.244  -4.255   0.710
  135    HD2  PHE  15           HD1      PHE  15 -21.365  -4.255   3.899
  136    HE1  PHE  15           HE2      PHE  15 -22.866  -2.611  -0.534
  137    HE2  PHE  15           HE1      PHE  15 -19.987  -2.610   2.654
  138    HZ   PHE  15           HZ       PHE  15 -20.738  -1.789   0.437
  139    H    ASN  16           HN       ASN  16 -25.531  -5.191   6.294
  140    HA   ASN  16           HA       ASN  16 -27.038  -6.668   7.313
  141    HB2  ASN  16           HB2      ASN  16 -28.603  -5.172   5.973
  142    HB3  ASN  16           HB1      ASN  16 -28.614  -6.430   4.738
  143   HD21  ASN  16          HD21      ASN  16 -30.939  -6.812   5.178
  144   HD22  ASN  16          HD22      ASN  16 -31.417  -7.669   6.562
  145    H    LEU  17           HN       LEU  17 -24.861  -7.908   6.040
  146    HA   LEU  17           HA       LEU  17 -25.914 -10.116   4.420
  147    HB2  LEU  17           HB2      LEU  17 -23.127  -9.589   5.472
  148    HB3  LEU  17           HB1      LEU  17 -23.549 -10.844   4.317
  149    HG   LEU  17           HG       LEU  17 -24.208  -7.940   3.812
  150   HD11  LEU  17          HD11      LEU  17 -22.124  -7.875   2.421
  151   HD12  LEU  17          HD12      LEU  17 -21.665  -9.432   3.110
  152   HD13  LEU  17          HD13      LEU  17 -21.801  -8.014   4.150
  153   HD21  LEU  17          HD21      LEU  17 -25.377  -9.376   2.314
  154   HD22  LEU  17          HD22      LEU  17 -23.983 -10.431   2.111
  155   HD23  LEU  17          HD23      LEU  17 -23.979  -8.821   1.403
  156    HA   PRO  18           HA       PRO  18 -26.729 -13.059   7.654
  157    HB2  PRO  18           HB2      PRO  18 -24.891 -14.947   6.228
  158    HB3  PRO  18           HB1      PRO  18 -26.565 -15.193   6.757
  159    HG2  PRO  18           HG2      PRO  18 -25.898 -14.749   4.179
  160    HG3  PRO  18           HG1      PRO  18 -27.441 -14.229   4.876
  161    HD2  PRO  18           HD2      PRO  18 -25.113 -12.575   4.064
  162    HD3  PRO  18           HD1      PRO  18 -26.818 -12.119   4.273
  163    H    ARG  19           HN       ARG  19 -25.801 -13.203   9.644
  164    HA   ARG  19           HA       ARG  19 -22.885 -12.797   9.925
  165    HB2  ARG  19           HB2      ARG  19 -24.668 -11.578  11.324
  166    HB3  ARG  19           HB1      ARG  19 -24.921 -13.119  12.141
  167    HG2  ARG  19           HG2      ARG  19 -23.317 -12.163  13.532
  168    HG3  ARG  19           HG1      ARG  19 -22.284 -13.062  12.426
  169    HD2  ARG  19           HD2      ARG  19 -22.041 -10.981  11.049
  170    HD3  ARG  19           HD1      ARG  19 -22.975 -10.113  12.259
  171    HE   ARG  19           HE       ARG  19 -21.107 -10.209  13.729
  172   HH11  ARG  19          HH21      ARG  19 -20.702 -12.145  10.895
  173   HH12  ARG  19          HH22      ARG  19 -19.013 -12.415  11.163
  174   HH21  ARG  19          HH11      ARG  19 -18.904 -10.559  14.090
  175   HH22  ARG  19          HH12      ARG  19 -17.997 -11.521  12.970
  176    H    ASP  20           HN       ASP  20 -25.256 -15.312  10.108
  177    HA   ASP  20           HA       ASP  20 -23.580 -17.110  11.709
  178    HB2  ASP  20           HB2      ASP  20 -25.347 -18.792  11.135
  179    HB3  ASP  20           HB1      ASP  20 -26.004 -17.330  11.870
  180    H    GLU  21           HN       GLU  21 -23.182 -15.952   8.720
  181    HA   GLU  21           HA       GLU  21 -22.401 -18.548   7.459
  182    HB2  GLU  21           HB2      GLU  21 -23.825 -17.017   6.132
  183    HB3  GLU  21           HB1      GLU  21 -22.588 -15.766   6.263
  184    HG2  GLU  21           HG2      GLU  21 -20.984 -17.190   5.083
  185    HG3  GLU  21           HG1      GLU  21 -22.167 -18.496   5.013
  186    H    LYS  22           HN       LYS  22 -20.329 -19.116   7.755
  187    HA   LYS  22           HA       LYS  22 -18.299 -17.133   8.531
  188    HB2  LYS  22           HB2      LYS  22 -18.035 -20.108   7.997
  189    HB3  LYS  22           HB1      LYS  22 -16.835 -19.085   8.786
  190    HG2  LYS  22           HG2      LYS  22 -19.646 -19.560   9.827
  191    HG3  LYS  22           HG1      LYS  22 -18.204 -20.389  10.417
  192    HD2  LYS  22           HD2      LYS  22 -17.258 -18.006  10.834
  193    HD3  LYS  22           HD1      LYS  22 -18.931 -17.468  10.670
  194    HE2  LYS  22           HE2      LYS  22 -19.623 -18.998  12.458
  195    HE3  LYS  22           HE1      LYS  22 -17.959 -19.559  12.630
  196    HZ1  LYS  22           HZ1      LYS  22 -17.839 -17.930  14.142
  197    HZ2  LYS  22           HZ2      LYS  22 -19.182 -17.094  13.521
  198    HZ3  LYS  22           HZ3      LYS  22 -17.655 -16.908  12.801
  199    H    TRP  23           HN       TRP  23 -16.555 -16.503   7.265
  200    HA   TRP  23           HA       TRP  23 -16.797 -17.106   4.348
  201    HB2  TRP  23           HB2      TRP  23 -15.151 -14.929   5.653
  202    HB3  TRP  23           HB1      TRP  23 -15.628 -15.049   3.960
  203    HD1  TRP  23           HD1      TRP  23 -18.718 -15.983   4.991
  204    HE1  TRP  23           HE1      TRP  23 -20.307 -14.061   5.620
  205    HE3  TRP  23           HE3      TRP  23 -15.326 -12.238   5.734
  206    HZ2  TRP  23           HZ2      TRP  23 -20.166 -11.302   6.340
  207    HZ3  TRP  23           HZ3      TRP  23 -16.082  -9.974   6.389
  208    HH2  TRP  23           HH2      TRP  23 -18.496  -9.500   6.693
  209    H    GLU  24           HN       GLU  24 -14.469 -16.842   3.276
  210    HA   GLU  24           HA       GLU  24 -12.689 -18.781   4.718
  211    HB2  GLU  24           HB2      GLU  24 -13.043 -18.146   1.778
  212    HB3  GLU  24           HB1      GLU  24 -11.771 -19.198   2.404
  213    HG2  GLU  24           HG2      GLU  24 -13.445 -20.680   3.397
  214    HG3  GLU  24           HG1      GLU  24 -14.741 -19.610   2.862
  215    H    CYS  25           HN       CYS  25 -10.947 -17.876   5.604
  216    HA   CYS  25           HA       CYS  25 -10.048 -15.199   4.805
  217    HB2  CYS  25           HB2      CYS  25  -8.282 -15.726   6.631
  218    HB3  CYS  25           HB1      CYS  25  -9.963 -15.575   7.140
  219    HG   CYS  25           HG       CYS  25  -9.873 -18.373   6.706
  220    H    GLU  26           HN       GLU  26  -8.166 -14.742   3.702
  221    HA   GLU  26           HA       GLU  26  -6.365 -17.004   2.942
  222    HB2  GLU  26           HB2      GLU  26  -7.970 -16.587   1.072
  223    HB3  GLU  26           HB1      GLU  26  -7.423 -14.912   1.011
  224    HG2  GLU  26           HG2      GLU  26  -5.141 -15.648   0.508
  225    HG3  GLU  26           HG1      GLU  26  -5.636 -17.334   0.641
  226    H    SER  27           HN       SER  27  -4.302 -16.444   3.372
  227    HA   SER  27           HA       SER  27  -3.685 -13.645   4.082
  228    HB2  SER  27           HB2      SER  27  -2.894 -15.664   5.415
  229    HB3  SER  27           HB1      SER  27  -1.817 -16.028   4.072
  230    HG   SER  27           HG       SER  27  -1.908 -13.641   5.608
  231    H    ILE  28           HN       ILE  28  -2.841 -12.260   2.619
  232    HA   ILE  28           HA       ILE  28  -1.152 -13.342   0.394
  233    HB   ILE  28           HB       ILE  28  -3.299 -11.216   0.076
  234   HG12  ILE  28          HG12      ILE  28  -3.234 -14.084  -0.912
  235   HG13  ILE  28          HG11      ILE  28  -4.210 -13.508   0.440
  236   HG21  ILE  28          HG21      ILE  28  -2.759 -11.295  -2.265
  237   HG22  ILE  28          HG22      ILE  28  -1.709 -12.694  -2.037
  238   HG23  ILE  28          HG23      ILE  28  -1.228 -11.122  -1.413
  239   HD11  ILE  28          HD11      ILE  28  -5.291 -11.863  -1.113
  240   HD12  ILE  28          HD12      ILE  28  -5.608 -13.544  -1.539
  241   HD13  ILE  28          HD13      ILE  28  -4.415 -12.615  -2.447
  242    H    GLU  29           HN       GLU  29   0.699 -12.184   0.144
  243    HA   GLU  29           HA       GLU  29   1.040  -9.724   1.801
  244    HB2  GLU  29           HB2      GLU  29   3.020 -11.611   0.499
  245    HB3  GLU  29           HB1      GLU  29   3.485 -10.132   1.343
  246    HG2  GLU  29           HG2      GLU  29   2.418 -10.944   3.396
  247    HG3  GLU  29           HG1      GLU  29   1.892 -12.405   2.564
  248    H    GLU  30           HN       GLU  30   1.108  -7.767   0.801
  249    HA   GLU  30           HA       GLU  30   2.016  -7.629  -2.038
  250    HB2  GLU  30           HB2      GLU  30  -0.640  -6.606  -1.011
  251    HB3  GLU  30           HB1      GLU  30   0.077  -6.082  -2.535
  252    HG2  GLU  30           HG2      GLU  30   0.117  -8.407  -3.332
  253    HG3  GLU  30           HG1      GLU  30  -0.565  -8.948  -1.802
  254    H    VAL  31           HN       VAL  31   2.614  -5.482  -2.694
  255    HA   VAL  31           HA       VAL  31   3.905  -3.987  -0.576
  256    HB   VAL  31           HB       VAL  31   3.565  -3.431  -3.529
  257   HG11  VAL  31          HG11      VAL  31   3.929  -1.314  -2.467
  258   HG12  VAL  31          HG12      VAL  31   5.496  -1.828  -3.087
  259   HG13  VAL  31          HG13      VAL  31   5.128  -1.998  -1.370
  260   HG21  VAL  31          HG21      VAL  31   4.914  -5.431  -2.906
  261   HG22  VAL  31          HG22      VAL  31   5.934  -4.403  -1.899
  262   HG23  VAL  31          HG23      VAL  31   5.901  -4.171  -3.647
  263    H    ALA  32           HN       ALA  32   3.204  -2.150   0.432
  264    HA   ALA  32           HA       ALA  32   0.455  -1.439   0.423
  265    HB1  ALA  32           HB1      ALA  32   1.830  -0.845   2.312
  266    HB2  ALA  32           HB2      ALA  32   1.270   0.662   1.588
  267    HB3  ALA  32           HB3      ALA  32   2.915   0.100   1.291
  268    H    ASP  33           HN       ASP  33   3.220   0.070  -1.218
  269    HA   ASP  33           HA       ASP  33   1.828   2.267  -2.354
  270    HB2  ASP  33           HB2      ASP  33   4.333   1.890  -2.323
  271    HB3  ASP  33           HB1      ASP  33   4.109   0.737  -3.639
  272    H    ASP  34           HN       ASP  34   1.273  -0.994  -2.844
  273    HA   ASP  34           HA       ASP  34   0.453  -0.706  -5.692
  274    HB2  ASP  34           HB2      ASP  34   1.732  -2.734  -4.793
  275    HB3  ASP  34           HB1      ASP  34   0.238  -3.180  -3.970
  276    H    ILE  35           HN       ILE  35  -0.993  -1.908  -2.631
  277    HA   ILE  35           HA       ILE  35  -3.694  -1.429  -3.781
  278    HB   ILE  35           HB       ILE  35  -4.461  -2.562  -1.665
  279   HG12  ILE  35          HG12      ILE  35  -1.508  -3.142  -1.292
  280   HG13  ILE  35          HG11      ILE  35  -2.379  -1.917  -0.369
  281   HG21  ILE  35          HG21      ILE  35  -3.992  -3.757  -3.841
  282   HG22  ILE  35          HG22      ILE  35  -3.839  -4.770  -2.406
  283   HG23  ILE  35          HG23      ILE  35  -2.394  -4.152  -3.207
  284   HD11  ILE  35          HD11      ILE  35  -3.879  -3.578   0.546
  285   HD12  ILE  35          HD12      ILE  35  -2.228  -4.146   0.794
  286   HD13  ILE  35          HD13      ILE  35  -3.210  -4.829  -0.501
  287    H    LEU  36           HN       LEU  36  -1.401   0.197  -1.915
  288    HA   LEU  36           HA       LEU  36  -3.501   1.955  -0.727
  289    HB2  LEU  36           HB2      LEU  36  -1.249   0.636   0.502
  290    HB3  LEU  36           HB1      LEU  36  -0.983   2.372   0.589
  291    HG   LEU  36           HG       LEU  36  -2.219   1.577   2.554
  292   HD11  LEU  36          HD11      LEU  36  -2.807   3.793   1.065
  293   HD12  LEU  36          HD12      LEU  36  -3.561   3.430   2.615
  294   HD13  LEU  36          HD13      LEU  36  -4.390   3.020   1.119
  295   HD21  LEU  36          HD21      LEU  36  -3.410  -0.241   0.903
  296   HD22  LEU  36          HD22      LEU  36  -4.689   0.969   0.986
  297   HD23  LEU  36          HD23      LEU  36  -4.079   0.228   2.463
  298    HA   PRO  37           HA       PRO  37  -1.497   4.379  -4.116
  299    HB2  PRO  37           HB2      PRO  37  -3.840   6.112  -3.429
  300    HB3  PRO  37           HB1      PRO  37  -3.266   5.571  -5.020
  301    HG2  PRO  37           HG2      PRO  37  -5.437   4.510  -3.887
  302    HG3  PRO  37           HG1      PRO  37  -4.316   3.523  -4.845
  303    HD2  PRO  37           HD2      PRO  37  -4.651   3.640  -1.868
  304    HD3  PRO  37           HD1      PRO  37  -4.223   2.260  -2.905
  305    H    ASP  38           HN       ASP  38  -0.494   6.491  -4.107
  306    HA   ASP  38           HA       ASP  38   0.768   7.276  -1.732
  307    HB2  ASP  38           HB2      ASP  38   1.274   9.406  -2.913
  308    HB3  ASP  38           HB1      ASP  38   1.557   7.993  -3.929
  309    H    GLN  39           HN       GLN  39  -2.487   7.614  -2.477
  310    HA   GLN  39           HA       GLN  39  -3.217  10.131  -1.449
  311    HB2  GLN  39           HB2      GLN  39  -4.619   7.450  -1.266
  312    HB3  GLN  39           HB1      GLN  39  -5.371   8.972  -0.785
  313    HG2  GLN  39           HG2      GLN  39  -5.076   9.871  -3.035
  314    HG3  GLN  39           HG1      GLN  39  -4.224   8.411  -3.535
  315   HE21  GLN  39          HE21      GLN  39  -6.253   8.642  -5.148
  316   HE22  GLN  39          HE22      GLN  39  -7.629   7.763  -4.679
  317    H    TYR  40           HN       TYR  40  -2.508   7.105   0.281
  318    HA   TYR  40           HA       TYR  40  -2.554   8.645   2.865
  319    HB2  TYR  40           HB2      TYR  40  -3.057   5.702   2.352
  320    HB3  TYR  40           HB1      TYR  40  -3.010   6.457   3.945
  321    HD1  TYR  40           HD1      TYR  40  -4.768   7.994   4.668
  322    HD2  TYR  40           HD2      TYR  40  -4.895   6.124   0.804
  323    HE1  TYR  40           HE1      TYR  40  -7.142   8.660   4.424
  324    HE2  TYR  40           HE2      TYR  40  -7.272   6.788   0.560
  325    HH   TYR  40           HH       TYR  40  -8.769   8.640   1.527
  326    H    VAL  41           HN       VAL  41  -0.544   7.195   0.613
  327    HA   VAL  41           HA       VAL  41   1.553   6.563   2.668
  328    HB   VAL  41           HB       VAL  41   1.224   5.622  -0.197
  329   HG11  VAL  41          HG11      VAL  41   3.573   5.889   0.159
  330   HG12  VAL  41          HG12      VAL  41   3.229   4.180   0.422
  331   HG13  VAL  41          HG13      VAL  41   3.463   5.255   1.801
  332   HG21  VAL  41          HG21      VAL  41   1.096   3.391   0.928
  333   HG22  VAL  41          HG22      VAL  41  -0.234   4.463   1.371
  334   HG23  VAL  41          HG23      VAL  41   1.110   4.219   2.487
  335    H    ARG  42           HN       ARG  42   2.424   8.618   2.934
  336    HA   ARG  42           HA       ARG  42   3.267  10.150   0.532
  337    HB2  ARG  42           HB2      ARG  42   3.206  10.797   3.491
  338    HB3  ARG  42           HB1      ARG  42   3.913  11.874   2.286
  339    HG2  ARG  42           HG2      ARG  42   1.772  11.969   1.087
  340    HG3  ARG  42           HG1      ARG  42   1.054  10.861   2.255
  341    HD2  ARG  42           HD2      ARG  42   1.441  12.496   4.057
  342    HD3  ARG  42           HD1      ARG  42   2.183  13.603   2.901
  343    HE   ARG  42           HE       ARG  42  -0.383  12.971   1.901
  344   HH11  ARG  42          HH21      ARG  42   1.102  14.470   4.632
  345   HH12  ARG  42          HH22      ARG  42  -0.220  15.553   4.920
  346   HH21  ARG  42          HH11      ARG  42  -2.114  14.377   2.263
  347   HH22  ARG  42          HH12      ARG  42  -2.038  15.501   3.580
  348    H    LEU  43           HN       LEU  43   4.897   8.440   0.017
  349    HA   LEU  43           HA       LEU  43   7.030   7.425   0.207
  350    HB2  LEU  43           HB2      LEU  43   7.717  10.312   0.837
  351    HB3  LEU  43           HB1      LEU  43   8.810   9.100   0.170
  352    HG   LEU  43           HG       LEU  43   6.274  10.085  -1.175
  353   HD11  LEU  43          HD11      LEU  43   8.077  11.787  -1.095
  354   HD12  LEU  43          HD12      LEU  43   7.791  11.214  -2.738
  355   HD13  LEU  43          HD13      LEU  43   9.186  10.629  -1.831
  356   HD21  LEU  43          HD21      LEU  43   7.502   8.883  -3.161
  357   HD22  LEU  43          HD22      LEU  43   6.609   7.907  -2.003
  358   HD23  LEU  43          HD23      LEU  43   8.366   8.026  -1.885
  359    H    GLY  44           HN       GLY  44   5.462   7.613   2.764
  360    HA2  GLY  44           HA2      GLY  44   7.529   8.012   4.827
  361    HA3  GLY  44           HA1      GLY  44   5.847   7.557   5.110
  362    HA   PRO  45           HA       PRO  45   8.533   3.807   5.873
  363    HB2  PRO  45           HB2      PRO  45   6.335   3.364   7.852
  364    HB3  PRO  45           HB1      PRO  45   8.092   3.246   8.074
  365    HG2  PRO  45           HG2      PRO  45   6.712   5.301   9.064
  366    HG3  PRO  45           HG1      PRO  45   8.337   5.525   8.387
  367    HD2  PRO  45           HD2      PRO  45   5.676   6.185   7.155
  368    HD3  PRO  45           HD1      PRO  45   7.208   7.087   7.078
  369    H    LEU  46           HN       LEU  46   5.144   4.310   5.229
  370    HA   LEU  46           HA       LEU  46   4.619   1.484   4.604
  371    HB2  LEU  46           HB2      LEU  46   2.905   3.949   4.169
  372    HB3  LEU  46           HB1      LEU  46   2.358   2.275   4.065
  373    HG   LEU  46           HG       LEU  46   3.504   3.593   6.548
  374   HD11  LEU  46          HD11      LEU  46   1.114   3.214   7.368
  375   HD12  LEU  46          HD12      LEU  46   0.682   2.946   5.680
  376   HD13  LEU  46          HD13      LEU  46   1.333   4.505   6.187
  377   HD21  LEU  46          HD21      LEU  46   2.391   1.403   7.531
  378   HD22  LEU  46          HD22      LEU  46   4.000   1.321   6.826
  379   HD23  LEU  46          HD23      LEU  46   2.600   0.792   5.891
  380    H    SER  47           HN       SER  47   6.496   3.506   3.074
  381    HA   SER  47           HA       SER  47   5.541   3.926   0.458
  382    HB2  SER  47           HB2      SER  47   7.920   3.938  -0.208
  383    HB3  SER  47           HB1      SER  47   7.671   4.831   1.289
  384    HG   SER  47           HG       SER  47   9.304   2.826   0.884
  385    H    ASN  48           HN       ASN  48   8.184   1.809   0.206
  386    HA   ASN  48           HA       ASN  48   6.586  -0.103  -1.360
  387    HB2  ASN  48           HB2      ASN  48   8.802   0.700  -2.164
  388    HB3  ASN  48           HB1      ASN  48   9.562  -0.053  -0.763
  389   HD21  ASN  48          HD21      ASN  48  10.774  -1.496  -2.237
  390   HD22  ASN  48          HD22      ASN  48  10.000  -2.817  -2.970
  391    H    LYS  49           HN       LYS  49   6.763   0.190   1.770
  392    HA   LYS  49           HA       LYS  49   7.865  -2.248   2.774
  393    HB2  LYS  49           HB2      LYS  49   7.296  -0.269   4.173
  394    HB3  LYS  49           HB1      LYS  49   5.584  -0.618   3.925
  395    HG2  LYS  49           HG2      LYS  49   5.820  -2.779   5.012
  396    HG3  LYS  49           HG1      LYS  49   7.565  -2.559   5.147
  397    HD2  LYS  49           HD2      LYS  49   7.195  -0.576   6.582
  398    HD3  LYS  49           HD1      LYS  49   5.453  -0.831   6.472
  399    HE2  LYS  49           HE2      LYS  49   7.380  -2.914   7.527
  400    HE3  LYS  49           HE1      LYS  49   6.513  -1.778   8.561
  401    HZ1  LYS  49           HZ1      LYS  49   4.972  -3.391   8.559
  402    HZ2  LYS  49           HZ2      LYS  49   5.531  -4.091   7.114
  403    HZ3  LYS  49           HZ3      LYS  49   4.525  -2.723   7.066
  404    H    ILE  50           HN       ILE  50   7.043  -4.279   2.901
  405    HA   ILE  50           HA       ILE  50   4.565  -4.868   1.434
  406    HB   ILE  50           HB       ILE  50   6.591  -6.655   2.800
  407   HG12  ILE  50          HG12      ILE  50   6.053  -6.199  -0.148
  408   HG13  ILE  50          HG11      ILE  50   7.298  -5.335   0.754
  409   HG21  ILE  50          HG21      ILE  50   4.125  -7.266   1.155
  410   HG22  ILE  50          HG22      ILE  50   4.516  -7.848   2.773
  411   HG23  ILE  50          HG23      ILE  50   5.428  -8.432   1.381
  412   HD11  ILE  50          HD11      ILE  50   7.132  -8.355   0.608
  413   HD12  ILE  50          HD12      ILE  50   8.450  -7.390   1.271
  414   HD13  ILE  50          HD13      ILE  50   8.136  -7.379  -0.464
  415    H    LEU  51           HN       LEU  51   2.628  -5.093   2.398
  416    HA   LEU  51           HA       LEU  51   2.539  -5.484   5.372
  417    HB2  LEU  51           HB2      LEU  51   0.459  -4.243   3.548
  418    HB3  LEU  51           HB1      LEU  51   0.369  -4.355   5.306
  419    HG   LEU  51           HG       LEU  51   2.482  -2.842   3.739
  420   HD11  LEU  51          HD11      LEU  51   1.388  -0.839   4.604
  421   HD12  LEU  51          HD12      LEU  51   0.221  -1.823   5.485
  422   HD13  LEU  51          HD13      LEU  51   0.212  -1.811   3.721
  423   HD21  LEU  51          HD21      LEU  51   3.584  -3.448   5.712
  424   HD22  LEU  51          HD22      LEU  51   2.102  -3.450   6.667
  425   HD23  LEU  51          HD23      LEU  51   2.845  -1.923   6.192
  426    H    GLN  52           HN       GLN  52   1.128  -6.998   6.219
  427    HA   GLN  52           HA       GLN  52   0.515  -9.263   4.489
  428    HB2  GLN  52           HB2      GLN  52  -0.351  -8.801   7.358
  429    HB3  GLN  52           HB1      GLN  52  -0.204 -10.350   6.523
  430    HG2  GLN  52           HG2      GLN  52   2.070  -8.450   7.173
  431    HG3  GLN  52           HG1      GLN  52   1.747  -9.992   7.967
  432   HE21  GLN  52          HE21      GLN  52   1.935 -11.980   6.577
  433   HE22  GLN  52          HE22      GLN  52   2.966 -11.950   5.228
  434    H    THR  53           HN       THR  53  -1.299  -9.322   3.260
  435    HA   THR  53           HA       THR  53  -3.691  -7.737   4.134
  436    HB   THR  53           HB       THR  53  -4.233  -7.440   1.876
  437    HG1  THR  53           HG1      THR  53  -4.217  -9.393   0.996
  438   HG21  THR  53          HG21      THR  53  -1.952  -6.456   2.586
  439   HG22  THR  53          HG22      THR  53  -2.300  -6.539   0.861
  440   HG23  THR  53          HG23      THR  53  -1.246  -7.739   1.606
  441    H    ASN  54           HN       ASN  54  -5.346  -8.906   4.898
  442    HA   ASN  54           HA       ASN  54  -5.565 -11.799   4.133
  443    HB2  ASN  54           HB2      ASN  54  -5.232 -11.334   6.559
  444    HB3  ASN  54           HB1      ASN  54  -6.713 -10.376   6.553
  445   HD21  ASN  54          HD21      ASN  54  -7.696 -11.945   8.073
  446   HD22  ASN  54          HD22      ASN  54  -8.244 -13.450   7.511
  447    H    THR  55           HN       THR  55  -6.938 -11.818   2.407
  448    HA   THR  55           HA       THR  55  -9.343 -10.067   2.435
  449    HB   THR  55           HB       THR  55  -8.278 -11.875   0.251
  450    HG1  THR  55           HG1      THR  55  -7.195 -10.172  -0.441
  451   HG21  THR  55          HG21      THR  55  -9.753 -10.372  -1.161
  452   HG22  THR  55          HG22      THR  55 -10.439  -9.760   0.343
  453   HG23  THR  55          HG23      THR  55 -10.619 -11.463  -0.080
  454    H    TYR  56           HN       TYR  56 -11.408 -10.880   2.518
  455    HA   TYR  56           HA       TYR  56 -11.684 -13.800   3.143
  456    HB2  TYR  56           HB2      TYR  56 -13.481 -11.434   3.754
  457    HB3  TYR  56           HB1      TYR  56 -13.869 -13.112   4.138
  458    HD1  TYR  56           HD2      TYR  56 -11.528 -10.321   4.836
  459    HD2  TYR  56           HD1      TYR  56 -12.832 -14.253   5.972
  460    HE1  TYR  56           HE2      TYR  56 -10.206 -10.156   6.928
  461    HE2  TYR  56           HE1      TYR  56 -11.512 -14.087   8.064
  462    HH   TYR  56           HH       TYR  56  -9.648 -12.881   8.966
  463    H    TYR  57           HN       TYR  57 -12.971 -15.066   1.824
  464    HA   TYR  57           HA       TYR  57 -14.490 -13.684  -0.371
  465    HB2  TYR  57           HB2      TYR  57 -12.744 -16.153  -0.514
  466    HB3  TYR  57           HB1      TYR  57 -13.882 -15.696  -1.782
  467    HD1  TYR  57           HD1      TYR  57 -13.666 -13.395  -2.849
  468    HD2  TYR  57           HD2      TYR  57 -10.610 -15.110  -0.364
  469    HE1  TYR  57           HE1      TYR  57 -12.013 -11.797  -3.778
  470    HE2  TYR  57           HE2      TYR  57  -8.958 -13.511  -1.293
  471    HH   TYR  57           HH       TYR  57  -9.620 -11.587  -4.056
  472    H    SER  58           HN       SER  58 -16.570 -14.158  -0.358
  473    HA   SER  58           HA       SER  58 -17.493 -16.843   0.543
  474    HB2  SER  58           HB2      SER  58 -18.099 -14.231   1.793
  475    HB3  SER  58           HB1      SER  58 -19.501 -15.259   1.519
  476    HG   SER  58           HG       SER  58 -17.274 -15.616   3.153
  477    H    ASP  59           HN       ASP  59 -19.767 -17.234  -0.198
  478    HA   ASP  59           HA       ASP  59 -20.070 -16.611  -2.971
  479    HB2  ASP  59           HB2      ASP  59 -21.056 -18.612  -1.899
  480    HB3  ASP  59           HB1      ASP  59 -22.150 -17.575  -0.985
  481    H    THR  60           HN       THR  60 -21.567 -15.251  -0.051
  482    HA   THR  60           HA       THR  60 -23.420 -13.529  -1.376
  483    HB   THR  60           HB       THR  60 -23.327 -12.233   0.798
  484    HG1  THR  60           HG1      THR  60 -21.491 -14.283   1.470
  485   HG21  THR  60          HG21      THR  60 -24.890 -14.081   0.543
  486   HG22  THR  60          HG22      THR  60 -24.198 -14.130   2.165
  487   HG23  THR  60          HG23      THR  60 -23.620 -15.243   0.925
  488    H    LEU  61           HN       LEU  61 -20.042 -13.064  -0.405
  489    HA   LEU  61           HA       LEU  61 -19.879 -10.278  -1.031
  490    HB2  LEU  61           HB2      LEU  61 -17.890 -12.515  -0.753
  491    HB3  LEU  61           HB1      LEU  61 -17.348 -10.968  -1.397
  492    HG   LEU  61           HG       LEU  61 -18.069  -9.806   0.592
  493   HD11  LEU  61          HD11      LEU  61 -18.972 -11.324   2.524
  494   HD12  LEU  61          HD12      LEU  61 -19.400 -12.435   1.227
  495   HD13  LEU  61          HD13      LEU  61 -20.084 -10.815   1.255
  496   HD21  LEU  61          HD21      LEU  61 -16.738 -12.368   1.506
  497   HD22  LEU  61          HD22      LEU  61 -16.562 -10.760   2.203
  498   HD23  LEU  61          HD23      LEU  61 -15.890 -11.110   0.610
  499    H    HIS  62           HN       HIS  62 -19.322 -13.181  -3.014
  500    HA   HIS  62           HA       HIS  62 -18.369 -11.871  -5.344
  501    HB2  HIS  62           HB2      HIS  62 -20.003 -14.398  -4.990
  502    HB3  HIS  62           HB1      HIS  62 -19.348 -13.886  -6.544
  503    HD1  HIS  62           HD1      HIS  62 -18.379 -15.382  -3.277
  504    HD2  HIS  62           HD2      HIS  62 -16.458 -13.930  -6.679
  505    HE1  HIS  62           HE1      HIS  62 -15.978 -16.177  -3.138
  506    H    LYS  63           HN       LYS  63 -21.685 -12.677  -4.339
  507    HA   LYS  63           HA       LYS  63 -22.986 -11.552  -6.632
  508    HB2  LYS  63           HB2      LYS  63 -23.946 -12.015  -3.794
  509    HB3  LYS  63           HB1      LYS  63 -25.001 -11.505  -5.113
  510    HG2  LYS  63           HG2      LYS  63 -24.409 -13.524  -6.386
  511    HG3  LYS  63           HG1      LYS  63 -23.326 -14.034  -5.089
  512    HD2  LYS  63           HD2      LYS  63 -25.231 -14.129  -3.529
  513    HD3  LYS  63           HD1      LYS  63 -26.317 -13.611  -4.818
  514    HE2  LYS  63           HE2      LYS  63 -25.741 -15.625  -6.119
  515    HE3  LYS  63           HE1      LYS  63 -24.649 -16.144  -4.836
  516    HZ1  LYS  63           HZ1      LYS  63 -26.588 -16.099  -3.316
  517    HZ2  LYS  63           HZ2      LYS  63 -26.718 -17.257  -4.552
  518    HZ3  LYS  63           HZ3      LYS  63 -27.590 -15.803  -4.652
  519    H    SER  64           HN       SER  64 -22.120 -10.210  -3.464
  520    HA   SER  64           HA       SER  64 -23.249  -7.583  -4.130
  521    HB2  SER  64           HB2      SER  64 -21.531  -8.481  -1.799
  522    HB3  SER  64           HB1      SER  64 -22.340  -6.921  -1.928
  523    HG   SER  64           HG       SER  64 -24.018  -7.901  -1.150
  524    H    ASN  65           HN       ASN  65 -20.395  -9.216  -4.844
  525    HA   ASN  65           HA       ASN  65 -18.346  -8.528  -5.740
  526    HB2  ASN  65           HB2      ASN  65 -19.947  -7.244  -7.235
  527    HB3  ASN  65           HB1      ASN  65 -19.698  -5.852  -6.180
  528   HD21  ASN  65          HD21      ASN  65 -18.178  -7.881  -8.631
  529   HD22  ASN  65          HD22      ASN  65 -16.776  -6.939  -8.802
  530    H    ILE  66           HN       ILE  66 -18.664  -8.289  -2.915
  531    HA   ILE  66           HA       ILE  66 -17.093  -5.808  -2.301
  532    HB   ILE  66           HB       ILE  66 -18.746  -7.554  -0.449
  533   HG12  ILE  66          HG12      ILE  66 -19.232  -4.705  -1.370
  534   HG13  ILE  66          HG11      ILE  66 -20.002  -6.110  -2.101
  535   HG21  ILE  66          HG21      ILE  66 -16.976  -5.144  -0.021
  536   HG22  ILE  66          HG22      ILE  66 -17.035  -6.649   0.895
  537   HG23  ILE  66          HG23      ILE  66 -18.326  -5.467   1.065
  538   HD11  ILE  66          HD11      ILE  66 -21.538  -5.258  -0.465
  539   HD12  ILE  66          HD12      ILE  66 -20.268  -5.148   0.753
  540   HD13  ILE  66          HD13      ILE  66 -20.839  -6.727   0.213
  541    H    TYR  67           HN       TYR  67 -15.008  -6.108  -1.690
  542    HA   TYR  67           HA       TYR  67 -14.120  -8.876  -0.917
  543    HB2  TYR  67           HB2      TYR  67 -12.491  -6.809  -2.406
  544    HB3  TYR  67           HB1      TYR  67 -12.077  -8.500  -2.118
  545    HD1  TYR  67           HD1      TYR  67 -13.745 -10.287  -3.012
  546    HD2  TYR  67           HD2      TYR  67 -13.646  -6.213  -4.373
  547    HE1  TYR  67           HE1      TYR  67 -14.956 -10.945  -5.074
  548    HE2  TYR  67           HE2      TYR  67 -14.856  -6.872  -6.434
  549    HH   TYR  67           HH       TYR  67 -16.478  -9.745  -6.771
  550    HA   PRO  68           HA       PRO  68 -13.122  -6.037   2.619
  551    HB2  PRO  68           HB2      PRO  68 -13.305  -8.582   4.133
  552    HB3  PRO  68           HB1      PRO  68 -14.123  -7.038   4.433
  553    HG2  PRO  68           HG2      PRO  68 -15.429  -9.185   3.492
  554    HG3  PRO  68           HG1      PRO  68 -15.865  -7.536   3.009
  555    HD2  PRO  68           HD2      PRO  68 -14.316  -9.600   1.471
  556    HD3  PRO  68           HD1      PRO  68 -15.508  -8.417   0.886
  557    H    PHE  69           HN       PHE  69 -11.097  -5.777   3.629
  558    HA   PHE  69           HA       PHE  69  -9.165  -8.017   3.538
  559    HB2  PHE  69           HB2      PHE  69  -7.458  -6.722   2.378
  560    HB3  PHE  69           HB1      PHE  69  -8.894  -6.835   1.364
  561    HD1  PHE  69           HD1      PHE  69 -10.368  -4.894   1.039
  562    HD2  PHE  69           HD2      PHE  69  -6.782  -4.615   3.388
  563    HE1  PHE  69           HE1      PHE  69 -10.489  -2.420   0.929
  564    HE2  PHE  69           HE2      PHE  69  -6.906  -2.139   3.281
  565    HZ   PHE  69           HZ       PHE  69  -8.759  -1.042   2.051
  566    H    ILE  70           HN       ILE  70  -7.421  -7.735   4.984
  567    HA   ILE  70           HA       ILE  70  -7.638  -5.388   6.845
  568    HB   ILE  70           HB       ILE  70  -7.129  -8.292   7.558
  569   HG12  ILE  70          HG12      ILE  70  -9.390  -6.441   8.375
  570   HG13  ILE  70          HG11      ILE  70  -9.512  -7.604   7.058
  571   HG21  ILE  70          HG21      ILE  70  -6.972  -5.718   9.130
  572   HG22  ILE  70          HG22      ILE  70  -5.788  -7.017   9.031
  573   HG23  ILE  70          HG23      ILE  70  -7.281  -7.257   9.930
  574   HD11  ILE  70          HD11      ILE  70  -9.069  -8.176   9.995
  575   HD12  ILE  70          HD12      ILE  70  -8.821  -9.392   8.740
  576   HD13  ILE  70          HD13      ILE  70 -10.421  -8.691   8.986
  577    H    LEU  71           HN       LEU  71  -5.739  -4.370   7.186
  578    HA   LEU  71           HA       LEU  71  -3.241  -5.637   6.116
  579    HB2  LEU  71           HB2      LEU  71  -3.800  -2.718   6.719
  580    HB3  LEU  71           HB1      LEU  71  -2.391  -3.371   5.880
  581    HG   LEU  71           HG       LEU  71  -5.262  -3.546   4.912
  582   HD11  LEU  71          HD11      LEU  71  -2.903  -1.834   4.108
  583   HD12  LEU  71          HD12      LEU  71  -4.508  -1.303   4.611
  584   HD13  LEU  71          HD13      LEU  71  -4.289  -2.091   3.050
  585   HD21  LEU  71          HD21      LEU  71  -4.215  -5.464   4.043
  586   HD22  LEU  71          HD22      LEU  71  -2.651  -4.660   3.891
  587   HD23  LEU  71          HD23      LEU  71  -3.953  -4.281   2.767
  588    H    TYR  72           HN       TYR  72  -1.747  -6.256   7.575
  589    HA   TYR  72           HA       TYR  72  -1.481  -4.814  10.138
  590    HB2  TYR  72           HB2      TYR  72  -1.661  -6.851  11.482
  591    HB3  TYR  72           HB1      TYR  72  -3.156  -6.587  10.588
  592    HD1  TYR  72           HD1      TYR  72  -3.693  -7.937   8.596
  593    HD2  TYR  72           HD2      TYR  72  -0.197  -8.705  10.965
  594    HE1  TYR  72           HE1      TYR  72  -3.465 -10.160   7.530
  595    HE2  TYR  72           HE2      TYR  72   0.037 -10.932   9.896
  596    HH   TYR  72           HH       TYR  72  -1.048 -12.485   8.633
  597    H    TYR  73           HN       TYR  73   0.495  -5.417  11.273
  598    HA   TYR  73           HA       TYR  73   2.555  -6.570   9.425
  599    HB2  TYR  73           HB2      TYR  73   2.744  -4.098   9.990
  600    HB3  TYR  73           HB1      TYR  73   3.049  -4.587  11.658
  601    HD1  TYR  73           HD1      TYR  73   4.170  -5.478   8.186
  602    HD2  TYR  73           HD2      TYR  73   5.286  -4.887  12.294
  603    HE1  TYR  73           HE1      TYR  73   6.531  -5.940   7.609
  604    HE2  TYR  73           HE2      TYR  73   7.653  -5.342  11.712
  605    HH   TYR  73           HH       TYR  73   9.085  -5.167   9.547
  606    H    GLN  74           HN       GLN  74   4.340  -7.662  10.520
  607    HA   GLN  74           HA       GLN  74   3.449  -9.638  12.352
  608    HB2  GLN  74           HB2      GLN  74   5.940 -10.097  12.636
  609    HB3  GLN  74           HB1      GLN  74   5.335 -10.144  10.981
  610    HG2  GLN  74           HG2      GLN  74   6.109  -7.839  10.617
  611    HG3  GLN  74           HG1      GLN  74   6.700  -7.767  12.277
  612   HE21  GLN  74          HE21      GLN  74   8.866  -7.370  11.127
  613   HE22  GLN  74          HE22      GLN  74   9.754  -8.728  10.627
  614    H    LYS  75           HN       LYS  75   3.494  -6.555  13.121
  615    HA   LYS  75           HA       LYS  75   4.559  -6.971  15.893
  616    HB2  LYS  75           HB2      LYS  75   5.782  -5.242  14.558
  617    HB3  LYS  75           HB1      LYS  75   4.266  -4.357  14.382
  618    HG2  LYS  75           HG2      LYS  75   4.088  -4.130  16.818
  619    HG3  LYS  75           HG1      LYS  75   5.567  -5.070  17.027
  620    HD2  LYS  75           HD2      LYS  75   6.830  -3.363  15.763
  621    HD3  LYS  75           HD1      LYS  75   5.353  -2.416  15.577
  622    HE2  LYS  75           HE2      LYS  75   5.162  -2.203  18.018
  623    HE3  LYS  75           HE1      LYS  75   6.616  -3.179  18.226
  624    HZ1  LYS  75           HZ1      LYS  75   7.801  -1.339  18.021
  625    HZ2  LYS  75           HZ2      LYS  75   6.406  -0.417  17.716
  626    HZ3  LYS  75           HZ3      LYS  75   7.240  -1.153  16.431
  627    H    GLN  76           HN       GLN  76   2.020  -5.445  13.913
  628    HA   GLN  76           HA       GLN  76  -0.046  -6.108  15.797
  629    HB2  GLN  76           HB2      GLN  76  -0.609  -3.806  16.537
  630    HB3  GLN  76           HB1      GLN  76   0.962  -4.328  17.141
  631    HG2  GLN  76           HG2      GLN  76   2.065  -3.129  15.267
  632    HG3  GLN  76           HG1      GLN  76   0.486  -2.568  14.716
  633   HE21  GLN  76          HE21      GLN  76   0.576  -0.345  15.219
  634   HE22  GLN  76          HE22      GLN  76   0.873   0.261  16.777
  635    H    LEU  77           HN       LEU  77  -2.049  -4.505  15.245
  636    HA   LEU  77           HA       LEU  77  -2.655  -4.972  12.472
  637    HB2  LEU  77           HB2      LEU  77  -4.327  -4.822  14.382
  638    HB3  LEU  77           HB1      LEU  77  -4.079  -3.078  14.360
  639    HG   LEU  77           HG       LEU  77  -4.613  -3.343  11.768
  640   HD11  LEU  77          HD11      LEU  77  -6.333  -5.589  12.818
  641   HD12  LEU  77          HD12      LEU  77  -4.731  -5.930  12.176
  642   HD13  LEU  77          HD13      LEU  77  -5.943  -5.173  11.150
  643   HD21  LEU  77          HD21      LEU  77  -5.957  -2.042  13.372
  644   HD22  LEU  77          HD22      LEU  77  -6.743  -3.522  13.917
  645   HD23  LEU  77          HD23      LEU  77  -7.000  -2.944  12.274
  646    H    ILE  78           HN       ILE  78  -2.572  -3.590  10.735
  647    HA   ILE  78           HA       ILE  78  -1.199  -0.973  11.148
  648    HB   ILE  78           HB       ILE  78  -1.512  -2.757   8.717
  649   HG12  ILE  78          HG12      ILE  78   0.204  -3.232  10.646
  650   HG13  ILE  78          HG11      ILE  78   0.752  -3.304   8.976
  651   HG21  ILE  78          HG21      ILE  78  -0.409   0.037   8.991
  652   HG22  ILE  78          HG22      ILE  78  -1.578  -0.573   7.820
  653   HG23  ILE  78          HG23      ILE  78   0.118  -1.040   7.698
  654   HD11  ILE  78          HD11      ILE  78   1.934  -1.299   9.134
  655   HD12  ILE  78          HD12      ILE  78   2.152  -1.958  10.755
  656   HD13  ILE  78          HD13      ILE  78   0.957  -0.699  10.470
  657    H    ALA  79           HN       ALA  79  -3.829  -2.408   9.161
  658    HA   ALA  79           HA       ALA  79  -5.525  -0.094   9.658
  659    HB1  ALA  79           HB1      ALA  79  -3.783   0.619   7.882
  660    HB2  ALA  79           HB2      ALA  79  -5.484   0.928   7.534
  661    HB3  ALA  79           HB3      ALA  79  -4.662  -0.444   6.789
  662    H    ILE  80           HN       ILE  80  -7.635  -0.338   8.658
  663    HA   ILE  80           HA       ILE  80  -8.196  -3.064   7.540
  664    HB   ILE  80           HB       ILE  80 -10.401  -2.872   8.843
  665   HG12  ILE  80          HG12      ILE  80  -8.771  -0.934  10.506
  666   HG13  ILE  80          HG11      ILE  80 -10.005  -0.412   9.360
  667   HG21  ILE  80          HG21      ILE  80  -7.695  -3.329  10.091
  668   HG22  ILE  80          HG22      ILE  80  -8.904  -4.514   9.604
  669   HG23  ILE  80          HG23      ILE  80  -9.168  -3.532  11.041
  670   HD11  ILE  80          HD11      ILE  80 -10.663  -0.774  11.879
  671   HD12  ILE  80          HD12      ILE  80 -10.686  -2.480  11.441
  672   HD13  ILE  80          HD13      ILE  80 -11.750  -1.344  10.613
  673    H    GLY  81           HN       GLY  81  -9.880  -3.120   6.005
  674    HA2  GLY  81           HA2      GLY  81 -11.598  -0.898   5.424
  675    HA3  GLY  81           HA1      GLY  81 -10.198  -0.851   4.351
  676    H    PHE  82           HN       PHE  82 -12.468  -1.192   3.036
  677    HA   PHE  82           HA       PHE  82 -12.263  -3.962   2.056
  678    HB2  PHE  82           HB2      PHE  82 -14.672  -4.408   2.225
  679    HB3  PHE  82           HB1      PHE  82 -13.993  -4.121   3.828
  680    HD1  PHE  82           HD2      PHE  82 -14.388  -1.944   4.977
  681    HD2  PHE  82           HD1      PHE  82 -16.250  -2.908   1.229
  682    HE1  PHE  82           HE2      PHE  82 -16.026  -0.115   5.319
  683    HE2  PHE  82           HE1      PHE  82 -17.889  -1.080   1.572
  684    HZ   PHE  82           HZ       PHE  82 -17.777   0.317   3.618
  685    H    ILE  83           HN       ILE  83 -13.329  -4.223  -0.039
  686    HA   ILE  83           HA       ILE  83 -13.559  -1.603  -1.483
  687    HB   ILE  83           HB       ILE  83 -13.012  -4.395  -2.534
  688   HG12  ILE  83          HG12      ILE  83 -11.189  -1.979  -2.351
  689   HG13  ILE  83          HG11      ILE  83 -11.189  -3.293  -1.174
  690   HG21  ILE  83          HG21      ILE  83 -13.175  -1.685  -3.879
  691   HG22  ILE  83          HG22      ILE  83 -14.169  -3.102  -4.212
  692   HG23  ILE  83          HG23      ILE  83 -12.457  -3.107  -4.637
  693   HD11  ILE  83          HD11      ILE  83 -10.678  -3.609  -4.145
  694   HD12  ILE  83          HD12      ILE  83 -10.646  -4.904  -2.948
  695   HD13  ILE  83          HD13      ILE  83  -9.437  -3.619  -2.891
  696    H    ASP  84           HN       ASP  84 -15.537  -1.010  -2.196
  697    HA   ASP  84           HA       ASP  84 -17.782  -2.931  -1.947
  698    HB2  ASP  84           HB2      ASP  84 -19.210  -0.959  -2.267
  699    HB3  ASP  84           HB1      ASP  84 -18.021  -0.661  -0.999
  700    H    GLU  85           HN       GLU  85 -19.544  -2.397  -3.785
  701    HA   GLU  85           HA       GLU  85 -18.495  -3.510  -6.212
  702    HB2  GLU  85           HB2      GLU  85 -20.760  -3.119  -7.110
  703    HB3  GLU  85           HB1      GLU  85 -20.837  -3.822  -5.495
  704    HG2  GLU  85           HG2      GLU  85 -21.162  -1.557  -4.537
  705    HG3  GLU  85           HG1      GLU  85 -21.140  -0.877  -6.164
  706    H    ASN  86           HN       ASN  86 -18.821  -0.253  -5.067
  707    HA   ASN  86           HA       ASN  86 -18.512   0.900  -7.777
  708    HB2  ASN  86           HB2      ASN  86 -18.734   2.157  -5.025
  709    HB3  ASN  86           HB1      ASN  86 -18.525   3.082  -6.514
  710   HD21  ASN  86          HD21      ASN  86 -20.915   2.937  -4.635
  711   HD22  ASN  86          HD22      ASN  86 -22.217   2.494  -5.629
  712    H    HIS  87           HN       HIS  87 -16.483  -0.677  -5.895
  713    HA   HIS  87           HA       HIS  87 -14.159  -0.798  -5.820
  714    HB2  HIS  87           HB2      HIS  87 -14.459   0.221  -8.207
  715    HB3  HIS  87           HB1      HIS  87 -13.962   1.736  -7.455
  716    HD1  HIS  87           HD1      HIS  87 -12.714  -1.864  -7.689
  717    HD2  HIS  87           HD2      HIS  87 -11.220   2.006  -7.285
  718    HE1  HIS  87           HE1      HIS  87 -10.190  -2.061  -7.756
  719    H    ASP  88           HN       ASP  88 -12.561   1.752  -5.990
  720    HA   ASP  88           HA       ASP  88 -11.632   3.283  -4.499
  721    HB2  ASP  88           HB2      ASP  88 -13.797   4.425  -4.841
  722    HB3  ASP  88           HB1      ASP  88 -14.485   3.509  -3.501
  723    H    MET  89           HN       MET  89 -10.483   3.016  -2.662
  724    HA   MET  89           HA       MET  89 -11.030   0.681  -0.989
  725    HB2  MET  89           HB2      MET  89  -8.899   2.835  -0.828
  726    HB3  MET  89           HB1      MET  89  -8.933   1.379   0.167
  727    HG2  MET  89           HG2      MET  89  -8.871   1.369  -2.862
  728    HG3  MET  89           HG1      MET  89  -7.447   1.167  -1.843
  729    HE1  MET  89           HE1      MET  89  -6.570  -1.185  -1.325
  730    HE2  MET  89           HE2      MET  89  -7.608  -2.160  -0.286
  731    HE3  MET  89           HE3      MET  89  -7.354  -0.456   0.083
  732    H    ASP  90           HN       ASP  90 -12.173   0.716   0.866
  733    HA   ASP  90           HA       ASP  90 -12.934   3.348   2.050
  734    HB2  ASP  90           HB2      ASP  90 -14.679   1.598   1.406
  735    HB3  ASP  90           HB1      ASP  90 -14.053   0.619   2.732
  736    H    PHE  91           HN       PHE  91 -11.519   3.970   3.609
  737    HA   PHE  91           HA       PHE  91 -10.250   1.902   5.350
  738    HB2  PHE  91           HB2      PHE  91  -9.617   4.850   5.021
  739    HB3  PHE  91           HB1      PHE  91  -8.688   3.690   5.973
  740    HD1  PHE  91           HD1      PHE  91  -7.814   1.581   4.739
  741    HD2  PHE  91           HD2      PHE  91  -9.128   5.145   2.733
  742    HE1  PHE  91           HE1      PHE  91  -6.562   0.901   2.709
  743    HE2  PHE  91           HE2      PHE  91  -7.876   4.465   0.703
  744    HZ   PHE  91           HZ       PHE  91  -6.594   2.341   0.691
  745    H    LEU  92           HN       LEU  92 -11.046   1.613   7.356
  746    HA   LEU  92           HA       LEU  92 -12.888   3.674   8.495
  747    HB2  LEU  92           HB2      LEU  92 -12.392   0.802   9.346
  748    HB3  LEU  92           HB1      LEU  92 -13.645   1.874   9.972
  749    HG   LEU  92           HG       LEU  92 -13.397   0.979   7.085
  750   HD11  LEU  92          HD11      LEU  92 -14.068  -0.825   8.661
  751   HD12  LEU  92          HD12      LEU  92 -15.371  -0.388   7.555
  752   HD13  LEU  92          HD13      LEU  92 -15.398   0.187   9.222
  753   HD21  LEU  92          HD21      LEU  92 -14.502   3.047   6.973
  754   HD22  LEU  92          HD22      LEU  92 -15.261   2.844   8.553
  755   HD23  LEU  92          HD23      LEU  92 -15.855   1.936   7.164
  756    H    TYR  93           HN       TYR  93  -9.808   2.129   8.941
  757    HA   TYR  93           HA       TYR  93  -9.125   4.044  11.048
  758    HB2  TYR  93           HB2      TYR  93 -10.150   2.341  12.432
  759    HB3  TYR  93           HB1      TYR  93  -9.255   1.069  11.607
  760    HD1  TYR  93           HD1      TYR  93  -8.683   4.247  13.519
  761    HD2  TYR  93           HD2      TYR  93  -7.225   0.330  12.523
  762    HE1  TYR  93           HE1      TYR  93  -6.809   4.536  15.116
  763    HE2  TYR  93           HE2      TYR  93  -5.352   0.620  14.120
  764    HH   TYR  93           HH       TYR  93  -4.192   3.185  15.142
  765    H    LEU  94           HN       LEU  94  -7.153   4.710  10.407
  766    HA   LEU  94           HA       LEU  94  -5.322   2.753   9.062
  767    HB2  LEU  94           HB2      LEU  94  -5.905   4.618   7.606
  768    HB3  LEU  94           HB1      LEU  94  -5.476   5.775   8.864
  769    HG   LEU  94           HG       LEU  94  -3.134   5.102   8.760
  770   HD11  LEU  94          HD11      LEU  94  -2.561   3.462   6.789
  771   HD12  LEU  94          HD12      LEU  94  -4.233   2.930   6.978
  772   HD13  LEU  94          HD13      LEU  94  -3.104   2.800   8.328
  773   HD21  LEU  94          HD21      LEU  94  -2.601   5.944   6.578
  774   HD22  LEU  94          HD22      LEU  94  -4.097   6.735   7.073
  775   HD23  LEU  94          HD23      LEU  94  -4.144   5.400   5.923
  776    H    HIS  95           HN       HIS  95  -3.534   2.210  10.147
  777    HA   HIS  95           HA       HIS  95  -2.459   4.062  12.230
  778    HB2  HIS  95           HB2      HIS  95  -3.705   2.253  13.354
  779    HB3  HIS  95           HB1      HIS  95  -2.732   1.057  12.499
  780    HD1  HIS  95           HD1      HIS  95  -0.283   3.413  12.962
  781    HD2  HIS  95           HD2      HIS  95  -2.319   1.031  15.710
  782    HE1  HIS  95           HE1      HIS  95   1.189   3.280  15.017
  783    H    ASN  96           HN       ASN  96  -0.522   4.666  11.465
  784    HA   ASN  96           HA       ASN  96   1.034   2.814   9.751
  785    HB2  ASN  96           HB2      ASN  96   1.626   5.675  10.574
  786    HB3  ASN  96           HB1      ASN  96   2.453   4.753   9.317
  787   HD21  ASN  96          HD21      ASN  96   1.236   7.139   8.534
  788   HD22  ASN  96          HD22      ASN  96  -0.160   6.808   7.625
  789    H    THR  97           HN       THR  97   3.113   2.099  10.312
  790    HA   THR  97           HA       THR  97   3.627   1.320  12.941
  791    HB   THR  97           HB       THR  97   6.056   1.167  12.175
  792    HG1  THR  97           HG1      THR  97   6.459   2.483  10.593
  793   HG21  THR  97          HG21      THR  97   4.639  -0.741  11.878
  794   HG22  THR  97          HG22      THR  97   5.467  -0.496  10.340
  795   HG23  THR  97          HG23      THR  97   3.791   0.020  10.533
  796    H    VAL  98           HN       VAL  98   3.855   4.461  11.628
  797    HA   VAL  98           HA       VAL  98   5.640   5.397  13.836
  798    HB   VAL  98           HB       VAL  98   6.356   6.147  11.648
  799   HG11  VAL  98          HG11      VAL  98   4.964   7.279  10.090
  800   HG12  VAL  98          HG12      VAL  98   3.691   7.517  11.277
  801   HG13  VAL  98          HG13      VAL  98   4.003   5.914  10.636
  802   HG21  VAL  98          HG21      VAL  98   4.919   8.477  12.940
  803   HG22  VAL  98          HG22      VAL  98   6.439   8.506  12.046
  804   HG23  VAL  98          HG23      VAL  98   6.366   7.746  13.635
  805    H    MET  99           HN       MET  99   2.547   6.309  12.249
  806    HA   MET  99           HA       MET  99   1.247   6.706  14.777
  807    HB2  MET  99           HB2      MET  99   1.106   9.088  14.898
  808    HB3  MET  99           HB1      MET  99   2.806   8.715  14.659
  809    HG2  MET  99           HG2      MET  99   2.605  10.321  13.013
  810    HG3  MET  99           HG1      MET  99   2.049   8.947  12.063
  811    HE1  MET  99           HE1      MET  99  -0.038  12.380  11.454
  812    HE2  MET  99           HE2      MET  99   1.148  11.308  10.713
  813    HE3  MET  99           HE3      MET  99   1.589  12.248  12.137
  814    HA   PRO 100           HA       PRO 100  -2.137   6.310  11.902
  815    HB2  PRO 100           HB2      PRO 100  -4.231   7.114  13.472
  816    HB3  PRO 100           HB1      PRO 100  -3.400   5.566  13.703
  817    HG2  PRO 100           HG2      PRO 100  -3.029   8.138  15.178
  818    HG3  PRO 100           HG1      PRO 100  -3.135   6.482  15.811
  819    HD2  PRO 100           HD2      PRO 100  -0.748   7.753  15.483
  820    HD3  PRO 100           HD1      PRO 100  -0.922   5.993  15.283
  821    H    LEU 101           HN       LEU 101  -3.289   7.555  10.426
  822    HA   LEU 101           HA       LEU 101  -2.859  10.497  10.574
  823    HB2  LEU 101           HB2      LEU 101  -3.986   8.844   8.293
  824    HB3  LEU 101           HB1      LEU 101  -3.409  10.508   8.214
  825    HG   LEU 101           HG       LEU 101  -1.703   8.092   8.886
  826   HD11  LEU 101          HD11      LEU 101  -2.549   8.397   6.470
  827   HD12  LEU 101          HD12      LEU 101  -0.806   8.255   6.696
  828   HD13  LEU 101          HD13      LEU 101  -1.534   9.839   6.426
  829   HD21  LEU 101          HD21      LEU 101   0.128   9.903   8.427
  830   HD22  LEU 101          HD22      LEU 101  -0.687   9.914   9.989
  831   HD23  LEU 101          HD23      LEU 101  -1.165  11.062   8.737
  832    H    LEU 102           HN       LEU 102  -5.507   8.215   9.802
  833    HA   LEU 102           HA       LEU 102  -7.455  10.236  10.876
  834    HB2  LEU 102           HB2      LEU 102  -7.880   8.254   8.621
  835    HB3  LEU 102           HB1      LEU 102  -9.064   9.417   9.218
  836    HG   LEU 102           HG       LEU 102  -6.379  10.134   8.002
  837   HD11  LEU 102          HD11      LEU 102  -7.564  10.756   6.031
  838   HD12  LEU 102          HD12      LEU 102  -9.127  10.608   6.835
  839   HD13  LEU 102          HD13      LEU 102  -8.187   9.163   6.462
  840   HD21  LEU 102          HD21      LEU 102  -7.674  12.439   7.934
  841   HD22  LEU 102          HD22      LEU 102  -6.883  11.930   9.420
  842   HD23  LEU 102          HD23      LEU 102  -8.626  11.724   9.236
  843    H    ASP 103           HN       ASP 103  -8.843   9.503  12.391
  844    HA   ASP 103           HA       ASP 103  -9.314   6.596  12.719
  845    HB2  ASP 103           HB2      ASP 103  -7.324   7.084  14.115
  846    HB3  ASP 103           HB1      ASP 103  -8.230   8.346  14.950
  847    H    GLN 104           HN       GLN 104 -11.487   7.097  12.154
  848    HA   GLN 104           HA       GLN 104 -12.983   8.824  14.102
  849    HB2  GLN 104           HB2      GLN 104 -13.620   8.024  11.249
  850    HB3  GLN 104           HB1      GLN 104 -14.733   8.900  12.299
  851    HG2  GLN 104           HG2      GLN 104 -11.946   9.858  11.586
  852    HG3  GLN 104           HG1      GLN 104 -13.421  10.410  10.796
  853   HE21  GLN 104          HE21      GLN 104 -11.279  11.331  13.148
  854   HE22  GLN 104          HE22      GLN 104 -12.313  12.242  14.139
  855    H    ARG 105           HN       ARG 105 -13.993   7.653  15.598
  856    HA   ARG 105           HA       ARG 105 -14.492   4.832  15.396
  857    HB2  ARG 105           HB2      ARG 105 -15.597   6.942  17.272
  858    HB3  ARG 105           HB1      ARG 105 -15.884   5.212  17.463
  859    HG2  ARG 105           HG2      ARG 105 -13.479   4.800  17.648
  860    HG3  ARG 105           HG1      ARG 105 -13.145   6.510  17.372
  861    HD2  ARG 105           HD2      ARG 105 -13.059   6.041  19.772
  862    HD3  ARG 105           HD1      ARG 105 -14.448   7.066  19.418
  863    HE   ARG 105           HE       ARG 105 -15.895   5.248  19.944
  864   HH11  ARG 105          HH21      ARG 105 -12.562   4.336  19.824
  865   HH12  ARG 105          HH22      ARG 105 -12.828   2.789  20.554
  866   HH21  ARG 105          HH11      ARG 105 -16.247   3.231  20.894
  867   HH22  ARG 105          HH12      ARG 105 -14.909   2.164  21.157
  868    H    TYR 106           HN       TYR 106 -16.466   7.692  14.779
  869    HA   TYR 106           HA       TYR 106 -19.025   6.528  14.637
  870    HB2  TYR 106           HB2      TYR 106 -18.014   8.603  12.678
  871    HB3  TYR 106           HB1      TYR 106 -19.653   8.407  13.297
  872    HD1  TYR 106           HD2      TYR 106 -20.141   8.907  15.720
  873    HD2  TYR 106           HD1      TYR 106 -16.356   9.806  13.897
  874    HE1  TYR 106           HE2      TYR 106 -19.600  10.442  17.593
  875    HE2  TYR 106           HE1      TYR 106 -15.815  11.338  15.766
  876    HH   TYR 106           HH       TYR 106 -17.958  12.604  17.779
  877    H    LEU 107           HN       LEU 107 -16.622   6.872  12.014
  878    HA   LEU 107           HA       LEU 107 -18.173   5.448  10.061
  879    HB2  LEU 107           HB2      LEU 107 -15.258   6.174  10.332
  880    HB3  LEU 107           HB1      LEU 107 -15.791   5.126   9.016
  881    HG   LEU 107           HG       LEU 107 -17.376   6.833   8.261
  882   HD11  LEU 107          HD11      LEU 107 -18.032   7.898  10.294
  883   HD12  LEU 107          HD12      LEU 107 -17.173   9.133   9.377
  884   HD13  LEU 107          HD13      LEU 107 -16.365   8.302  10.706
  885   HD21  LEU 107          HD21      LEU 107 -15.079   6.944   7.393
  886   HD22  LEU 107          HD22      LEU 107 -14.594   7.937   8.766
  887   HD23  LEU 107          HD23      LEU 107 -15.736   8.570   7.580
  888    H    LEU 108           HN       LEU 108 -15.686   4.419  12.378
  889    HA   LEU 108           HA       LEU 108 -15.429   1.730  11.471
  890    HB2  LEU 108           HB2      LEU 108 -14.067   3.126  13.246
  891    HB3  LEU 108           HB1      LEU 108 -15.223   2.452  14.390
  892    HG   LEU 108           HG       LEU 108 -13.502   0.835  12.490
  893   HD11  LEU 108          HD11      LEU 108 -13.295   1.247  15.486
  894   HD12  LEU 108          HD12      LEU 108 -12.213   1.945  14.282
  895   HD13  LEU 108          HD13      LEU 108 -12.263   0.198  14.516
  896   HD21  LEU 108          HD21      LEU 108 -15.332  -0.553  12.885
  897   HD22  LEU 108          HD22      LEU 108 -15.653   0.134  14.479
  898   HD23  LEU 108          HD23      LEU 108 -14.310  -0.983  14.251
  899    H    THR 109           HN       THR 109 -17.573   3.149  13.949
  900    HA   THR 109           HA       THR 109 -18.983   0.551  14.234
  901    HB   THR 109           HB       THR 109 -19.555   3.177  15.638
  902    HG1  THR 109           HG1      THR 109 -17.527   2.729  16.227
  903   HG21  THR 109          HG21      THR 109 -20.412   1.552  17.392
  904   HG22  THR 109          HG22      THR 109 -20.245   0.282  16.181
  905   HG23  THR 109          HG23      THR 109 -21.358   1.622  15.905
  906    H    GLY 110           HN       GLY 110 -19.182   3.361  12.364
  907    HA2  GLY 110           HA2      GLY 110 -20.781   3.885  10.705
  908    HA3  GLY 110           HA1      GLY 110 -21.771   2.541  11.275
  909    H    GLY 111           HN       GLY 111 -21.072   4.081  14.023
  910    HA2  GLY 111           HA2      GLY 111 -22.420   5.348  15.473
  911    HA3  GLY 111           HA1      GLY 111 -22.372   6.525  14.163
  912    H    GLN 112           HN       GLN 112 -24.581   6.879  15.291
  913    HA   GLN 112           HA       GLN 112 -26.717   5.002  14.740
  914    HB2  GLN 112           HB2      GLN 112 -26.709   7.923  15.546
  915    HB3  GLN 112           HB1      GLN 112 -28.183   6.964  15.381
  916    HG2  GLN 112           HG2      GLN 112 -27.368   5.374  17.058
  917    HG3  GLN 112           HG1      GLN 112 -25.853   6.266  17.195
  918   HE21  GLN 112          HE21      GLN 112 -28.882   5.927  18.623
  919   HE22  GLN 112          HE22      GLN 112 -28.961   7.421  19.423
  920    H    LEU 113           HN       LEU 113 -28.211   5.026  13.080
  921    HA   LEU 113           HA       LEU 113 -27.378   6.272  10.580
  922    HB2  LEU 113           HB2      LEU 113 -29.797   5.262   9.946
  923    HB3  LEU 113           HB1      LEU 113 -28.375   4.236  10.099
  924    HG   LEU 113           HG       LEU 113 -29.976   4.792  12.588
  925   HD11  LEU 113          HD11      LEU 113 -30.784   2.807  10.444
  926   HD12  LEU 113          HD12      LEU 113 -31.706   4.221  10.954
  927   HD13  LEU 113          HD13      LEU 113 -31.463   2.876  12.070
  928   HD21  LEU 113          HD21      LEU 113 -29.100   2.717  13.299
  929   HD22  LEU 113          HD22      LEU 113 -27.776   3.403  12.363
  930   HD23  LEU 113          HD23      LEU 113 -28.804   2.167  11.650
  931    H    GLU 114           HN       GLU 114 -28.241   8.087   9.625
  932    HA   GLU 114           HA       GLU 114 -29.952   9.800  11.294
  933    HB2  GLU 114           HB2      GLU 114 -27.975  10.663   9.992
  934    HB3  GLU 114           HB1      GLU 114 -28.868  10.321   8.512
  935    HG2  GLU 114           HG2      GLU 114 -29.223  12.645   9.038
  936    HG3  GLU 114           HG1      GLU 114 -30.723  11.794   9.397
  937    H    HIS 115           HN       HIS 115 -32.111   9.605  11.192
  938    HA   HIS 115           HA       HIS 115 -33.412   8.318   8.893
  939    HB2  HIS 115           HB2      HIS 115 -35.453   8.511  10.229
  940    HB3  HIS 115           HB1      HIS 115 -34.149   7.879  11.235
  941    HD1  HIS 115           HD1      HIS 115 -32.872   9.751  12.744
  942    HD2  HIS 115           HD2      HIS 115 -36.591  10.848  11.213
  943    HE1  HIS 115           HE1      HIS 115 -33.636  11.756  14.088
  944    H    HIS 116           HN       HIS 116 -32.583  11.483   9.856
  945    HA   HIS 116           HA       HIS 116 -34.770  12.817   8.415
  946    HB2  HIS 116           HB2      HIS 116 -33.720  13.829  10.440
  947    HB3  HIS 116           HB1      HIS 116 -32.204  13.969   9.552
  948    HD1  HIS 116           HD1      HIS 116 -32.132  15.674   7.563
  949    HD2  HIS 116           HD2      HIS 116 -35.689  15.733   9.736
  950    HE1  HIS 116           HE1      HIS 116 -33.354  17.783   6.879
  951    H    HIS 117           HN       HIS 117 -34.691  13.419   6.305
  952    HA   HIS 117           HA       HIS 117 -32.131  12.984   4.803
  953    HB2  HIS 117           HB2      HIS 117 -34.103  11.635   4.089
  954    HB3  HIS 117           HB1      HIS 117 -34.979  13.131   3.763
  955    HD1  HIS 117           HD1      HIS 117 -34.056  14.649   1.808
  956    HD2  HIS 117           HD2      HIS 117 -32.230  10.914   2.119
  957    HE1  HIS 117           HE1      HIS 117 -32.790  14.289  -0.355
  958    H    HIS 118           HN       HIS 118 -31.076  14.893   4.573
  959    HA   HIS 118           HA       HIS 118 -32.604  17.425   4.352
  960    HB2  HIS 118           HB2      HIS 118 -30.606  17.262   5.847
  961    HB3  HIS 118           HB1      HIS 118 -29.606  16.975   4.422
  962    HD1  HIS 118           HD1      HIS 118 -29.554  18.950   2.616
  963    HD2  HIS 118           HD2      HIS 118 -31.223  19.946   6.304
  964    HE1  HIS 118           HE1      HIS 118 -29.639  21.480   2.704
  965    H    HIS 119           HN       HIS 119 -32.944  18.411   2.429
  966    HA   HIS 119           HA       HIS 119 -31.942  17.166  -0.027
  967    HB2  HIS 119           HB2      HIS 119 -34.223  17.946  -0.041
  968    HB3  HIS 119           HB1      HIS 119 -33.736  19.546   0.515
  969    HD1  HIS 119           HD1      HIS 119 -32.674  21.148  -1.212
  970    HD2  HIS 119           HD2      HIS 119 -33.726  17.445  -2.810
  971    HE1  HIS 119           HE1      HIS 119 -32.526  21.387  -3.728
  972    H    HIS 120           HN       HIS 120 -30.174  17.827  -1.135
  973    HA   HIS 120           HA       HIS 120 -29.227  20.613  -0.959
  974    HB2  HIS 120           HB2      HIS 120 -28.126  19.590   0.982
  975    HB3  HIS 120           HB1      HIS 120 -27.522  18.278  -0.030
  976    HD1  HIS 120           HD1      HIS 120 -27.272  22.080   0.202
  977    HD2  HIS 120           HD2      HIS 120 -25.077  18.827  -1.207
  978    HE1  HIS 120           HE1      HIS 120 -25.039  22.999  -0.565
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1 -11.542  -5.073  24.086
    2    H2   MET   1           HT2      MET   1 -10.267  -5.353  22.998
    3    H3   MET   1           HT3      MET   1 -10.926  -6.641  23.892
    4    HA   MET   1           HA       MET   1 -12.823  -6.760  22.635
    5    HB2  MET   1           HB2      MET   1 -12.184  -3.911  21.821
    6    HB3  MET   1           HB1      MET   1 -13.498  -4.861  21.124
    7    HG2  MET   1           HG2      MET   1 -14.514  -5.133  23.334
    8    HG3  MET   1           HG1      MET   1 -13.176  -4.261  24.078
    9    HE1  MET   1           HE1      MET   1 -15.553  -3.773  20.889
   10    HE2  MET   1           HE2      MET   1 -16.682  -2.654  21.645
   11    HE3  MET   1           HE3      MET   1 -16.443  -4.255  22.340
   12    H    THR   2           HN       THR   2 -12.910  -7.657  20.543
   13    HA   THR   2           HA       THR   2 -10.285  -7.765  19.143
   14    HB   THR   2           HB       THR   2 -11.352  -9.702  17.945
   15    HG1  THR   2           HG1      THR   2 -13.527  -8.671  18.746
   16   HG21  THR   2          HG21      THR   2 -11.257 -11.198  19.889
   17   HG22  THR   2          HG22      THR   2 -11.428  -9.816  20.972
   18   HG23  THR   2          HG23      THR   2  -9.976  -9.990  19.986
   19    H    LEU   3           HN       LEU   3 -10.032  -6.355  17.521
   20    HA   LEU   3           HA       LEU   3 -12.149  -4.899  16.242
   21    HB2  LEU   3           HB2      LEU   3  -9.280  -5.432  15.427
   22    HB3  LEU   3           HB1      LEU   3 -10.332  -4.277  14.612
   23    HG   LEU   3           HG       LEU   3  -9.678  -4.190  17.574
   24   HD11  LEU   3          HD11      LEU   3  -7.673  -3.818  16.160
   25   HD12  LEU   3          HD12      LEU   3  -8.147  -2.361  17.031
   26   HD13  LEU   3          HD13      LEU   3  -8.527  -2.525  15.318
   27   HD21  LEU   3          HD21      LEU   3 -11.642  -2.947  17.375
   28   HD22  LEU   3          HD22      LEU   3 -11.303  -2.469  15.713
   29   HD23  LEU   3          HD23      LEU   3 -10.449  -1.696  17.045
   30    H    GLU   4           HN       GLU   4 -10.349  -7.820  15.342
   31    HA   GLU   4           HA       GLU   4 -11.244  -8.140  12.692
   32    HB2  GLU   4           HB2      GLU   4 -10.712 -10.214  14.838
   33    HB3  GLU   4           HB1      GLU   4 -10.949 -10.606  13.135
   34    HG2  GLU   4           HG2      GLU   4  -9.022  -9.214  12.523
   35    HG3  GLU   4           HG1      GLU   4  -8.806  -8.751  14.212
   36    H    LEU   5           HN       LEU   5 -12.772  -9.399  15.675
   37    HA   LEU   5           HA       LEU   5 -15.065 -10.476  14.340
   38    HB2  LEU   5           HB2      LEU   5 -14.448 -11.132  16.635
   39    HB3  LEU   5           HB1      LEU   5 -14.775  -9.495  17.196
   40    HG   LEU   5           HG       LEU   5 -17.139  -9.717  16.559
   41   HD11  LEU   5          HD11      LEU   5 -16.174 -12.338  15.432
   42   HD12  LEU   5          HD12      LEU   5 -17.251 -11.141  14.709
   43   HD13  LEU   5          HD13      LEU   5 -17.841 -12.191  15.992
   44   HD21  LEU   5          HD21      LEU   5 -17.801 -11.225  18.299
   45   HD22  LEU   5          HD22      LEU   5 -16.259 -10.533  18.802
   46   HD23  LEU   5          HD23      LEU   5 -16.317 -12.166  18.139
   47    H    GLN   6           HN       GLN   6 -14.432  -7.348  15.858
   48    HA   GLN   6           HA       GLN   6 -17.058  -6.265  15.575
   49    HB2  GLN   6           HB2      GLN   6 -15.335  -5.266  17.023
   50    HB3  GLN   6           HB1      GLN   6 -14.370  -4.872  15.601
   51    HG2  GLN   6           HG2      GLN   6 -16.050  -3.354  14.786
   52    HG3  GLN   6           HG1      GLN   6 -17.180  -3.846  16.048
   53   HE21  GLN   6          HE21      GLN   6 -16.426  -1.115  15.789
   54   HE22  GLN   6          HE22      GLN   6 -15.474  -0.677  17.127
   55    H    LEU   7           HN       LEU   7 -14.278  -6.352  13.386
   56    HA   LEU   7           HA       LEU   7 -15.309  -4.543  11.433
   57    HB2  LEU   7           HB2      LEU   7 -12.955  -5.351  11.483
   58    HB3  LEU   7           HB1      LEU   7 -13.517  -6.951  11.004
   59    HG   LEU   7           HG       LEU   7 -14.477  -5.956   8.921
   60   HD11  LEU   7          HD11      LEU   7 -14.908  -3.706   9.321
   61   HD12  LEU   7          HD12      LEU   7 -13.405  -3.596   8.416
   62   HD13  LEU   7          HD13      LEU   7 -13.384  -3.451  10.173
   63   HD21  LEU   7          HD21      LEU   7 -12.363  -6.946   8.606
   64   HD22  LEU   7          HD22      LEU   7 -11.532  -5.697   9.534
   65   HD23  LEU   7          HD23      LEU   7 -12.161  -5.333   7.926
   66    H    LYS   8           HN       LYS   8 -15.596  -8.082  11.736
   67    HA   LYS   8           HA       LYS   8 -17.086  -8.480   9.327
   68    HB2  LYS   8           HB2      LYS   8 -17.013 -10.046  11.909
   69    HB3  LYS   8           HB1      LYS   8 -17.829 -10.605  10.450
   70    HG2  LYS   8           HG2      LYS   8 -15.660 -10.371   9.214
   71    HG3  LYS   8           HG1      LYS   8 -14.877  -9.980  10.742
   72    HD2  LYS   8           HD2      LYS   8 -16.482 -12.520  10.407
   73    HD3  LYS   8           HD1      LYS   8 -14.786 -12.443   9.940
   74    HE2  LYS   8           HE2      LYS   8 -15.917 -11.911  12.704
   75    HE3  LYS   8           HE1      LYS   8 -14.935 -13.286  12.214
   76    HZ1  LYS   8           HZ1      LYS   8 -13.269 -12.008  12.960
   77    HZ2  LYS   8           HZ2      LYS   8 -14.142 -10.560  12.795
   78    HZ3  LYS   8           HZ3      LYS   8 -13.390 -11.261  11.442
   79    H    HIS   9           HN       HIS   9 -18.057  -7.734  12.637
   80    HA   HIS   9           HA       HIS   9 -20.899  -7.949  12.107
   81    HB2  HIS   9           HB2      HIS   9 -19.932  -8.154  14.380
   82    HB3  HIS   9           HB1      HIS   9 -19.443  -6.460  14.307
   83    HD1  HIS   9           HD1      HIS   9 -21.058  -5.042  15.554
   84    HD2  HIS   9           HD2      HIS   9 -22.982  -8.188  13.612
   85    HE1  HIS   9           HE1      HIS   9 -23.530  -4.775  16.033
   86    H    TYR  10           HN       TYR  10 -18.589  -5.252  12.321
   87    HA   TYR  10           HA       TYR  10 -20.486  -3.152  11.861
   88    HB2  TYR  10           HB2      TYR  10 -18.251  -2.713  12.763
   89    HB3  TYR  10           HB1      TYR  10 -17.521  -3.268  11.256
   90    HD1  TYR  10           HD1      TYR  10 -19.493  -0.599  12.853
   91    HD2  TYR  10           HD2      TYR  10 -17.621  -1.922   9.222
   92    HE1  TYR  10           HE1      TYR  10 -19.770   1.667  11.886
   93    HE2  TYR  10           HE2      TYR  10 -17.896   0.345   8.253
   94    HH   TYR  10           HH       TYR  10 -19.919   2.507   9.190
   95    H    ILE  11           HN       ILE  11 -18.261  -4.815   9.596
   96    HA   ILE  11           HA       ILE  11 -19.130  -3.391   7.271
   97    HB   ILE  11           HB       ILE  11 -17.040  -4.831   7.513
   98   HG12  ILE  11          HG12      ILE  11 -18.773  -5.564   5.138
   99   HG13  ILE  11          HG11      ILE  11 -18.006  -3.985   5.316
  100   HG21  ILE  11          HG21      ILE  11 -18.426  -6.770   8.464
  101   HG22  ILE  11          HG22      ILE  11 -17.200  -7.194   7.278
  102   HG23  ILE  11          HG23      ILE  11 -18.897  -7.110   6.805
  103   HD11  ILE  11          HD11      ILE  11 -15.797  -5.198   5.575
  104   HD12  ILE  11          HD12      ILE  11 -16.533  -5.336   3.978
  105   HD13  ILE  11          HD13      ILE  11 -16.639  -6.678   5.116
  106    H    THR  12           HN       THR  12 -20.241  -6.411   8.764
  107    HA   THR  12           HA       THR  12 -22.061  -7.204   6.715
  108    HB   THR  12           HB       THR  12 -23.232  -8.350   8.731
  109    HG1  THR  12           HG1      THR  12 -21.179  -8.200  10.336
  110   HG21  THR  12          HG21      THR  12 -21.074  -9.790   9.116
  111   HG22  THR  12          HG22      THR  12 -20.386  -8.785   7.841
  112   HG23  THR  12          HG23      THR  12 -21.815  -9.766   7.517
  113    H    ASN  13           HN       ASN  13 -22.552  -5.184   9.613
  114    HA   ASN  13           HA       ASN  13 -25.354  -4.749   9.191
  115    HB2  ASN  13           HB2      ASN  13 -23.238  -3.148  10.649
  116    HB3  ASN  13           HB1      ASN  13 -24.949  -2.728  10.670
  117   HD21  ASN  13          HD21      ASN  13 -25.563  -5.788  10.573
  118   HD22  ASN  13          HD22      ASN  13 -25.335  -6.282  12.178
  119    H    LEU  14           HN       LEU  14 -22.461  -3.105   8.029
  120    HA   LEU  14           HA       LEU  14 -23.732  -0.781   6.993
  121    HB2  LEU  14           HB2      LEU  14 -21.174  -1.531   7.218
  122    HB3  LEU  14           HB1      LEU  14 -21.400  -2.000   5.542
  123    HG   LEU  14           HG       LEU  14 -20.569   0.257   5.552
  124   HD11  LEU  14          HD11      LEU  14 -23.535   0.588   5.104
  125   HD12  LEU  14          HD12      LEU  14 -22.541  -0.398   4.028
  126   HD13  LEU  14          HD13      LEU  14 -22.199   1.318   4.216
  127   HD21  LEU  14          HD21      LEU  14 -21.238   1.939   6.983
  128   HD22  LEU  14          HD22      LEU  14 -21.651   0.572   8.010
  129   HD23  LEU  14          HD23      LEU  14 -22.904   1.378   7.067
  130    H    PHE  15           HN       PHE  15 -23.065  -3.933   5.456
  131    HA   PHE  15           HA       PHE  15 -24.669  -3.098   3.082
  132    HB2  PHE  15           HB2      PHE  15 -22.858  -5.478   3.597
  133    HB3  PHE  15           HB1      PHE  15 -23.774  -5.240   2.110
  134    HD1  PHE  15           HD2      PHE  15 -23.312  -3.235   0.666
  135    HD2  PHE  15           HD1      PHE  15 -20.845  -4.236   4.039
  136    HE1  PHE  15           HE2      PHE  15 -21.521  -1.757  -0.204
  137    HE2  PHE  15           HE1      PHE  15 -19.054  -2.756   3.166
  138    HZ   PHE  15           HZ       PHE  15 -19.392  -1.517   1.045
  139    H    ASN  16           HN       ASN  16 -25.290  -4.304   6.020
  140    HA   ASN  16           HA       ASN  16 -27.001  -5.582   6.956
  141    HB2  ASN  16           HB2      ASN  16 -28.190  -4.953   4.242
  142    HB3  ASN  16           HB1      ASN  16 -29.075  -5.841   5.482
  143   HD21  ASN  16          HD21      ASN  16 -29.983  -3.268   4.627
  144   HD22  ASN  16          HD22      ASN  16 -29.769  -2.170   5.905
  145    H    LEU  17           HN       LEU  17 -24.796  -7.003   5.682
  146    HA   LEU  17           HA       LEU  17 -26.097  -9.351   4.432
  147    HB2  LEU  17           HB2      LEU  17 -23.175  -8.782   4.990
  148    HB3  LEU  17           HB1      LEU  17 -23.787 -10.136   4.048
  149    HG   LEU  17           HG       LEU  17 -24.414  -7.262   3.347
  150   HD11  LEU  17          HD11      LEU  17 -22.177  -8.984   2.242
  151   HD12  LEU  17          HD12      LEU  17 -21.954  -7.634   3.354
  152   HD13  LEU  17          HD13      LEU  17 -22.586  -7.345   1.733
  153   HD21  LEU  17          HD21      LEU  17 -25.903  -8.761   2.230
  154   HD22  LEU  17          HD22      LEU  17 -24.615  -9.920   1.904
  155   HD23  LEU  17          HD23      LEU  17 -24.658  -8.384   1.045
  156    HA   PRO  18           HA       PRO  18 -26.185 -11.634   8.253
  157    HB2  PRO  18           HB2      PRO  18 -25.949 -14.217   7.292
  158    HB3  PRO  18           HB1      PRO  18 -27.444 -13.266   7.210
  159    HG2  PRO  18           HG2      PRO  18 -25.398 -13.756   5.093
  160    HG3  PRO  18           HG1      PRO  18 -27.166 -13.702   4.962
  161    HD2  PRO  18           HD2      PRO  18 -25.587 -11.616   4.206
  162    HD3  PRO  18           HD1      PRO  18 -27.220 -11.378   4.857
  163    H    ARG  19           HN       ARG  19 -24.727 -12.346   9.784
  164    HA   ARG  19           HA       ARG  19 -21.886 -12.618   8.953
  165    HB2  ARG  19           HB2      ARG  19 -21.429 -12.418  11.392
  166    HB3  ARG  19           HB1      ARG  19 -22.361 -11.052  10.776
  167    HG2  ARG  19           HG2      ARG  19 -24.443 -12.098  11.581
  168    HG3  ARG  19           HG1      ARG  19 -23.520 -13.472  12.193
  169    HD2  ARG  19           HD2      ARG  19 -23.061 -10.608  13.075
  170    HD3  ARG  19           HD1      ARG  19 -24.066 -11.759  13.956
  171    HE   ARG  19           HE       ARG  19 -21.572 -13.012  13.565
  172   HH11  ARG  19          HH21      ARG  19 -22.877 -10.211  15.114
  173   HH12  ARG  19          HH22      ARG  19 -21.684 -10.196  16.369
  174   HH21  ARG  19          HH11      ARG  19 -20.022 -13.000  15.193
  175   HH22  ARG  19          HH12      ARG  19 -20.070 -11.773  16.416
  176    H    ASP  20           HN       ASP  20 -24.490 -14.612   9.376
  177    HA   ASP  20           HA       ASP  20 -23.143 -16.784  10.816
  178    HB2  ASP  20           HB2      ASP  20 -25.762 -16.619   9.295
  179    HB3  ASP  20           HB1      ASP  20 -25.203 -18.080  10.110
  180    H    GLU  21           HN       GLU  21 -22.780 -15.517   7.789
  181    HA   GLU  21           HA       GLU  21 -22.617 -18.019   6.278
  182    HB2  GLU  21           HB2      GLU  21 -21.745 -15.189   5.617
  183    HB3  GLU  21           HB1      GLU  21 -21.683 -16.540   4.484
  184    HG2  GLU  21           HG2      GLU  21 -24.199 -15.586   5.879
  185    HG3  GLU  21           HG1      GLU  21 -23.749 -15.157   4.228
  186    H    LYS  22           HN       LYS  22 -20.779 -19.181   5.829
  187    HA   LYS  22           HA       LYS  22 -18.499 -18.820   7.569
  188    HB2  LYS  22           HB2      LYS  22 -19.328 -21.029   6.754
  189    HB3  LYS  22           HB1      LYS  22 -18.757 -20.603   5.139
  190    HG2  LYS  22           HG2      LYS  22 -16.471 -20.414   5.941
  191    HG3  LYS  22           HG1      LYS  22 -16.996 -20.666   7.603
  192    HD2  LYS  22           HD2      LYS  22 -16.187 -22.786   6.892
  193    HD3  LYS  22           HD1      LYS  22 -17.941 -22.912   6.814
  194    HE2  LYS  22           HE2      LYS  22 -17.953 -22.671   4.439
  195    HE3  LYS  22           HE1      LYS  22 -16.273 -22.135   4.409
  196    HZ1  LYS  22           HZ1      LYS  22 -15.763 -24.253   4.056
  197    HZ2  LYS  22           HZ2      LYS  22 -17.332 -24.787   4.432
  198    HZ3  LYS  22           HZ3      LYS  22 -16.193 -24.553   5.670
  199    H    TRP  23           HN       TRP  23 -16.606 -17.788   7.171
  200    HA   TRP  23           HA       TRP  23 -16.246 -16.484   4.503
  201    HB2  TRP  23           HB2      TRP  23 -15.398 -15.850   7.321
  202    HB3  TRP  23           HB1      TRP  23 -14.415 -15.240   5.989
  203    HD1  TRP  23           HD1      TRP  23 -18.168 -15.582   5.529
  204    HE1  TRP  23           HE1      TRP  23 -19.205 -13.233   5.344
  205    HE3  TRP  23           HE3      TRP  23 -14.110 -12.744   6.744
  206    HZ2  TRP  23           HZ2      TRP  23 -18.412 -10.503   5.667
  207    HZ3  TRP  23           HZ3      TRP  23 -14.274 -10.273   6.797
  208    HH2  TRP  23           HH2      TRP  23 -16.418  -9.150   6.261
  209    H    GLU  24           HN       GLU  24 -14.225 -16.671   3.424
  210    HA   GLU  24           HA       GLU  24 -12.570 -19.014   4.310
  211    HB2  GLU  24           HB2      GLU  24 -13.727 -19.111   2.065
  212    HB3  GLU  24           HB1      GLU  24 -12.721 -17.754   1.563
  213    HG2  GLU  24           HG2      GLU  24 -11.613 -19.761   0.832
  214    HG3  GLU  24           HG1      GLU  24 -10.701 -19.138   2.207
  215    H    CYS  25           HN       CYS  25 -10.703 -18.430   5.222
  216    HA   CYS  25           HA       CYS  25  -9.644 -15.730   4.952
  217    HB2  CYS  25           HB2      CYS  25  -7.829 -16.623   6.439
  218    HB3  CYS  25           HB1      CYS  25  -9.452 -16.863   7.086
  219    HG   CYS  25           HG       CYS  25  -7.638 -19.111   5.942
  220    H    GLU  26           HN       GLU  26  -8.284 -15.079   3.380
  221    HA   GLU  26           HA       GLU  26  -6.455 -17.092   2.116
  222    HB2  GLU  26           HB2      GLU  26  -8.358 -16.531   0.596
  223    HB3  GLU  26           HB1      GLU  26  -7.893 -14.831   0.690
  224    HG2  GLU  26           HG2      GLU  26  -5.696 -15.350  -0.240
  225    HG3  GLU  26           HG1      GLU  26  -6.086 -17.068  -0.270
  226    H    SER  27           HN       SER  27  -4.493 -16.479   2.888
  227    HA   SER  27           HA       SER  27  -3.917 -13.591   3.289
  228    HB2  SER  27           HB2      SER  27  -3.388 -15.046   5.155
  229    HB3  SER  27           HB1      SER  27  -2.433 -16.094   4.111
  230    HG   SER  27           HG       SER  27  -0.970 -14.757   5.005
  231    H    ILE  28           HN       ILE  28  -2.705 -12.479   1.864
  232    HA   ILE  28           HA       ILE  28  -0.744 -13.943   0.156
  233    HB   ILE  28           HB       ILE  28  -1.460 -12.579  -1.801
  234   HG12  ILE  28          HG12      ILE  28  -3.840 -11.861  -0.060
  235   HG13  ILE  28          HG11      ILE  28  -2.533 -10.748  -0.470
  236   HG21  ILE  28          HG21      ILE  28  -2.300 -14.899  -1.379
  237   HG22  ILE  28          HG22      ILE  28  -3.415 -13.909  -2.320
  238   HG23  ILE  28          HG23      ILE  28  -3.718 -14.197  -0.608
  239   HD11  ILE  28          HD11      ILE  28  -3.036 -11.192  -2.906
  240   HD12  ILE  28          HD12      ILE  28  -4.321 -10.352  -2.038
  241   HD13  ILE  28          HD13      ILE  28  -4.468 -12.076  -2.382
  242    H    GLU  29           HN       GLU  29   1.052 -12.631  -0.470
  243    HA   GLU  29           HA       GLU  29   1.405 -10.252   1.286
  244    HB2  GLU  29           HB2      GLU  29   3.104 -12.108   1.245
  245    HB3  GLU  29           HB1      GLU  29   3.463 -11.662  -0.424
  246    HG2  GLU  29           HG2      GLU  29   4.115  -9.427   0.254
  247    HG3  GLU  29           HG1      GLU  29   3.620  -9.747   1.917
  248    H    GLU  30           HN       GLU  30   1.249  -8.235   0.448
  249    HA   GLU  30           HA       GLU  30   1.924  -7.799  -2.421
  250    HB2  GLU  30           HB2      GLU  30  -0.534  -8.154  -2.318
  251    HB3  GLU  30           HB1      GLU  30  -0.660  -6.848  -1.137
  252    HG2  GLU  30           HG2      GLU  30   0.218  -5.245  -2.753
  253    HG3  GLU  30           HG1      GLU  30   0.487  -6.532  -3.928
  254    H    VAL  31           HN       VAL  31   2.431  -5.567  -2.874
  255    HA   VAL  31           HA       VAL  31   3.757  -4.243  -0.691
  256    HB   VAL  31           HB       VAL  31   3.165  -3.144  -3.442
  257   HG11  VAL  31          HG11      VAL  31   5.116  -1.755  -3.037
  258   HG12  VAL  31          HG12      VAL  31   5.432  -2.572  -1.507
  259   HG13  VAL  31          HG13      VAL  31   4.008  -1.549  -1.682
  260   HG21  VAL  31          HG21      VAL  31   4.258  -5.236  -3.796
  261   HG22  VAL  31          HG22      VAL  31   5.320  -5.002  -2.408
  262   HG23  VAL  31          HG23      VAL  31   5.545  -4.032  -3.863
  263    H    ALA  32           HN       ALA  32   3.117  -2.518   0.523
  264    HA   ALA  32           HA       ALA  32   0.353  -1.906   0.828
  265    HB1  ALA  32           HB1      ALA  32   2.899  -0.565   1.731
  266    HB2  ALA  32           HB2      ALA  32   1.744  -1.487   2.694
  267    HB3  ALA  32           HB3      ALA  32   1.322   0.123   2.115
  268    H    ASP  33           HN       ASP  33   2.909  -0.274  -1.039
  269    HA   ASP  33           HA       ASP  33   1.298   2.038  -1.661
  270    HB2  ASP  33           HB2      ASP  33   3.031   2.629  -3.213
  271    HB3  ASP  33           HB1      ASP  33   3.820   1.906  -1.813
  272    H    ASP  34           HN       ASP  34   0.952  -1.140  -2.605
  273    HA   ASP  34           HA       ASP  34  -0.074  -0.510  -5.324
  274    HB2  ASP  34           HB2      ASP  34   1.294  -2.568  -4.931
  275    HB3  ASP  34           HB1      ASP  34   0.027  -3.161  -3.857
  276    H    ILE  35           HN       ILE  35  -1.163  -1.053  -2.081
  277    HA   ILE  35           HA       ILE  35  -4.018  -1.154  -3.015
  278    HB   ILE  35           HB       ILE  35  -4.404  -2.019  -0.623
  279   HG12  ILE  35          HG12      ILE  35  -1.478  -2.755  -0.780
  280   HG13  ILE  35          HG11      ILE  35  -2.008  -1.283   0.033
  281   HG21  ILE  35          HG21      ILE  35  -2.920  -3.570  -2.743
  282   HG22  ILE  35          HG22      ILE  35  -4.650  -3.564  -2.404
  283   HG23  ILE  35          HG23      ILE  35  -3.535  -4.341  -1.281
  284   HD11  ILE  35          HD11      ILE  35  -1.763  -3.456   1.451
  285   HD12  ILE  35          HD12      ILE  35  -3.284  -3.935   0.699
  286   HD13  ILE  35          HD13      ILE  35  -3.205  -2.466   1.672
  287    H    LEU  36           HN       LEU  36  -1.631   0.534  -1.122
  288    HA   LEU  36           HA       LEU  36  -3.729   2.390  -0.103
  289    HB2  LEU  36           HB2      LEU  36  -0.921   1.884   0.835
  290    HB3  LEU  36           HB1      LEU  36  -1.957   3.159   1.467
  291    HG   LEU  36           HG       LEU  36  -3.056   0.359   1.369
  292   HD11  LEU  36          HD11      LEU  36  -0.988  -0.124   2.414
  293   HD12  LEU  36          HD12      LEU  36  -2.128   0.098   3.738
  294   HD13  LEU  36          HD13      LEU  36  -1.002   1.386   3.324
  295   HD21  LEU  36          HD21      LEU  36  -4.342   1.114   3.267
  296   HD22  LEU  36          HD22      LEU  36  -4.401   2.409   2.075
  297   HD23  LEU  36          HD23      LEU  36  -3.327   2.540   3.464
  298    HA   PRO  37           HA       PRO  37  -2.227   4.898  -3.646
  299    HB2  PRO  37           HB2      PRO  37  -3.938   6.854  -2.140
  300    HB3  PRO  37           HB1      PRO  37  -3.873   6.530  -3.883
  301    HG2  PRO  37           HG2      PRO  37  -5.852   5.581  -2.381
  302    HG3  PRO  37           HG1      PRO  37  -5.163   4.620  -3.705
  303    HD2  PRO  37           HD2      PRO  37  -4.824   4.280  -0.760
  304    HD3  PRO  37           HD1      PRO  37  -4.779   3.055  -2.057
  305    H    ASP  38           HN       ASP  38  -1.066   6.994  -3.838
  306    HA   ASP  38           HA       ASP  38   1.082   7.293  -2.019
  307    HB2  ASP  38           HB2      ASP  38   0.874   8.167  -4.420
  308    HB3  ASP  38           HB1      ASP  38  -0.029   9.521  -3.739
  309    H    GLN  39           HN       GLN  39  -1.924   9.196  -2.302
  310    HA   GLN  39           HA       GLN  39  -1.401  11.102  -0.292
  311    HB2  GLN  39           HB2      GLN  39  -3.966  11.069   0.005
  312    HB3  GLN  39           HB1      GLN  39  -3.345  11.449  -1.601
  313    HG2  GLN  39           HG2      GLN  39  -3.706   9.156  -2.334
  314    HG3  GLN  39           HG1      GLN  39  -4.206   8.684  -0.710
  315   HE21  GLN  39          HE21      GLN  39  -6.185   8.081  -2.318
  316   HE22  GLN  39          HE22      GLN  39  -7.396   9.270  -2.406
  317    H    TYR  40           HN       TYR  40  -2.058   7.715   0.002
  318    HA   TYR  40           HA       TYR  40  -2.429   7.995   2.969
  319    HB2  TYR  40           HB2      TYR  40  -3.238   5.873   0.977
  320    HB3  TYR  40           HB1      TYR  40  -3.158   5.524   2.705
  321    HD1  TYR  40           HD1      TYR  40  -4.351   7.287   4.270
  322    HD2  TYR  40           HD2      TYR  40  -5.242   6.748   0.101
  323    HE1  TYR  40           HE1      TYR  40  -6.563   8.352   4.606
  324    HE2  TYR  40           HE2      TYR  40  -7.458   7.816   0.440
  325    HH   TYR  40           HH       TYR  40  -8.497   9.423   2.065
  326    H    VAL  41           HN       VAL  41   0.031   7.670   0.902
  327    HA   VAL  41           HA       VAL  41   1.572   5.943   2.792
  328    HB   VAL  41           HB       VAL  41   1.607   5.691  -0.231
  329   HG11  VAL  41          HG11      VAL  41   3.118   3.706   0.390
  330   HG12  VAL  41          HG12      VAL  41   3.281   4.470   1.972
  331   HG13  VAL  41          HG13      VAL  41   3.831   5.315   0.524
  332   HG21  VAL  41          HG21      VAL  41  -0.338   4.617   0.716
  333   HG22  VAL  41          HG22      VAL  41   0.631   3.872   1.989
  334   HG23  VAL  41          HG23      VAL  41   0.831   3.361   0.311
  335    H    ARG  42           HN       ARG  42   1.820   8.042  -0.091
  336    HA   ARG  42           HA       ARG  42   3.659   9.390  -0.776
  337    HB2  ARG  42           HB2      ARG  42   3.910  11.292   0.892
  338    HB3  ARG  42           HB1      ARG  42   2.264  10.961   0.369
  339    HG2  ARG  42           HG2      ARG  42   1.794   9.736   2.410
  340    HG3  ARG  42           HG1      ARG  42   3.472   9.867   2.929
  341    HD2  ARG  42           HD2      ARG  42   3.226  12.343   2.970
  342    HD3  ARG  42           HD1      ARG  42   1.527  12.158   2.534
  343    HE   ARG  42           HE       ARG  42   2.727  11.546   5.158
  344   HH11  ARG  42          HH21      ARG  42   0.069  11.225   2.974
  345   HH12  ARG  42          HH22      ARG  42  -1.080  10.891   4.225
  346   HH21  ARG  42          HH11      ARG  42   1.242  11.117   6.787
  347   HH22  ARG  42          HH12      ARG  42  -0.418  10.830   6.383
  348    H    LEU  43           HN       LEU  43   5.055  10.489   1.978
  349    HA   LEU  43           HA       LEU  43   7.440   8.793   1.592
  350    HB2  LEU  43           HB2      LEU  43   6.811  11.312   3.138
  351    HB3  LEU  43           HB1      LEU  43   8.307  10.427   3.432
  352    HG   LEU  43           HG       LEU  43   8.883  10.610   1.031
  353   HD11  LEU  43          HD11      LEU  43   6.225  12.049   0.945
  354   HD12  LEU  43          HD12      LEU  43   6.766  10.699  -0.051
  355   HD13  LEU  43          HD13      LEU  43   7.459  12.301  -0.290
  356   HD21  LEU  43          HD21      LEU  43   8.201  13.184   2.479
  357   HD22  LEU  43          HD22      LEU  43   9.151  13.136   0.994
  358   HD23  LEU  43          HD23      LEU  43   9.754  12.349   2.452
  359    H    GLY  44           HN       GLY  44   4.634   8.563   3.306
  360    HA2  GLY  44           HA2      GLY  44   5.156   7.992   5.946
  361    HA3  GLY  44           HA1      GLY  44   4.009   7.048   4.998
  362    HA   PRO  45           HA       PRO  45   7.884   4.512   6.193
  363    HB2  PRO  45           HB2      PRO  45   6.859   3.082   8.299
  364    HB3  PRO  45           HB1      PRO  45   7.687   4.638   8.502
  365    HG2  PRO  45           HG2      PRO  45   4.760   4.048   8.454
  366    HG3  PRO  45           HG1      PRO  45   5.669   5.160   9.496
  367    HD2  PRO  45           HD2      PRO  45   4.233   6.008   7.315
  368    HD3  PRO  45           HD1      PRO  45   5.681   6.853   7.907
  369    H    LEU  46           HN       LEU  46   4.592   4.055   5.436
  370    HA   LEU  46           HA       LEU  46   4.760   1.145   5.047
  371    HB2  LEU  46           HB2      LEU  46   2.650   3.133   4.142
  372    HB3  LEU  46           HB1      LEU  46   2.477   1.378   4.172
  373    HG   LEU  46           HG       LEU  46   2.960   3.134   6.600
  374   HD11  LEU  46          HD11      LEU  46   0.471   1.729   5.586
  375   HD12  LEU  46          HD12      LEU  46   0.711   3.469   5.745
  376   HD13  LEU  46          HD13      LEU  46   0.618   2.457   7.186
  377   HD21  LEU  46          HD21      LEU  46   3.876   1.048   7.174
  378   HD22  LEU  46          HD22      LEU  46   2.712   0.155   6.193
  379   HD23  LEU  46          HD23      LEU  46   2.211   0.880   7.719
  380    H    SER  47           HN       SER  47   5.968   3.783   3.471
  381    HA   SER  47           HA       SER  47   5.364   3.256   0.730
  382    HB2  SER  47           HB2      SER  47   7.894   4.500   1.812
  383    HB3  SER  47           HB1      SER  47   7.184   4.739   0.217
  384    HG   SER  47           HG       SER  47   5.819   5.326   2.629
  385    H    ASN  48           HN       ASN  48   6.285   1.935  -0.765
  386    HA   ASN  48           HA       ASN  48   7.394   0.016  -1.533
  387    HB2  ASN  48           HB2      ASN  48   9.617   1.446  -0.046
  388    HB3  ASN  48           HB1      ASN  48   9.874   0.079  -1.131
  389   HD21  ASN  48          HD21      ASN  48   7.347   1.444  -2.619
  390   HD22  ASN  48          HD22      ASN  48   8.125   2.574  -3.619
  391    H    LYS  49           HN       LYS  49   6.405   0.204   1.498
  392    HA   LYS  49           HA       LYS  49   8.009  -2.003   2.640
  393    HB2  LYS  49           HB2      LYS  49   7.206  -0.066   4.029
  394    HB3  LYS  49           HB1      LYS  49   5.558  -0.641   3.780
  395    HG2  LYS  49           HG2      LYS  49   6.127  -2.790   4.816
  396    HG3  LYS  49           HG1      LYS  49   7.794  -2.264   5.026
  397    HD2  LYS  49           HD2      LYS  49   7.029  -0.411   6.472
  398    HD3  LYS  49           HD1      LYS  49   5.362  -0.958   6.280
  399    HE2  LYS  49           HE2      LYS  49   5.941  -3.122   7.302
  400    HE3  LYS  49           HE1      LYS  49   7.617  -2.597   7.476
  401    HZ1  LYS  49           HZ1      LYS  49   6.340  -0.583   8.649
  402    HZ2  LYS  49           HZ2      LYS  49   6.898  -1.951   9.488
  403    HZ3  LYS  49           HZ3      LYS  49   5.271  -1.849   9.011
  404    H    ILE  50           HN       ILE  50   7.336  -4.112   2.673
  405    HA   ILE  50           HA       ILE  50   4.930  -4.805   1.135
  406    HB   ILE  50           HB       ILE  50   7.046  -6.513   2.451
  407   HG12  ILE  50          HG12      ILE  50   6.586  -5.872  -0.476
  408   HG13  ILE  50          HG11      ILE  50   7.715  -4.977   0.541
  409   HG21  ILE  50          HG21      ILE  50   6.039  -8.197   0.720
  410   HG22  ILE  50          HG22      ILE  50   4.615  -7.160   0.781
  411   HG23  ILE  50          HG23      ILE  50   5.196  -7.950   2.248
  412   HD11  ILE  50          HD11      ILE  50   8.834  -6.795  -0.742
  413   HD12  ILE  50          HD12      ILE  50   7.810  -7.971   0.083
  414   HD13  ILE  50          HD13      ILE  50   8.974  -7.017   1.002
  415    H    LEU  51           HN       LEU  51   2.991  -5.102   2.074
  416    HA   LEU  51           HA       LEU  51   2.885  -5.729   4.997
  417    HB2  LEU  51           HB2      LEU  51   1.155  -4.125   3.147
  418    HB3  LEU  51           HB1      LEU  51   0.407  -4.866   4.556
  419    HG   LEU  51           HG       LEU  51   1.230  -2.506   4.916
  420   HD11  LEU  51          HD11      LEU  51   1.794  -2.904   7.123
  421   HD12  LEU  51          HD12      LEU  51   2.859  -4.248   6.745
  422   HD13  LEU  51          HD13      LEU  51   1.111  -4.472   6.718
  423   HD21  LEU  51          HD21      LEU  51   3.345  -3.007   3.480
  424   HD22  LEU  51          HD22      LEU  51   4.006  -3.670   4.976
  425   HD23  LEU  51          HD23      LEU  51   3.523  -1.980   4.901
  426    H    GLN  52           HN       GLN  52   1.510  -7.324   5.749
  427    HA   GLN  52           HA       GLN  52   0.954  -9.469   3.818
  428    HB2  GLN  52           HB2      GLN  52   1.917  -9.922   6.079
  429    HB3  GLN  52           HB1      GLN  52   0.426  -9.326   6.804
  430    HG2  GLN  52           HG2      GLN  52   0.330 -11.754   6.683
  431    HG3  GLN  52           HG1      GLN  52  -0.834 -11.083   5.540
  432   HE21  GLN  52          HE21      GLN  52  -0.776 -12.673   3.891
  433   HE22  GLN  52          HE22      GLN  52   0.633 -13.103   3.047
  434    H    THR  53           HN       THR  53  -0.871  -9.106   2.616
  435    HA   THR  53           HA       THR  53  -3.229  -7.814   3.856
  436    HB   THR  53           HB       THR  53  -4.121  -8.131   1.444
  437    HG1  THR  53           HG1      THR  53  -2.241  -8.330  -0.002
  438   HG21  THR  53          HG21      THR  53  -3.492  -5.943   1.967
  439   HG22  THR  53          HG22      THR  53  -2.417  -6.316   0.624
  440   HG23  THR  53          HG23      THR  53  -1.813  -6.385   2.278
  441    H    ASN  54           HN       ASN  54  -5.068  -8.896   4.411
  442    HA   ASN  54           HA       ASN  54  -5.269 -11.809   3.733
  443    HB2  ASN  54           HB2      ASN  54  -5.841 -10.376   6.332
  444    HB3  ASN  54           HB1      ASN  54  -6.464 -11.991   5.980
  445   HD21  ASN  54          HD21      ASN  54  -4.606 -11.605   8.112
  446   HD22  ASN  54          HD22      ASN  54  -3.135 -12.339   7.691
  447    H    THR  55           HN       THR  55  -6.759 -11.681   2.107
  448    HA   THR  55           HA       THR  55  -9.195 -10.026   2.507
  449    HB   THR  55           HB       THR  55  -8.223 -11.570   0.092
  450    HG1  THR  55           HG1      THR  55  -7.452  -9.675  -0.578
  451   HG21  THR  55          HG21      THR  55 -10.580  -9.734   0.562
  452   HG22  THR  55          HG22      THR  55 -10.611 -11.402  -0.007
  453   HG23  THR  55          HG23      THR  55  -9.978 -10.127  -1.048
  454    H    TYR  56           HN       TYR  56 -11.213 -10.922   2.753
  455    HA   TYR  56           HA       TYR  56 -11.314 -13.898   3.087
  456    HB2  TYR  56           HB2      TYR  56 -13.038 -11.674   4.204
  457    HB3  TYR  56           HB1      TYR  56 -13.393 -13.392   4.405
  458    HD1  TYR  56           HD1      TYR  56 -11.004 -10.682   5.211
  459    HD2  TYR  56           HD2      TYR  56 -12.088 -14.783   5.876
  460    HE1  TYR  56           HE1      TYR  56  -9.416 -10.794   7.114
  461    HE2  TYR  56           HE2      TYR  56 -10.504 -14.895   7.779
  462    HH   TYR  56           HH       TYR  56  -8.159 -12.489   8.358
  463    H    TYR  57           HN       TYR  57 -12.532 -15.050   1.666
  464    HA   TYR  57           HA       TYR  57 -14.399 -13.542  -0.150
  465    HB2  TYR  57           HB2      TYR  57 -12.693 -15.997  -0.662
  466    HB3  TYR  57           HB1      TYR  57 -13.913 -15.391  -1.782
  467    HD1  TYR  57           HD2      TYR  57 -13.682 -13.063  -2.722
  468    HD2  TYR  57           HD1      TYR  57 -10.541 -14.970  -0.498
  469    HE1  TYR  57           HE2      TYR  57 -12.050 -11.431  -3.629
  470    HE2  TYR  57           HE1      TYR  57  -8.908 -13.336  -1.405
  471    HH   TYR  57           HH       TYR  57  -9.765 -10.487  -2.831
  472    H    SER  58           HN       SER  58 -16.481 -14.176  -0.106
  473    HA   SER  58           HA       SER  58 -17.155 -16.907   0.894
  474    HB2  SER  58           HB2      SER  58 -17.358 -14.912   2.636
  475    HB3  SER  58           HB1      SER  58 -18.854 -14.587   1.766
  476    HG   SER  58           HG       SER  58 -19.649 -16.155   2.907
  477    H    ASP  59           HN       ASP  59 -19.449 -17.472   0.345
  478    HA   ASP  59           HA       ASP  59 -20.021 -16.910  -2.409
  479    HB2  ASP  59           HB2      ASP  59 -22.164 -18.107  -1.940
  480    HB3  ASP  59           HB1      ASP  59 -20.751 -18.985  -1.357
  481    H    THR  60           HN       THR  60 -21.423 -15.670   0.619
  482    HA   THR  60           HA       THR  60 -23.427 -14.041  -0.660
  483    HB   THR  60           HB       THR  60 -22.130 -13.547   2.030
  484    HG1  THR  60           HG1      THR  60 -22.813 -15.713   1.836
  485   HG21  THR  60          HG21      THR  60 -23.771 -11.880   0.950
  486   HG22  THR  60          HG22      THR  60 -24.136 -12.431   2.582
  487   HG23  THR  60          HG23      THR  60 -25.000 -13.119   1.208
  488    H    LEU  61           HN       LEU  61 -20.161 -13.380   0.577
  489    HA   LEU  61           HA       LEU  61 -20.145 -10.588  -0.046
  490    HB2  LEU  61           HB2      LEU  61 -18.050 -12.676   0.483
  491    HB3  LEU  61           HB1      LEU  61 -17.527 -11.145  -0.208
  492    HG   LEU  61           HG       LEU  61 -18.817 -10.015   1.720
  493   HD11  LEU  61          HD11      LEU  61 -18.503 -12.699   3.059
  494   HD12  LEU  61          HD12      LEU  61 -20.009 -12.248   2.266
  495   HD13  LEU  61          HD13      LEU  61 -19.409 -11.294   3.614
  496   HD21  LEU  61          HD21      LEU  61 -16.510 -11.771   2.583
  497   HD22  LEU  61          HD22      LEU  61 -16.930 -10.168   3.182
  498   HD23  LEU  61          HD23      LEU  61 -16.294 -10.361   1.553
  499    H    HIS  62           HN       HIS  62 -19.223 -13.448  -1.927
  500    HA   HIS  62           HA       HIS  62 -18.139 -12.084  -4.169
  501    HB2  HIS  62           HB2      HIS  62 -18.055 -14.555  -3.790
  502    HB3  HIS  62           HB1      HIS  62 -19.774 -14.636  -4.173
  503    HD1  HIS  62           HD1      HIS  62 -20.478 -14.044  -6.642
  504    HD2  HIS  62           HD2      HIS  62 -16.363 -14.284  -6.022
  505    HE1  HIS  62           HE1      HIS  62 -19.412 -14.144  -8.937
  506    H    LYS  63           HN       LYS  63 -21.480 -13.089  -3.454
  507    HA   LYS  63           HA       LYS  63 -22.636 -12.000  -5.850
  508    HB2  LYS  63           HB2      LYS  63 -23.817 -12.558  -3.115
  509    HB3  LYS  63           HB1      LYS  63 -24.769 -12.111  -4.530
  510    HG2  LYS  63           HG2      LYS  63 -23.982 -14.092  -5.730
  511    HG3  LYS  63           HG1      LYS  63 -22.921 -14.511  -4.389
  512    HD2  LYS  63           HD2      LYS  63 -24.818 -15.883  -4.057
  513    HD3  LYS  63           HD1      LYS  63 -25.054 -14.546  -2.935
  514    HE2  LYS  63           HE2      LYS  63 -26.633 -13.483  -4.407
  515    HE3  LYS  63           HE1      LYS  63 -26.246 -14.589  -5.723
  516    HZ1  LYS  63           HZ1      LYS  63 -26.935 -16.287  -3.775
  517    HZ2  LYS  63           HZ2      LYS  63 -28.010 -15.705  -4.955
  518    HZ3  LYS  63           HZ3      LYS  63 -27.953 -14.977  -3.421
  519    H    SER  64           HN       SER  64 -22.164 -10.707  -2.574
  520    HA   SER  64           HA       SER  64 -23.437  -8.163  -3.141
  521    HB2  SER  64           HB2      SER  64 -23.135  -9.156  -0.840
  522    HB3  SER  64           HB1      SER  64 -21.412  -8.822  -0.980
  523    HG   SER  64           HG       SER  64 -21.998  -6.956  -0.188
  524    H    ASN  65           HN       ASN  65 -20.553  -9.544  -4.117
  525    HA   ASN  65           HA       ASN  65 -18.636  -8.716  -5.150
  526    HB2  ASN  65           HB2      ASN  65 -20.505  -6.363  -5.537
  527    HB3  ASN  65           HB1      ASN  65 -18.886  -6.431  -6.228
  528   HD21  ASN  65          HD21      ASN  65 -21.215  -6.377  -7.904
  529   HD22  ASN  65          HD22      ASN  65 -21.333  -7.874  -8.696
  530    H    ILE  66           HN       ILE  66 -18.832  -8.444  -2.274
  531    HA   ILE  66           HA       ILE  66 -17.289  -5.909  -1.805
  532    HB   ILE  66           HB       ILE  66 -18.647  -7.712   0.224
  533   HG12  ILE  66          HG12      ILE  66 -20.348  -6.726  -1.196
  534   HG13  ILE  66          HG11      ILE  66 -20.338  -5.859   0.337
  535   HG21  ILE  66          HG21      ILE  66 -17.409  -4.950   0.393
  536   HG22  ILE  66          HG22      ILE  66 -16.842  -6.414   1.196
  537   HG23  ILE  66          HG23      ILE  66 -18.373  -5.682   1.676
  538   HD11  ILE  66          HD11      ILE  66 -18.669  -4.238  -0.893
  539   HD12  ILE  66          HD12      ILE  66 -20.393  -4.104  -1.216
  540   HD13  ILE  66          HD13      ILE  66 -19.347  -4.950  -2.356
  541    H    TYR  67           HN       TYR  67 -15.149  -6.134  -1.424
  542    HA   TYR  67           HA       TYR  67 -14.119  -8.846  -0.639
  543    HB2  TYR  67           HB2      TYR  67 -12.798  -6.793  -2.413
  544    HB3  TYR  67           HB1      TYR  67 -12.133  -8.365  -1.972
  545    HD1  TYR  67           HD2      TYR  67 -13.756 -10.420  -2.392
  546    HD2  TYR  67           HD1      TYR  67 -14.032  -6.635  -4.405
  547    HE1  TYR  67           HE2      TYR  67 -15.019 -11.494  -4.237
  548    HE2  TYR  67           HE1      TYR  67 -15.299  -7.708  -6.247
  549    HH   TYR  67           HH       TYR  67 -15.321 -10.476  -7.090
  550    HA   PRO  68           HA       PRO  68 -12.736  -5.819   2.557
  551    HB2  PRO  68           HB2      PRO  68 -13.109  -7.436   4.737
  552    HB3  PRO  68           HB1      PRO  68 -14.392  -6.443   4.023
  553    HG2  PRO  68           HG2      PRO  68 -13.920  -9.364   3.801
  554    HG3  PRO  68           HG1      PRO  68 -15.442  -8.459   3.784
  555    HD2  PRO  68           HD2      PRO  68 -14.140  -9.480   1.519
  556    HD3  PRO  68           HD1      PRO  68 -15.405  -8.230   1.495
  557    H    PHE  69           HN       PHE  69 -10.717  -5.667   3.561
  558    HA   PHE  69           HA       PHE  69  -9.031  -8.104   3.721
  559    HB2  PHE  69           HB2      PHE  69  -7.195  -7.013   2.505
  560    HB3  PHE  69           HB1      PHE  69  -8.619  -7.146   1.473
  561    HD1  PHE  69           HD1      PHE  69  -6.516  -4.841   3.447
  562    HD2  PHE  69           HD2      PHE  69  -9.914  -5.182   0.841
  563    HE1  PHE  69           HE1      PHE  69  -6.516  -2.382   3.125
  564    HE2  PHE  69           HE2      PHE  69  -9.913  -2.723   0.520
  565    HZ   PHE  69           HZ       PHE  69  -8.213  -1.323   1.660
  566    H    ILE  70           HN       ILE  70  -7.292  -7.903   5.182
  567    HA   ILE  70           HA       ILE  70  -7.254  -5.396   6.828
  568    HB   ILE  70           HB       ILE  70  -7.114  -8.260   7.820
  569   HG12  ILE  70          HG12      ILE  70  -9.144  -6.087   8.415
  570   HG13  ILE  70          HG11      ILE  70  -9.386  -7.327   7.186
  571   HG21  ILE  70          HG21      ILE  70  -6.684  -5.577   9.148
  572   HG22  ILE  70          HG22      ILE  70  -5.647  -7.001   9.199
  573   HG23  ILE  70          HG23      ILE  70  -7.176  -6.992  10.078
  574   HD11  ILE  70          HD11      ILE  70  -8.745  -7.979  10.070
  575   HD12  ILE  70          HD12      ILE  70  -9.315  -9.083   8.818
  576   HD13  ILE  70          HD13      ILE  70 -10.394  -7.846   9.463
  577    H    LEU  71           HN       LEU  71  -5.238  -4.587   7.137
  578    HA   LEU  71           HA       LEU  71  -2.955  -6.071   5.972
  579    HB2  LEU  71           HB2      LEU  71  -2.954  -3.320   7.232
  580    HB3  LEU  71           HB1      LEU  71  -1.777  -3.983   6.100
  581    HG   LEU  71           HG       LEU  71  -4.646  -3.196   5.550
  582   HD11  LEU  71          HD11      LEU  71  -2.665  -1.539   5.479
  583   HD12  LEU  71          HD12      LEU  71  -3.715  -1.611   4.064
  584   HD13  LEU  71          HD13      LEU  71  -2.149  -2.420   4.043
  585   HD21  LEU  71          HD21      LEU  71  -4.420  -5.257   4.379
  586   HD22  LEU  71          HD22      LEU  71  -2.753  -4.903   3.923
  587   HD23  LEU  71          HD23      LEU  71  -4.081  -4.013   3.180
  588    H    TYR  72           HN       TYR  72  -1.463  -7.088   7.166
  589    HA   TYR  72           HA       TYR  72  -1.415  -6.616  10.128
  590    HB2  TYR  72           HB2      TYR  72  -1.140  -9.184   8.555
  591    HB3  TYR  72           HB1      TYR  72  -0.697  -9.039  10.257
  592    HD1  TYR  72           HD1      TYR  72  -2.495  -8.025  11.844
  593    HD2  TYR  72           HD2      TYR  72  -3.372  -9.682   7.979
  594    HE1  TYR  72           HE1      TYR  72  -4.862  -8.325  12.511
  595    HE2  TYR  72           HE2      TYR  72  -5.743  -9.981   8.646
  596    HH   TYR  72           HH       TYR  72  -6.860 -10.203  11.401
  597    H    TYR  73           HN       TYR  73   0.595  -6.626  11.106
  598    HA   TYR  73           HA       TYR  73   3.015  -7.044   9.453
  599    HB2  TYR  73           HB2      TYR  73   2.567  -4.668   9.131
  600    HB3  TYR  73           HB1      TYR  73   2.356  -4.441  10.867
  601    HD1  TYR  73           HD2      TYR  73   4.843  -5.541   8.302
  602    HD2  TYR  73           HD1      TYR  73   4.214  -3.967  12.249
  603    HE1  TYR  73           HE2      TYR  73   7.283  -5.171   8.544
  604    HE2  TYR  73           HE1      TYR  73   6.653  -3.596  12.491
  605    HH   TYR  73           HH       TYR  73   8.616  -3.267  11.016
  606    H    GLN  74           HN       GLN  74   3.376  -8.808  10.824
  607    HA   GLN  74           HA       GLN  74   4.449  -9.833  12.627
  608    HB2  GLN  74           HB2      GLN  74   5.651  -7.501  12.748
  609    HB3  GLN  74           HB1      GLN  74   4.580  -7.209  14.118
  610    HG2  GLN  74           HG2      GLN  74   6.622  -8.130  14.994
  611    HG3  GLN  74           HG1      GLN  74   5.388  -9.386  15.109
  612   HE21  GLN  74          HE21      GLN  74   6.245 -11.372  14.501
  613   HE22  GLN  74          HE22      GLN  74   7.366 -11.615  13.250
  614    H    LYS  75           HN       LYS  75   1.658  -9.664  12.352
  615    HA   LYS  75           HA       LYS  75  -0.215 -10.332  13.571
  616    HB2  LYS  75           HB2      LYS  75   1.716 -11.358  15.059
  617    HB3  LYS  75           HB1      LYS  75   1.271 -10.079  16.181
  618    HG2  LYS  75           HG2      LYS  75  -1.040 -10.853  16.229
  619    HG3  LYS  75           HG1      LYS  75  -0.692 -12.077  15.012
  620    HD2  LYS  75           HD2      LYS  75   0.809 -11.994  17.631
  621    HD3  LYS  75           HD1      LYS  75  -0.734 -12.829  17.486
  622    HE2  LYS  75           HE2      LYS  75   0.266 -14.125  15.540
  623    HE3  LYS  75           HE1      LYS  75   1.825 -13.430  15.975
  624    HZ1  LYS  75           HZ1      LYS  75   1.939 -14.611  17.882
  625    HZ2  LYS  75           HZ2      LYS  75   1.003 -15.697  16.970
  626    HZ3  LYS  75           HZ3      LYS  75   0.258 -14.669  18.098
  627    H    GLN  76           HN       GLN  76   0.980  -7.424  13.399
  628    HA   GLN  76           HA       GLN  76  -0.808  -6.199  15.467
  629    HB2  GLN  76           HB2      GLN  76   1.593  -5.142  13.969
  630    HB3  GLN  76           HB1      GLN  76   0.502  -4.094  14.879
  631    HG2  GLN  76           HG2      GLN  76   1.856  -6.518  16.069
  632    HG3  GLN  76           HG1      GLN  76   2.516  -4.888  16.181
  633   HE21  GLN  76          HE21      GLN  76   0.982  -6.968  18.110
  634   HE22  GLN  76          HE22      GLN  76  -0.054  -5.929  18.966
  635    H    LEU  77           HN       LEU  77  -2.185  -4.509  14.849
  636    HA   LEU  77           HA       LEU  77  -3.207  -4.805  12.086
  637    HB2  LEU  77           HB2      LEU  77  -4.766  -4.855  14.031
  638    HB3  LEU  77           HB1      LEU  77  -4.306  -3.196  14.408
  639    HG   LEU  77           HG       LEU  77  -5.088  -2.504  12.131
  640   HD11  LEU  77          HD11      LEU  77  -5.683  -5.444  11.950
  641   HD12  LEU  77          HD12      LEU  77  -5.031  -4.356  10.726
  642   HD13  LEU  77          HD13      LEU  77  -6.744  -4.306  11.121
  643   HD21  LEU  77          HD21      LEU  77  -7.165  -3.944  13.809
  644   HD22  LEU  77          HD22      LEU  77  -7.475  -2.634  12.669
  645   HD23  LEU  77          HD23      LEU  77  -6.537  -2.327  14.129
  646    H    ILE  78           HN       ILE  78  -2.679  -3.377  10.522
  647    HA   ILE  78           HA       ILE  78  -1.477  -0.746  11.310
  648    HB   ILE  78           HB       ILE  78  -1.436  -2.192   8.651
  649   HG12  ILE  78          HG12      ILE  78  -0.215  -3.481  10.315
  650   HG13  ILE  78          HG11      ILE  78   0.937  -2.684   9.256
  651   HG21  ILE  78          HG21      ILE  78  -0.025   0.272   9.696
  652   HG22  ILE  78          HG22      ILE  78  -1.125   0.162   8.320
  653   HG23  ILE  78          HG23      ILE  78   0.470  -0.584   8.237
  654   HD11  ILE  78          HD11      ILE  78   0.868  -0.783  11.097
  655   HD12  ILE  78          HD12      ILE  78   1.856  -2.216  11.342
  656   HD13  ILE  78          HD13      ILE  78   0.280  -2.091  12.120
  657    H    ALA  79           HN       ALA  79  -3.781  -2.165   8.952
  658    HA   ALA  79           HA       ALA  79  -5.527   0.162   9.283
  659    HB1  ALA  79           HB1      ALA  79  -4.344  -0.353   6.549
  660    HB2  ALA  79           HB2      ALA  79  -3.769   0.912   7.630
  661    HB3  ALA  79           HB3      ALA  79  -5.422   0.958   7.018
  662    H    ILE  80           HN       ILE  80  -7.544  -0.084   8.043
  663    HA   ILE  80           HA       ILE  80  -8.042  -2.858   7.037
  664    HB   ILE  80           HB       ILE  80  -9.756  -1.318   9.008
  665   HG12  ILE  80          HG12      ILE  80  -8.426  -4.027   9.264
  666   HG13  ILE  80          HG11      ILE  80  -7.713  -2.538   9.880
  667   HG21  ILE  80          HG21      ILE  80 -11.121  -3.476   8.906
  668   HG22  ILE  80          HG22      ILE  80 -10.214  -3.872   7.448
  669   HG23  ILE  80          HG23      ILE  80 -11.236  -2.435   7.489
  670   HD11  ILE  80          HD11      ILE  80 -10.502  -3.415  10.644
  671   HD12  ILE  80          HD12      ILE  80  -9.485  -2.209  11.433
  672   HD13  ILE  80          HD13      ILE  80  -9.078  -3.922  11.550
  673    H    GLY  81           HN       GLY  81  -9.597  -2.961   5.375
  674    HA2  GLY  81           HA2      GLY  81 -11.302  -0.746   4.695
  675    HA3  GLY  81           HA1      GLY  81  -9.865  -0.734   3.673
  676    H    PHE  82           HN       PHE  82 -12.211  -1.110   2.377
  677    HA   PHE  82           HA       PHE  82 -11.971  -3.933   1.489
  678    HB2  PHE  82           HB2      PHE  82 -14.384  -4.308   1.575
  679    HB3  PHE  82           HB1      PHE  82 -13.820  -3.867   3.186
  680    HD1  PHE  82           HD1      PHE  82 -15.685  -2.723   0.217
  681    HD2  PHE  82           HD2      PHE  82 -14.376  -1.722   4.184
  682    HE1  PHE  82           HE1      PHE  82 -17.282  -0.827   0.265
  683    HE2  PHE  82           HE2      PHE  82 -15.972   0.177   4.230
  684    HZ   PHE  82           HZ       PHE  82 -17.427   0.622   2.272
  685    H    ILE  83           HN       ILE  83 -12.976  -4.253  -0.649
  686    HA   ILE  83           HA       ILE  83 -12.937  -1.714  -2.231
  687    HB   ILE  83           HB       ILE  83 -12.638  -4.590  -3.138
  688   HG12  ILE  83          HG12      ILE  83 -10.551  -2.403  -2.966
  689   HG13  ILE  83          HG11      ILE  83 -10.780  -3.610  -1.702
  690   HG21  ILE  83          HG21      ILE  83 -11.835  -3.452  -5.241
  691   HG22  ILE  83          HG22      ILE  83 -12.401  -1.926  -4.562
  692   HG23  ILE  83          HG23      ILE  83 -13.552  -3.217  -4.910
  693   HD11  ILE  83          HD11      ILE  83 -10.278  -4.337  -4.596
  694   HD12  ILE  83          HD12      ILE  83 -10.215  -5.402  -3.191
  695   HD13  ILE  83          HD13      ILE  83  -8.983  -4.160  -3.412
  696    H    ASP  84           HN       ASP  84 -14.793  -0.993  -3.071
  697    HA   ASP  84           HA       ASP  84 -17.242  -2.636  -2.801
  698    HB2  ASP  84           HB2      ASP  84 -17.053  -0.205  -2.047
  699    HB3  ASP  84           HB1      ASP  84 -17.011   0.225  -3.757
  700    H    GLU  85           HN       GLU  85 -18.850  -1.829  -4.770
  701    HA   GLU  85           HA       GLU  85 -17.978  -3.289  -7.069
  702    HB2  GLU  85           HB2      GLU  85 -20.374  -2.763  -6.270
  703    HB3  GLU  85           HB1      GLU  85 -20.170  -1.211  -7.080
  704    HG2  GLU  85           HG2      GLU  85 -19.731  -3.873  -8.464
  705    HG3  GLU  85           HG1      GLU  85 -21.262  -3.002  -8.491
  706    H    ASN  86           HN       ASN  86 -17.898   0.165  -6.285
  707    HA   ASN  86           HA       ASN  86 -17.094   0.904  -9.009
  708    HB2  ASN  86           HB2      ASN  86 -17.264   2.441  -6.403
  709    HB3  ASN  86           HB1      ASN  86 -16.684   3.163  -7.906
  710   HD21  ASN  86          HD21      ASN  86 -19.087   4.091  -6.624
  711   HD22  ASN  86          HD22      ASN  86 -20.404   3.709  -7.627
  712    H    HIS  87           HN       HIS  87 -15.491  -1.054  -7.391
  713    HA   HIS  87           HA       HIS  87 -13.265  -1.495  -6.810
  714    HB2  HIS  87           HB2      HIS  87 -11.662  -0.888  -8.484
  715    HB3  HIS  87           HB1      HIS  87 -13.190  -1.137  -9.324
  716    HD1  HIS  87           HD1      HIS  87 -14.244   0.868 -10.490
  717    HD2  HIS  87           HD2      HIS  87 -10.900   1.902  -8.227
  718    HE1  HIS  87           HE1      HIS  87 -13.698   3.270 -11.077
  719    H    ASP  88           HN       ASP  88 -14.639   1.220  -5.866
  720    HA   ASP  88           HA       ASP  88 -12.329   2.878  -5.252
  721    HB2  ASP  88           HB2      ASP  88 -15.205   2.880  -4.321
  722    HB3  ASP  88           HB1      ASP  88 -14.012   4.032  -3.716
  723    H    MET  89           HN       MET  89 -11.196   2.988  -3.317
  724    HA   MET  89           HA       MET  89 -11.553   0.661  -1.493
  725    HB2  MET  89           HB2      MET  89  -9.296   2.642  -1.873
  726    HB3  MET  89           HB1      MET  89  -9.287   1.346  -0.672
  727    HG2  MET  89           HG2      MET  89  -9.628  -0.305  -2.513
  728    HG3  MET  89           HG1      MET  89  -9.528   1.013  -3.675
  729    HE1  MET  89           HE1      MET  89  -8.122  -0.799  -0.840
  730    HE2  MET  89           HE2      MET  89  -7.056   0.498  -0.312
  731    HE3  MET  89           HE3      MET  89  -6.382  -0.921  -1.101
  732    H    ASP  90           HN       ASP  90 -12.913   1.094   0.163
  733    HA   ASP  90           HA       ASP  90 -12.919   3.816   1.394
  734    HB2  ASP  90           HB2      ASP  90 -15.068   2.680   0.623
  735    HB3  ASP  90           HB1      ASP  90 -14.823   1.532   1.938
  736    H    PHE  91           HN       PHE  91 -11.529   3.987   3.091
  737    HA   PHE  91           HA       PHE  91 -10.641   1.615   4.554
  738    HB2  PHE  91           HB2      PHE  91 -10.092   4.549   5.089
  739    HB3  PHE  91           HB1      PHE  91  -9.218   3.183   5.782
  740    HD1  PHE  91           HD2      PHE  91  -8.102   1.524   4.138
  741    HD2  PHE  91           HD1      PHE  91  -9.414   5.463   3.022
  742    HE1  PHE  91           HE2      PHE  91  -6.625   1.453   2.148
  743    HE2  PHE  91           HE1      PHE  91  -7.938   5.385   1.029
  744    HZ   PHE  91           HZ       PHE  91  -6.542   3.383   0.593
  745    H    LEU  92           HN       LEU  92 -11.213   1.039   6.624
  746    HA   LEU  92           HA       LEU  92 -13.497   2.519   7.878
  747    HB2  LEU  92           HB2      LEU  92 -12.539  -0.346   8.174
  748    HB3  LEU  92           HB1      LEU  92 -13.878   0.352   9.079
  749    HG   LEU  92           HG       LEU  92 -13.741   0.191   6.052
  750   HD11  LEU  92          HD11      LEU  92 -13.989  -2.043   6.782
  751   HD12  LEU  92          HD12      LEU  92 -15.643  -1.510   6.484
  752   HD13  LEU  92          HD13      LEU  92 -15.025  -1.583   8.135
  753   HD21  LEU  92          HD21      LEU  92 -16.328   0.578   6.510
  754   HD22  LEU  92          HD22      LEU  92 -15.227   1.948   6.477
  755   HD23  LEU  92          HD23      LEU  92 -15.750   1.276   8.022
  756    H    TYR  93           HN       TYR  93 -10.222   1.395   8.284
  757    HA   TYR  93           HA       TYR  93  -9.945   3.075  10.673
  758    HB2  TYR  93           HB2      TYR  93 -10.763   0.907  11.599
  759    HB3  TYR  93           HB1      TYR  93  -9.388   0.095  10.847
  760    HD1  TYR  93           HD2      TYR  93 -10.280   2.824  13.236
  761    HD2  TYR  93           HD1      TYR  93  -7.287   0.029  11.940
  762    HE1  TYR  93           HE2      TYR  93  -8.874   3.427  15.187
  763    HE2  TYR  93           HE1      TYR  93  -5.882   0.629  13.894
  764    HH   TYR  93           HH       TYR  93  -5.599   2.159  15.554
  765    H    LEU  94           HN       LEU  94  -8.071   4.138  10.249
  766    HA   LEU  94           HA       LEU  94  -5.877   2.656   8.829
  767    HB2  LEU  94           HB2      LEU  94  -6.765   4.445   7.438
  768    HB3  LEU  94           HB1      LEU  94  -6.613   5.594   8.765
  769    HG   LEU  94           HG       LEU  94  -4.186   5.410   8.724
  770   HD11  LEU  94          HD11      LEU  94  -3.213   4.021   6.735
  771   HD12  LEU  94          HD12      LEU  94  -4.755   3.170   6.788
  772   HD13  LEU  94          HD13      LEU  94  -3.698   3.173   8.200
  773   HD21  LEU  94          HD21      LEU  94  -5.058   5.618   5.837
  774   HD22  LEU  94          HD22      LEU  94  -3.775   6.506   6.658
  775   HD23  LEU  94          HD23      LEU  94  -5.462   6.861   7.023
  776    H    HIS  95           HN       HIS  95  -4.048   2.390   9.988
  777    HA   HIS  95           HA       HIS  95  -3.379   4.377  12.107
  778    HB2  HIS  95           HB2      HIS  95  -4.545   2.375  13.107
  779    HB3  HIS  95           HB1      HIS  95  -3.203   1.386  12.532
  780    HD1  HIS  95           HD1      HIS  95  -0.730   2.614  13.275
  781    HD2  HIS  95           HD2      HIS  95  -4.079   3.200  15.688
  782    HE1  HIS  95           HE1      HIS  95   0.141   3.324  15.545
  783    H    ASN  96           HN       ASN  96  -1.338   5.060  11.813
  784    HA   ASN  96           HA       ASN  96   0.468   3.518  10.038
  785    HB2  ASN  96           HB2      ASN  96   0.077   6.027   9.822
  786    HB3  ASN  96           HB1      ASN  96   0.965   6.211  11.334
  787   HD21  ASN  96          HD21      ASN  96   1.406   4.428   8.213
  788   HD22  ASN  96          HD22      ASN  96   3.054   4.810   8.067
  789    H    THR  97           HN       THR  97   2.898   3.666  10.808
  790    HA   THR  97           HA       THR  97   3.145   2.127  13.226
  791    HB   THR  97           HB       THR  97   5.590   2.464  12.890
  792    HG1  THR  97           HG1      THR  97   6.165   4.187  11.868
  793   HG21  THR  97          HG21      THR  97   3.870   1.786  10.500
  794   HG22  THR  97          HG22      THR  97   4.637   0.676  11.635
  795   HG23  THR  97          HG23      THR  97   5.621   1.584  10.487
  796    H    VAL  98           HN       VAL  98   3.454   5.560  12.495
  797    HA   VAL  98           HA       VAL  98   4.344   6.143  15.271
  798    HB   VAL  98           HB       VAL  98   3.937   7.899  12.836
  799   HG11  VAL  98          HG11      VAL  98   5.215   9.575  14.297
  800   HG12  VAL  98          HG12      VAL  98   4.801   8.539  15.665
  801   HG13  VAL  98          HG13      VAL  98   3.523   9.302  14.716
  802   HG21  VAL  98          HG21      VAL  98   6.318   7.945  12.700
  803   HG22  VAL  98          HG22      VAL  98   5.886   6.249  12.922
  804   HG23  VAL  98          HG23      VAL  98   6.496   7.192  14.284
  805    H    MET  99           HN       MET  99   2.082   7.998  13.242
  806    HA   MET  99           HA       MET  99   0.042   7.711  15.414
  807    HB2  MET  99           HB2      MET  99  -0.558  10.079  15.074
  808    HB3  MET  99           HB1      MET  99   1.117   9.910  15.585
  809    HG2  MET  99           HG2      MET  99   1.300  11.419  13.807
  810    HG3  MET  99           HG1      MET  99   1.614   9.883  13.000
  811    HE1  MET  99           HE1      MET  99  -0.711  12.645  10.992
  812    HE2  MET  99           HE2      MET  99   0.964  12.162  11.245
  813    HE3  MET  99           HE3      MET  99   0.111  13.049  12.506
  814    HA   PRO 100           HA       PRO 100  -2.691   6.596  12.089
  815    HB2  PRO 100           HB2      PRO 100  -5.112   7.279  13.192
  816    HB3  PRO 100           HB1      PRO 100  -4.186   5.857  13.700
  817    HG2  PRO 100           HG2      PRO 100  -4.366   8.553  14.973
  818    HG3  PRO 100           HG1      PRO 100  -4.382   6.944  15.727
  819    HD2  PRO 100           HD2      PRO 100  -2.147   8.490  15.683
  820    HD3  PRO 100           HD1      PRO 100  -2.069   6.716  15.612
  821    H    LEU 101           HN       LEU 101  -3.828   7.524  10.334
  822    HA   LEU 101           HA       LEU 101  -3.713  10.506  10.188
  823    HB2  LEU 101           HB2      LEU 101  -4.009   8.412   8.015
  824    HB3  LEU 101           HB1      LEU 101  -3.846  10.146   7.748
  825    HG   LEU 101           HG       LEU 101  -1.787   8.423   9.166
  826   HD11  LEU 101          HD11      LEU 101  -1.806   7.752   6.868
  827   HD12  LEU 101          HD12      LEU 101  -0.461   8.879   7.036
  828   HD13  LEU 101          HD13      LEU 101  -1.976   9.417   6.312
  829   HD21  LEU 101          HD21      LEU 101  -1.944  11.342   8.403
  830   HD22  LEU 101          HD22      LEU 101  -0.377  10.544   8.533
  831   HD23  LEU 101          HD23      LEU 101  -1.439  10.623   9.930
  832    H    LEU 102           HN       LEU 102  -5.835   8.074   8.640
  833    HA   LEU 102           HA       LEU 102  -8.071   9.975   8.833
  834    HB2  LEU 102           HB2      LEU 102  -7.689   8.636   6.784
  835    HB3  LEU 102           HB1      LEU 102  -7.979   7.166   7.698
  836    HG   LEU 102           HG       LEU 102 -10.272   8.034   8.271
  837   HD11  LEU 102          HD11      LEU 102 -11.006   9.895   6.550
  838   HD12  LEU 102          HD12      LEU 102  -9.294  10.310   6.564
  839   HD13  LEU 102          HD13      LEU 102 -10.226  10.354   8.060
  840   HD21  LEU 102          HD21      LEU 102 -10.047   6.456   6.453
  841   HD22  LEU 102          HD22      LEU 102  -9.535   7.730   5.347
  842   HD23  LEU 102          HD23      LEU 102 -11.191   7.701   5.953
  843    H    ASP 103           HN       ASP 103  -8.653   6.554   9.190
  844    HA   ASP 103           HA       ASP 103 -10.105   5.478  10.677
  845    HB2  ASP 103           HB2      ASP 103  -9.165   5.680  13.104
  846    HB3  ASP 103           HB1      ASP 103  -8.160   4.939  11.860
  847    H    GLN 104           HN       GLN 104 -12.099   6.508  10.564
  848    HA   GLN 104           HA       GLN 104 -12.547   8.895  12.296
  849    HB2  GLN 104           HB2      GLN 104 -14.156   7.631  10.065
  850    HB3  GLN 104           HB1      GLN 104 -14.797   8.914  11.097
  851    HG2  GLN 104           HG2      GLN 104 -12.970  10.401  10.442
  852    HG3  GLN 104           HG1      GLN 104 -12.238   9.115   9.479
  853   HE21  GLN 104          HE21      GLN 104 -13.709  11.872   8.865
  854   HE22  GLN 104          HE22      GLN 104 -14.725  11.453   7.571
  855    H    ARG 105           HN       ARG 105 -13.232   8.478  14.299
  856    HA   ARG 105           HA       ARG 105 -14.212   5.951  15.220
  857    HB2  ARG 105           HB2      ARG 105 -14.369   8.747  16.368
  858    HB3  ARG 105           HB1      ARG 105 -14.930   7.321  17.239
  859    HG2  ARG 105           HG2      ARG 105 -12.671   6.333  17.080
  860    HG3  ARG 105           HG1      ARG 105 -12.111   7.757  16.200
  861    HD2  ARG 105           HD2      ARG 105 -12.658   9.183  18.135
  862    HD3  ARG 105           HD1      ARG 105 -13.247   7.774  19.012
  863    HE   ARG 105           HE       ARG 105 -10.997   7.061  19.339
  864   HH11  ARG 105          HH21      ARG 105 -11.264   9.772  17.217
  865   HH12  ARG 105          HH22      ARG 105  -9.571  10.128  17.253
  866   HH21  ARG 105          HH11      ARG 105  -8.793   7.515  19.390
  867   HH22  ARG 105          HH12      ARG 105  -8.172   8.851  18.481
  868    H    TYR 106           HN       TYR 106 -15.819   8.888  14.102
  869    HA   TYR 106           HA       TYR 106 -18.479   8.235  14.889
  870    HB2  TYR 106           HB2      TYR 106 -17.586   9.751  12.418
  871    HB3  TYR 106           HB1      TYR 106 -19.166   9.856  13.196
  872    HD1  TYR 106           HD2      TYR 106 -19.365  10.832  15.494
  873    HD2  TYR 106           HD1      TYR 106 -15.684  10.915  13.283
  874    HE1  TYR 106           HE2      TYR 106 -18.486  12.579  17.020
  875    HE2  TYR 106           HE1      TYR 106 -14.803  12.659  14.808
  876    HH   TYR 106           HH       TYR 106 -16.816  14.313  17.060
  877    H    LEU 107           HN       LEU 107 -16.619   7.443  11.970
  878    HA   LEU 107           HA       LEU 107 -18.752   6.187  10.545
  879    HB2  LEU 107           HB2      LEU 107 -16.617   6.805   9.474
  880    HB3  LEU 107           HB1      LEU 107 -15.775   5.606  10.454
  881    HG   LEU 107           HG       LEU 107 -17.106   3.805   9.415
  882   HD11  LEU 107          HD11      LEU 107 -19.180   4.692   8.821
  883   HD12  LEU 107          HD12      LEU 107 -18.388   4.609   7.252
  884   HD13  LEU 107          HD13      LEU 107 -18.477   6.146   8.112
  885   HD21  LEU 107          HD21      LEU 107 -15.748   5.691   7.465
  886   HD22  LEU 107          HD22      LEU 107 -16.167   4.016   7.100
  887   HD23  LEU 107          HD23      LEU 107 -14.990   4.375   8.363
  888    H    LEU 108           HN       LEU 108 -16.367   4.911  12.856
  889    HA   LEU 108           HA       LEU 108 -17.460   2.193  12.646
  890    HB2  LEU 108           HB2      LEU 108 -15.488   3.374  14.623
  891    HB3  LEU 108           HB1      LEU 108 -15.810   1.657  14.383
  892    HG   LEU 108           HG       LEU 108 -14.743   3.546  12.263
  893   HD11  LEU 108          HD11      LEU 108 -12.634   2.266  12.537
  894   HD12  LEU 108          HD12      LEU 108 -13.359   1.383  13.881
  895   HD13  LEU 108          HD13      LEU 108 -13.081   3.119  14.014
  896   HD21  LEU 108          HD21      LEU 108 -15.538   0.640  12.268
  897   HD22  LEU 108          HD22      LEU 108 -14.224   1.172  11.223
  898   HD23  LEU 108          HD23      LEU 108 -15.827   1.874  11.041
  899    H    THR 109           HN       THR 109 -18.410   4.995  14.221
  900    HA   THR 109           HA       THR 109 -19.799   3.465  16.403
  901    HB   THR 109           HB       THR 109 -19.225   6.437  16.203
  902    HG1  THR 109           HG1      THR 109 -17.967   4.282  17.495
  903   HG21  THR 109          HG21      THR 109 -19.883   6.271  18.679
  904   HG22  THR 109          HG22      THR 109 -20.570   4.698  18.272
  905   HG23  THR 109          HG23      THR 109 -21.190   6.159  17.501
  906    H    GLY 110           HN       GLY 110 -20.192   4.997  13.422
  907    HA2  GLY 110           HA2      GLY 110 -22.556   6.394  13.425
  908    HA3  GLY 110           HA1      GLY 110 -22.157   5.254  12.141
  909    H    GLY 111           HN       GLY 111 -24.131   5.813  14.939
  910    HA2  GLY 111           HA2      GLY 111 -26.171   4.071  14.278
  911    HA3  GLY 111           HA1      GLY 111 -25.052   3.065  15.197
  912    H    GLN 112           HN       GLN 112 -27.418   3.275  16.340
  913    HA   GLN 112           HA       GLN 112 -28.666   4.106  18.144
  914    HB2  GLN 112           HB2      GLN 112 -25.818   4.279  19.163
  915    HB3  GLN 112           HB1      GLN 112 -27.240   4.475  20.192
  916    HG2  GLN 112           HG2      GLN 112 -28.040   2.244  19.546
  917    HG3  GLN 112           HG1      GLN 112 -26.650   2.043  18.480
  918   HE21  GLN 112          HE21      GLN 112 -26.586   0.069  20.202
  919   HE22  GLN 112          HE22      GLN 112 -25.577   0.348  21.539
  920    H    LEU 113           HN       LEU 113 -29.106   6.036  16.641
  921    HA   LEU 113           HA       LEU 113 -27.835   8.559  17.567
  922    HB2  LEU 113           HB2      LEU 113 -29.552   9.456  15.741
  923    HB3  LEU 113           HB1      LEU 113 -28.048   8.685  15.254
  924    HG   LEU 113           HG       LEU 113 -29.192   6.553  14.922
  925   HD11  LEU 113          HD11      LEU 113 -31.559   8.085  16.015
  926   HD12  LEU 113          HD12      LEU 113 -30.895   6.555  16.585
  927   HD13  LEU 113          HD13      LEU 113 -31.759   6.621  15.053
  928   HD21  LEU 113          HD21      LEU 113 -30.866   8.716  13.629
  929   HD22  LEU 113          HD22      LEU 113 -30.426   7.144  12.962
  930   HD23  LEU 113          HD23      LEU 113 -29.200   8.399  13.146
  931    H    GLU 114           HN       GLU 114 -30.219   6.598  18.624
  932    HA   GLU 114           HA       GLU 114 -32.526   8.124  19.007
  933    HB2  GLU 114           HB2      GLU 114 -31.196   6.151  20.877
  934    HB3  GLU 114           HB1      GLU 114 -32.808   6.814  21.150
  935    HG2  GLU 114           HG2      GLU 114 -33.577   5.917  19.008
  936    HG3  GLU 114           HG1      GLU 114 -31.955   5.322  18.652
  937    H    HIS 115           HN       HIS 115 -33.251   9.510  20.675
  938    HA   HIS 115           HA       HIS 115 -33.075  11.296  22.164
  939    HB2  HIS 115           HB2      HIS 115 -32.195   9.436  23.632
  940    HB3  HIS 115           HB1      HIS 115 -30.566   9.914  23.154
  941    HD1  HIS 115           HD1      HIS 115 -29.642  12.138  24.078
  942    HD2  HIS 115           HD2      HIS 115 -33.543  11.330  25.306
  943    HE1  HIS 115           HE1      HIS 115 -30.169  13.791  25.923
  944    H    HIS 116           HN       HIS 116 -32.040  13.322  22.349
  945    HA   HIS 116           HA       HIS 116 -29.538  13.689  20.742
  946    HB2  HIS 116           HB2      HIS 116 -32.041  15.405  20.655
  947    HB3  HIS 116           HB1      HIS 116 -30.515  15.799  19.859
  948    HD1  HIS 116           HD1      HIS 116 -29.674  13.981  18.037
  949    HD2  HIS 116           HD2      HIS 116 -33.669  13.684  19.188
  950    HE1  HIS 116           HE1      HIS 116 -30.818  12.547  16.290
  951    H    HIS 117           HN       HIS 117 -28.130  15.217  21.551
  952    HA   HIS 117           HA       HIS 117 -28.236  15.823  24.345
  953    HB2  HIS 117           HB2      HIS 117 -26.140  15.675  23.045
  954    HB3  HIS 117           HB1      HIS 117 -26.605  17.114  22.137
  955    HD1  HIS 117           HD1      HIS 117 -26.599  19.390  23.402
  956    HD2  HIS 117           HD2      HIS 117 -25.192  16.186  25.668
  957    HE1  HIS 117           HE1      HIS 117 -25.492  20.392  25.447
  958    H    HIS 118           HN       HIS 118 -28.770  17.879  21.471
  959    HA   HIS 118           HA       HIS 118 -30.821  19.418  22.749
  960    HB2  HIS 118           HB2      HIS 118 -28.961  20.363  24.053
  961    HB3  HIS 118           HB1      HIS 118 -28.094  20.749  22.566
  962    HD1  HIS 118           HD1      HIS 118 -28.611  22.966  21.509
  963    HD2  HIS 118           HD2      HIS 118 -31.538  21.836  24.255
  964    HE1  HIS 118           HE1      HIS 118 -30.195  24.931  21.719
  965    H    HIS 119           HN       HIS 119 -31.764  20.919  21.257
  966    HA   HIS 119           HA       HIS 119 -30.789  20.584  18.446
  967    HB2  HIS 119           HB2      HIS 119 -33.504  21.342  19.563
  968    HB3  HIS 119           HB1      HIS 119 -33.115  21.263  17.843
  969    HD1  HIS 119           HD1      HIS 119 -32.154  18.823  17.033
  970    HD2  HIS 119           HD2      HIS 119 -34.251  18.891  20.637
  971    HE1  HIS 119           HE1      HIS 119 -32.816  16.427  17.522
  972    H    HIS 120           HN       HIS 120 -29.940  22.317  17.434
  973    HA   HIS 120           HA       HIS 120 -29.674  24.866  18.782
  974    HB2  HIS 120           HB2      HIS 120 -29.036  23.950  15.967
  975    HB3  HIS 120           HB1      HIS 120 -28.613  25.543  16.598
  976    HD1  HIS 120           HD1      HIS 120 -27.710  21.913  16.850
  977    HD2  HIS 120           HD2      HIS 120 -26.549  25.522  18.587
  978    HE1  HIS 120           HE1      HIS 120 -25.570  21.441  18.123
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1  -7.300  -8.509  20.796
    2    H2   MET   1           HT2      MET   1  -8.858  -9.022  21.240
    3    H3   MET   1           HT3      MET   1  -8.638  -7.513  20.490
    4    HA   MET   1           HA       MET   1  -7.909  -8.589  18.460
    5    HB2  MET   1           HB2      MET   1  -8.535 -11.114  20.030
    6    HB3  MET   1           HB1      MET   1  -8.164 -11.064  18.308
    7    HG2  MET   1           HG2      MET   1  -6.316 -10.086  20.504
    8    HG3  MET   1           HG1      MET   1  -6.165 -11.637  19.685
    9    HE1  MET   1           HE1      MET   1  -6.823 -10.709  16.411
   10    HE2  MET   1           HE2      MET   1  -6.111 -11.988  17.390
   11    HE3  MET   1           HE3      MET   1  -5.101 -11.084  16.267
   12    H    THR   2           HN       THR   2 -10.159  -7.309  19.668
   13    HA   THR   2           HA       THR   2 -12.506  -8.838  18.600
   14    HB   THR   2           HB       THR   2 -13.860  -7.203  19.870
   15    HG1  THR   2           HG1      THR   2 -12.952  -5.402  20.373
   16   HG21  THR   2          HG21      THR   2 -12.896  -9.310  20.911
   17   HG22  THR   2          HG22      THR   2 -13.357  -8.044  22.050
   18   HG23  THR   2          HG23      THR   2 -11.659  -8.282  21.635
   19    H    LEU   3           HN       LEU   3 -10.301  -6.609  17.593
   20    HA   LEU   3           HA       LEU   3 -11.859  -4.574  16.311
   21    HB2  LEU   3           HB2      LEU   3  -9.152  -5.770  15.615
   22    HB3  LEU   3           HB1      LEU   3  -9.815  -4.337  14.838
   23    HG   LEU   3           HG       LEU   3  -9.427  -4.581  17.834
   24   HD11  LEU   3          HD11      LEU   3  -7.652  -3.162  15.828
   25   HD12  LEU   3          HD12      LEU   3  -7.263  -4.711  16.577
   26   HD13  LEU   3          HD13      LEU   3  -7.402  -3.259  17.570
   27   HD21  LEU   3          HD21      LEU   3 -10.281  -2.384  15.948
   28   HD22  LEU   3          HD22      LEU   3  -9.446  -1.965  17.440
   29   HD23  LEU   3          HD23      LEU   3 -10.966  -2.845  17.505
   30    H    GLU   4           HN       GLU   4 -10.744  -7.746  15.233
   31    HA   GLU   4           HA       GLU   4 -11.648  -7.543  12.520
   32    HB2  GLU   4           HB2      GLU   4 -11.248  -9.985  14.295
   33    HB3  GLU   4           HB1      GLU   4 -11.511 -10.047  12.553
   34    HG2  GLU   4           HG2      GLU   4  -9.176 -10.110  12.680
   35    HG3  GLU   4           HG1      GLU   4  -9.474  -8.393  12.441
   36    H    LEU   5           HN       LEU   5 -13.190  -8.676  15.488
   37    HA   LEU   5           HA       LEU   5 -15.573  -9.724  14.286
   38    HB2  LEU   5           HB2      LEU   5 -14.873  -8.705  17.048
   39    HB3  LEU   5           HB1      LEU   5 -16.532  -9.163  16.664
   40    HG   LEU   5           HG       LEU   5 -15.739 -11.397  15.941
   41   HD11  LEU   5          HD11      LEU   5 -13.507 -10.999  15.226
   42   HD12  LEU   5          HD12      LEU   5 -13.347 -11.978  16.684
   43   HD13  LEU   5          HD13      LEU   5 -13.068 -10.239  16.756
   44   HD21  LEU   5          HD21      LEU   5 -14.649 -10.806  18.701
   45   HD22  LEU   5          HD22      LEU   5 -15.436 -12.277  18.133
   46   HD23  LEU   5          HD23      LEU   5 -16.380 -10.806  18.363
   47    H    GLN   6           HN       GLN   6 -14.710  -6.509  15.491
   48    HA   GLN   6           HA       GLN   6 -17.288  -5.301  15.154
   49    HB2  GLN   6           HB2      GLN   6 -14.485  -4.133  15.181
   50    HB3  GLN   6           HB1      GLN   6 -15.946  -3.146  15.125
   51    HG2  GLN   6           HG2      GLN   6 -16.727  -4.151  17.230
   52    HG3  GLN   6           HG1      GLN   6 -15.288  -5.169  17.287
   53   HE21  GLN   6          HE21      GLN   6 -14.093  -4.294  19.013
   54   HE22  GLN   6          HE22      GLN   6 -13.661  -2.658  19.144
   55    H    LEU   7           HN       LEU   7 -14.527  -5.735  12.991
   56    HA   LEU   7           HA       LEU   7 -15.432  -4.048  10.879
   57    HB2  LEU   7           HB2      LEU   7 -13.129  -4.956  10.979
   58    HB3  LEU   7           HB1      LEU   7 -13.755  -6.584  10.718
   59    HG   LEU   7           HG       LEU   7 -14.681  -5.850   8.521
   60   HD11  LEU   7          HD11      LEU   7 -13.547  -3.219   9.453
   61   HD12  LEU   7          HD12      LEU   7 -15.092  -3.555   8.670
   62   HD13  LEU   7          HD13      LEU   7 -13.610  -3.574   7.726
   63   HD21  LEU   7          HD21      LEU   7 -12.563  -6.875   8.344
   64   HD22  LEU   7          HD22      LEU   7 -11.739  -5.502   9.084
   65   HD23  LEU   7          HD23      LEU   7 -12.382  -5.367   7.448
   66    H    LYS   8           HN       LYS   8 -15.956  -7.498  11.530
   67    HA   LYS   8           HA       LYS   8 -17.444  -8.081   9.152
   68    HB2  LYS   8           HB2      LYS   8 -17.482  -9.360  11.908
   69    HB3  LYS   8           HB1      LYS   8 -18.333 -10.023  10.512
   70    HG2  LYS   8           HG2      LYS   8 -16.205 -10.175   9.277
   71    HG3  LYS   8           HG1      LYS   8 -15.348  -9.507  10.665
   72    HD2  LYS   8           HD2      LYS   8 -16.027 -11.425  12.037
   73    HD3  LYS   8           HD1      LYS   8 -16.945 -12.086  10.684
   74    HE2  LYS   8           HE2      LYS   8 -14.770 -13.198  10.815
   75    HE3  LYS   8           HE1      LYS   8 -14.841 -12.212   9.355
   76    HZ1  LYS   8           HZ1      LYS   8 -13.555 -11.463  11.925
   77    HZ2  LYS   8           HZ2      LYS   8 -13.689 -10.443  10.573
   78    HZ3  LYS   8           HZ3      LYS   8 -12.759 -11.863  10.482
   79    H    HIS   9           HN       HIS   9 -18.406  -6.942  12.361
   80    HA   HIS   9           HA       HIS   9 -21.249  -7.057  11.934
   81    HB2  HIS   9           HB2      HIS   9 -20.181  -6.849  14.178
   82    HB3  HIS   9           HB1      HIS   9 -19.650  -5.221  13.758
   83    HD1  HIS   9           HD1      HIS   9 -22.727  -7.213  14.598
   84    HD2  HIS   9           HD2      HIS   9 -21.706  -3.257  13.770
   85    HE1  HIS   9           HE1      HIS   9 -24.756  -5.812  15.179
   86    H    TYR  10           HN       TYR  10 -18.867  -4.432  11.595
   87    HA   TYR  10           HA       TYR  10 -20.707  -2.401  10.778
   88    HB2  TYR  10           HB2      TYR  10 -18.439  -1.833  11.496
   89    HB3  TYR  10           HB1      TYR  10 -17.752  -2.736  10.145
   90    HD1  TYR  10           HD1      TYR  10 -18.071  -1.943   7.809
   91    HD2  TYR  10           HD2      TYR  10 -19.403   0.358  11.183
   92    HE1  TYR  10           HE1      TYR  10 -18.306   0.052   6.354
   93    HE2  TYR  10           HE2      TYR  10 -19.636   2.354   9.729
   94    HH   TYR  10           HH       TYR  10 -19.010   2.158   6.228
   95    H    ILE  11           HN       ILE  11 -18.708  -4.654   8.874
   96    HA   ILE  11           HA       ILE  11 -19.506  -3.669   6.318
   97    HB   ILE  11           HB       ILE  11 -18.537  -6.419   7.194
   98   HG12  ILE  11          HG12      ILE  11 -17.071  -4.224   7.312
   99   HG13  ILE  11          HG11      ILE  11 -16.379  -5.690   6.625
  100   HG21  ILE  11          HG21      ILE  11 -19.652  -6.850   5.150
  101   HG22  ILE  11          HG22      ILE  11 -17.975  -6.591   4.667
  102   HG23  ILE  11          HG23      ILE  11 -19.161  -5.304   4.458
  103   HD11  ILE  11          HD11      ILE  11 -17.794  -3.721   4.832
  104   HD12  ILE  11          HD12      ILE  11 -16.558  -4.902   4.424
  105   HD13  ILE  11          HD13      ILE  11 -16.123  -3.445   5.312
  106    H    THR  12           HN       THR  12 -20.832  -6.264   8.346
  107    HA   THR  12           HA       THR  12 -22.815  -7.182   6.500
  108    HB   THR  12           HB       THR  12 -23.980  -8.003   8.623
  109    HG1  THR  12           HG1      THR  12 -21.921  -7.675  10.241
  110   HG21  THR  12          HG21      THR  12 -22.524  -9.528   7.547
  111   HG22  THR  12          HG22      THR  12 -21.994  -9.511   9.230
  112   HG23  THR  12          HG23      THR  12 -21.090  -8.613   8.010
  113    H    ASN  13           HN       ASN  13 -22.999  -4.763   9.108
  114    HA   ASN  13           HA       ASN  13 -25.782  -4.147   8.731
  115    HB2  ASN  13           HB2      ASN  13 -23.495  -2.600   9.983
  116    HB3  ASN  13           HB1      ASN  13 -25.158  -2.016   9.982
  117   HD21  ASN  13          HD21      ASN  13 -23.767  -2.672  12.418
  118   HD22  ASN  13          HD22      ASN  13 -24.537  -4.014  13.116
  119    H    LEU  14           HN       LEU  14 -22.811  -2.890   7.320
  120    HA   LEU  14           HA       LEU  14 -23.870  -0.560   6.123
  121    HB2  LEU  14           HB2      LEU  14 -21.380  -1.592   6.260
  122    HB3  LEU  14           HB1      LEU  14 -21.776  -2.163   4.645
  123    HG   LEU  14           HG       LEU  14 -20.712   0.002   4.428
  124   HD11  LEU  14          HD11      LEU  14 -22.326   1.105   3.094
  125   HD12  LEU  14          HD12      LEU  14 -23.659   0.583   4.116
  126   HD13  LEU  14          HD13      LEU  14 -22.844  -0.579   3.069
  127   HD21  LEU  14          HD21      LEU  14 -22.830   1.502   5.909
  128   HD22  LEU  14          HD22      LEU  14 -21.098   1.793   5.815
  129   HD23  LEU  14          HD23      LEU  14 -21.719   0.575   6.919
  130    H    PHE  15           HN       PHE  15 -23.537  -3.840   4.789
  131    HA   PHE  15           HA       PHE  15 -25.340  -3.044   2.519
  132    HB2  PHE  15           HB2      PHE  15 -23.297  -5.246   2.855
  133    HB3  PHE  15           HB1      PHE  15 -24.470  -5.242   1.536
  134    HD1  PHE  15           HD1      PHE  15 -24.537  -3.289  -0.051
  135    HD2  PHE  15           HD2      PHE  15 -21.376  -3.835   2.806
  136    HE1  PHE  15           HE1      PHE  15 -23.113  -1.707  -1.323
  137    HE2  PHE  15           HE2      PHE  15 -19.952  -2.251   1.533
  138    HZ   PHE  15           HZ       PHE  15 -20.822  -1.186  -0.531
  139    H    ASN  16           HN       ASN  16 -25.570  -4.365   5.503
  140    HA   ASN  16           HA       ASN  16 -27.136  -5.739   6.569
  141    HB2  ASN  16           HB2      ASN  16 -28.639  -4.993   4.054
  142    HB3  ASN  16           HB1      ASN  16 -29.364  -5.928   5.358
  143   HD21  ASN  16          HD21      ASN  16 -30.073  -3.152   4.494
  144   HD22  ASN  16          HD22      ASN  16 -29.850  -2.172   5.861
  145    H    LEU  17           HN       LEU  17 -25.085  -7.026   5.116
  146    HA   LEU  17           HA       LEU  17 -26.303  -9.234   3.650
  147    HB2  LEU  17           HB2      LEU  17 -23.432  -8.795   4.505
  148    HB3  LEU  17           HB1      LEU  17 -23.981 -10.047   3.394
  149    HG   LEU  17           HG       LEU  17 -24.619  -7.146   2.861
  150   HD11  LEU  17          HD11      LEU  17 -22.575  -7.012   1.477
  151   HD12  LEU  17          HD12      LEU  17 -22.098  -8.616   2.037
  152   HD13  LEU  17          HD13      LEU  17 -22.178  -7.273   3.176
  153   HD21  LEU  17          HD21      LEU  17 -24.331  -9.637   1.156
  154   HD22  LEU  17          HD22      LEU  17 -24.519  -8.022   0.484
  155   HD23  LEU  17          HD23      LEU  17 -25.802  -8.718   1.466
  156    HA   PRO  18           HA       PRO  18 -27.064 -12.144   6.912
  157    HB2  PRO  18           HB2      PRO  18 -25.187 -13.901   5.347
  158    HB3  PRO  18           HB1      PRO  18 -26.774 -14.296   6.041
  159    HG2  PRO  18           HG2      PRO  18 -26.469 -13.774   3.432
  160    HG3  PRO  18           HG1      PRO  18 -27.923 -13.287   4.321
  161    HD2  PRO  18           HD2      PRO  18 -25.743 -11.586   3.257
  162    HD3  PRO  18           HD1      PRO  18 -27.410 -11.156   3.696
  163    H    ARG  19           HN       ARG  19 -26.140 -12.146   8.868
  164    HA   ARG  19           HA       ARG  19 -23.226 -11.703   9.162
  165    HB2  ARG  19           HB2      ARG  19 -24.868 -10.367  10.492
  166    HB3  ARG  19           HB1      ARG  19 -25.412 -11.854  11.270
  167    HG2  ARG  19           HG2      ARG  19 -23.227 -12.231  12.229
  168    HG3  ARG  19           HG1      ARG  19 -22.541 -10.889  11.314
  169    HD2  ARG  19           HD2      ARG  19 -24.745 -10.593  13.380
  170    HD3  ARG  19           HD1      ARG  19 -23.034 -10.303  13.701
  171    HE   ARG  19           HE       ARG  19 -23.574  -8.698  11.503
  172   HH11  ARG  19          HH21      ARG  19 -24.934  -9.137  14.665
  173   HH12  ARG  19          HH22      ARG  19 -25.450  -7.489  14.800
  174   HH21  ARG  19          HH11      ARG  19 -24.249  -6.561  11.687
  175   HH22  ARG  19          HH12      ARG  19 -25.063  -6.039  13.124
  176    H    ASP  20           HN       ASP  20 -25.497 -14.272   9.273
  177    HA   ASP  20           HA       ASP  20 -23.901 -15.979  11.073
  178    HB2  ASP  20           HB2      ASP  20 -26.435 -16.022  10.943
  179    HB3  ASP  20           HB1      ASP  20 -26.273 -16.758   9.347
  180    H    GLU  21           HN       GLU  21 -23.237 -14.955   8.117
  181    HA   GLU  21           HA       GLU  21 -22.486 -17.622   6.976
  182    HB2  GLU  21           HB2      GLU  21 -22.588 -14.853   5.741
  183    HB3  GLU  21           HB1      GLU  21 -21.938 -16.267   4.916
  184    HG2  GLU  21           HG2      GLU  21 -24.756 -16.073   6.022
  185    HG3  GLU  21           HG1      GLU  21 -24.324 -15.829   4.328
  186    H    LYS  22           HN       LYS  22 -20.530 -18.304   7.422
  187    HA   LYS  22           HA       LYS  22 -18.448 -16.485   8.371
  188    HB2  LYS  22           HB2      LYS  22 -18.676 -18.688   9.425
  189    HB3  LYS  22           HB1      LYS  22 -18.401 -19.481   7.876
  190    HG2  LYS  22           HG2      LYS  22 -16.328 -19.480   9.181
  191    HG3  LYS  22           HG1      LYS  22 -16.128 -18.436   7.783
  192    HD2  LYS  22           HD2      LYS  22 -16.311 -16.461   9.070
  193    HD3  LYS  22           HD1      LYS  22 -17.052 -17.310  10.430
  194    HE2  LYS  22           HE2      LYS  22 -14.927 -18.476  10.849
  195    HE3  LYS  22           HE1      LYS  22 -14.196 -17.654   9.472
  196    HZ1  LYS  22           HZ1      LYS  22 -14.305 -15.605  10.538
  197    HZ2  LYS  22           HZ2      LYS  22 -13.834 -16.667  11.778
  198    HZ3  LYS  22           HZ3      LYS  22 -15.445 -16.135  11.677
  199    H    TRP  23           HN       TRP  23 -16.576 -15.976   7.299
  200    HA   TRP  23           HA       TRP  23 -16.572 -16.490   4.354
  201    HB2  TRP  23           HB2      TRP  23 -14.911 -14.461   5.863
  202    HB3  TRP  23           HB1      TRP  23 -15.264 -14.504   4.138
  203    HD1  TRP  23           HD1      TRP  23 -18.467 -15.238   4.829
  204    HE1  TRP  23           HE1      TRP  23 -19.980 -13.239   5.419
  205    HE3  TRP  23           HE3      TRP  23 -14.921 -11.793   6.119
  206    HZ2  TRP  23           HZ2      TRP  23 -19.726 -10.539   6.319
  207    HZ3  TRP  23           HZ3      TRP  23 -15.587  -9.516   6.839
  208    HH2  TRP  23           HH2      TRP  23 -17.983  -8.886   6.940
  209    H    GLU  24           HN       GLU  24 -14.257 -16.454   3.451
  210    HA   GLU  24           HA       GLU  24 -12.613 -18.411   5.030
  211    HB2  GLU  24           HB2      GLU  24 -12.847 -17.922   2.046
  212    HB3  GLU  24           HB1      GLU  24 -11.658 -19.000   2.778
  213    HG2  GLU  24           HG2      GLU  24 -13.452 -20.333   3.789
  214    HG3  GLU  24           HG1      GLU  24 -14.662 -19.243   3.114
  215    H    CYS  25           HN       CYS  25 -10.794 -17.671   5.816
  216    HA   CYS  25           HA       CYS  25  -9.773 -15.027   5.099
  217    HB2  CYS  25           HB2      CYS  25  -9.828 -16.106   7.447
  218    HB3  CYS  25           HB1      CYS  25  -8.408 -17.011   6.924
  219    HG   CYS  25           HG       CYS  25  -8.497 -13.886   7.084
  220    H    GLU  26           HN       GLU  26  -8.116 -14.588   3.814
  221    HA   GLU  26           HA       GLU  26  -6.387 -16.838   2.825
  222    HB2  GLU  26           HB2      GLU  26  -8.099 -15.925   1.152
  223    HB3  GLU  26           HB1      GLU  26  -7.180 -14.420   1.187
  224    HG2  GLU  26           HG2      GLU  26  -6.309 -15.704  -0.645
  225    HG3  GLU  26           HG1      GLU  26  -5.119 -15.803   0.650
  226    H    SER  27           HN       SER  27  -4.375 -16.528   3.436
  227    HA   SER  27           HA       SER  27  -3.441 -13.796   4.187
  228    HB2  SER  27           HB2      SER  27  -3.218 -15.785   5.762
  229    HB3  SER  27           HB1      SER  27  -2.019 -16.430   4.644
  230    HG   SER  27           HG       SER  27  -1.472 -14.857   6.533
  231    H    ILE  28           HN       ILE  28  -2.194 -12.714   2.866
  232    HA   ILE  28           HA       ILE  28  -0.213 -14.063   1.147
  233    HB   ILE  28           HB       ILE  28  -0.975 -12.846  -0.874
  234   HG12  ILE  28          HG12      ILE  28  -3.447 -12.218   0.778
  235   HG13  ILE  28          HG11      ILE  28  -2.211 -11.035   0.351
  236   HG21  ILE  28          HG21      ILE  28  -1.702 -15.216  -0.244
  237   HG22  ILE  28          HG22      ILE  28  -2.705 -14.380  -1.430
  238   HG23  ILE  28          HG23      ILE  28  -3.236 -14.499   0.247
  239   HD11  ILE  28          HD11      ILE  28  -2.636 -11.735  -2.094
  240   HD12  ILE  28          HD12      ILE  28  -3.881 -10.764  -1.308
  241   HD13  ILE  28          HD13      ILE  28  -4.102 -12.506  -1.486
  242    H    GLU  29           HN       GLU  29   1.394 -12.616   0.373
  243    HA   GLU  29           HA       GLU  29   1.625 -10.132   2.022
  244    HB2  GLU  29           HB2      GLU  29   3.762 -11.602   0.445
  245    HB3  GLU  29           HB1      GLU  29   4.013 -10.288   1.596
  246    HG2  GLU  29           HG2      GLU  29   2.803 -12.984   2.281
  247    HG3  GLU  29           HG1      GLU  29   4.465 -12.505   2.615
  248    H    GLU  30           HN       GLU  30   1.346  -8.239   1.069
  249    HA   GLU  30           HA       GLU  30   2.003  -7.911  -1.828
  250    HB2  GLU  30           HB2      GLU  30  -0.656  -7.245  -0.535
  251    HB3  GLU  30           HB1      GLU  30  -0.146  -6.605  -2.099
  252    HG2  GLU  30           HG2      GLU  30   0.119  -8.897  -2.962
  253    HG3  GLU  30           HG1      GLU  30  -0.370  -9.548  -1.399
  254    H    VAL  31           HN       VAL  31   2.362  -5.745  -2.431
  255    HA   VAL  31           HA       VAL  31   3.610  -4.126  -0.367
  256    HB   VAL  31           HB       VAL  31   3.067  -3.360  -3.248
  257   HG11  VAL  31          HG11      VAL  31   5.303  -2.568  -1.363
  258   HG12  VAL  31          HG12      VAL  31   3.847  -1.603  -1.609
  259   HG13  VAL  31          HG13      VAL  31   4.956  -1.884  -2.951
  260   HG21  VAL  31          HG21      VAL  31   5.331  -4.306  -3.694
  261   HG22  VAL  31          HG22      VAL  31   4.183  -5.546  -3.188
  262   HG23  VAL  31          HG23      VAL  31   5.374  -4.926  -2.044
  263    H    ALA  32           HN       ALA  32   2.849  -2.337   0.589
  264    HA   ALA  32           HA       ALA  32   0.095  -1.813   0.850
  265    HB1  ALA  32           HB1      ALA  32   0.866   0.422   1.785
  266    HB2  ALA  32           HB2      ALA  32   2.504  -0.022   1.304
  267    HB3  ALA  32           HB3      ALA  32   1.648  -0.985   2.506
  268    H    ASP  33           HN       ASP  33   2.498  -0.164  -1.206
  269    HA   ASP  33           HA       ASP  33   0.709   1.809  -2.245
  270    HB2  ASP  33           HB2      ASP  33   2.401   2.062  -4.059
  271    HB3  ASP  33           HB1      ASP  33   3.132   2.044  -2.457
  272    H    ASP  34           HN       ASP  34   0.552  -1.486  -2.622
  273    HA   ASP  34           HA       ASP  34  -0.469  -1.404  -5.423
  274    HB2  ASP  34           HB2      ASP  34   1.052  -3.266  -4.625
  275    HB3  ASP  34           HB1      ASP  34  -0.253  -3.790  -3.558
  276    H    ILE  35           HN       ILE  35  -1.553  -1.549  -2.115
  277    HA   ILE  35           HA       ILE  35  -4.396  -1.874  -3.061
  278    HB   ILE  35           HB       ILE  35  -4.835  -2.637  -0.691
  279   HG12  ILE  35          HG12      ILE  35  -1.816  -2.941  -0.589
  280   HG13  ILE  35          HG11      ILE  35  -2.697  -1.659   0.239
  281   HG21  ILE  35          HG21      ILE  35  -2.842  -4.326  -2.223
  282   HG22  ILE  35          HG22      ILE  35  -4.544  -4.172  -2.655
  283   HG23  ILE  35          HG23      ILE  35  -4.089  -4.901  -1.116
  284   HD11  ILE  35          HD11      ILE  35  -3.158  -4.628   0.648
  285   HD12  ILE  35          HD12      ILE  35  -3.976  -3.324   1.507
  286   HD13  ILE  35          HD13      ILE  35  -2.248  -3.584   1.739
  287    H    LEU  36           HN       LEU  36  -2.082   0.156  -1.613
  288    HA   LEU  36           HA       LEU  36  -4.221   2.002  -0.603
  289    HB2  LEU  36           HB2      LEU  36  -1.380   1.593   0.313
  290    HB3  LEU  36           HB1      LEU  36  -2.326   3.007   0.752
  291    HG   LEU  36           HG       LEU  36  -3.559   0.295   1.172
  292   HD11  LEU  36          HD11      LEU  36  -1.434   1.570   2.910
  293   HD12  LEU  36          HD12      LEU  36  -1.419  -0.046   2.203
  294   HD13  LEU  36          HD13      LEU  36  -2.553   0.339   3.498
  295   HD21  LEU  36          HD21      LEU  36  -4.799   2.465   1.529
  296   HD22  LEU  36          HD22      LEU  36  -3.640   2.859   2.791
  297   HD23  LEU  36          HD23      LEU  36  -4.696   1.462   2.973
  298    HA   PRO  37           HA       PRO  37  -2.643   3.958  -4.471
  299    HB2  PRO  37           HB2      PRO  37  -4.921   5.759  -3.719
  300    HB3  PRO  37           HB1      PRO  37  -4.515   5.058  -5.299
  301    HG2  PRO  37           HG2      PRO  37  -6.519   4.089  -3.837
  302    HG3  PRO  37           HG1      PRO  37  -5.469   3.017  -4.783
  303    HD2  PRO  37           HD2      PRO  37  -5.515   3.480  -1.825
  304    HD3  PRO  37           HD1      PRO  37  -5.140   1.995  -2.733
  305    H    ASP  38           HN       ASP  38  -1.552   5.917  -4.834
  306    HA   ASP  38           HA       ASP  38   0.016   7.014  -2.841
  307    HB2  ASP  38           HB2      ASP  38  -1.074   8.342  -5.343
  308    HB3  ASP  38           HB1      ASP  38   0.162   9.079  -4.325
  309    H    GLN  39           HN       GLN  39  -3.343   7.464  -3.242
  310    HA   GLN  39           HA       GLN  39  -3.721  10.077  -2.153
  311    HB2  GLN  39           HB2      GLN  39  -5.528   8.792  -3.264
  312    HB3  GLN  39           HB1      GLN  39  -5.526   7.640  -1.928
  313    HG2  GLN  39           HG2      GLN  39  -6.199   9.371  -0.361
  314    HG3  GLN  39           HG1      GLN  39  -6.041  10.610  -1.604
  315   HE21  GLN  39          HE21      GLN  39  -8.520  10.160  -0.223
  316   HE22  GLN  39          HE22      GLN  39  -9.650   9.560  -1.340
  317    H    TYR  40           HN       TYR  40  -3.404   6.894  -0.594
  318    HA   TYR  40           HA       TYR  40  -3.400   8.262   2.086
  319    HB2  TYR  40           HB2      TYR  40  -3.879   5.357   1.346
  320    HB3  TYR  40           HB1      TYR  40  -3.827   5.986   2.994
  321    HD1  TYR  40           HD1      TYR  40  -5.701   6.022  -0.196
  322    HD2  TYR  40           HD2      TYR  40  -5.611   7.337   3.892
  323    HE1  TYR  40           HE1      TYR  40  -8.080   6.703  -0.363
  324    HE2  TYR  40           HE2      TYR  40  -7.990   8.017   3.726
  325    HH   TYR  40           HH       TYR  40  -9.893   7.349   0.812
  326    H    VAL  41           HN       VAL  41  -1.232   7.494  -0.156
  327    HA   VAL  41           HA       VAL  41   0.826   6.706   1.886
  328    HB   VAL  41           HB       VAL  41   0.907   5.707  -0.970
  329   HG11  VAL  41          HG11      VAL  41   2.968   5.721   0.464
  330   HG12  VAL  41          HG12      VAL  41   2.473   4.100  -0.029
  331   HG13  VAL  41          HG13      VAL  41   2.127   4.671   1.605
  332   HG21  VAL  41          HG21      VAL  41  -1.145   4.807  -0.109
  333   HG22  VAL  41          HG22      VAL  41  -0.414   4.470   1.460
  334   HG23  VAL  41          HG23      VAL  41   0.060   3.528   0.046
  335    H    ARG  42           HN       ARG  42   0.429   9.304   1.345
  336    HA   ARG  42           HA       ARG  42   1.873  10.368  -0.909
  337    HB2  ARG  42           HB2      ARG  42   1.163  11.570   1.788
  338    HB3  ARG  42           HB1      ARG  42   1.901  12.485   0.474
  339    HG2  ARG  42           HG2      ARG  42  -0.000  11.957  -0.988
  340    HG3  ARG  42           HG1      ARG  42  -0.736  10.996   0.295
  341    HD2  ARG  42           HD2      ARG  42  -0.855  13.006   1.734
  342    HD3  ARG  42           HD1      ARG  42  -0.130  13.968   0.445
  343    HE   ARG  42           HE       ARG  42  -2.414  12.699  -0.649
  344   HH11  ARG  42          HH21      ARG  42  -1.579  15.015   1.800
  345   HH12  ARG  42          HH22      ARG  42  -3.077  15.875   1.661
  346   HH21  ARG  42          HH11      ARG  42  -4.348  13.825  -0.824
  347   HH22  ARG  42          HH12      ARG  42  -4.634  15.205   0.183
  348    H    LEU  43           HN       LEU  43   3.829   9.185  -0.957
  349    HA   LEU  43           HA       LEU  43   6.079   8.741  -0.483
  350    HB2  LEU  43           HB2      LEU  43   5.676  11.554   0.541
  351    HB3  LEU  43           HB1      LEU  43   7.245  10.759   0.683
  352    HG   LEU  43           HG       LEU  43   7.296  10.376  -1.744
  353   HD11  LEU  43          HD11      LEU  43   4.566  11.668  -1.610
  354   HD12  LEU  43          HD12      LEU  43   5.002  10.114  -2.322
  355   HD13  LEU  43          HD13      LEU  43   5.500  11.613  -3.104
  356   HD21  LEU  43          HD21      LEU  43   7.678  12.655  -2.417
  357   HD22  LEU  43          HD22      LEU  43   8.090  12.559  -0.705
  358   HD23  LEU  43          HD23      LEU  43   6.553  13.264  -1.204
  359    H    GLY  44           HN       GLY  44   3.788   8.521   1.688
  360    HA2  GLY  44           HA2      GLY  44   4.864   8.668   4.272
  361    HA3  GLY  44           HA1      GLY  44   3.638   7.501   3.789
  362    HA   PRO  45           HA       PRO  45   7.820   5.439   4.689
  363    HB2  PRO  45           HB2      PRO  45   7.214   4.325   7.132
  364    HB3  PRO  45           HB1      PRO  45   7.946   5.930   6.949
  365    HG2  PRO  45           HG2      PRO  45   5.101   5.201   7.480
  366    HG3  PRO  45           HG1      PRO  45   6.065   6.538   8.131
  367    HD2  PRO  45           HD2      PRO  45   4.240   6.850   6.097
  368    HD3  PRO  45           HD1      PRO  45   5.661   7.897   6.308
  369    H    LEU  46           HN       LEU  46   4.512   4.621   4.539
  370    HA   LEU  46           HA       LEU  46   4.858   1.708   4.648
  371    HB2  LEU  46           HB2      LEU  46   2.522   3.436   3.745
  372    HB3  LEU  46           HB1      LEU  46   2.460   1.686   3.944
  373    HG   LEU  46           HG       LEU  46   3.134   3.652   6.156
  374   HD11  LEU  46          HD11      LEU  46   0.603   2.036   5.739
  375   HD12  LEU  46          HD12      LEU  46   0.755   3.744   5.329
  376   HD13  LEU  46          HD13      LEU  46   0.907   3.222   7.005
  377   HD21  LEU  46          HD21      LEU  46   2.527   1.451   7.494
  378   HD22  LEU  46          HD22      LEU  46   4.136   1.634   6.810
  379   HD23  LEU  46          HD23      LEU  46   2.935   0.645   5.979
  380    H    SER  47           HN       SER  47   5.487   4.093   2.392
  381    HA   SER  47           HA       SER  47   4.647   2.911  -0.061
  382    HB2  SER  47           HB2      SER  47   5.955   4.543  -1.101
  383    HB3  SER  47           HB1      SER  47   5.689   5.269   0.482
  384    HG   SER  47           HG       SER  47   7.764   3.801   0.837
  385    H    ASN  48           HN       ASN  48   5.426   1.330  -1.257
  386    HA   ASN  48           HA       ASN  48   6.623  -0.561  -1.895
  387    HB2  ASN  48           HB2      ASN  48   9.013   1.033  -0.941
  388    HB3  ASN  48           HB1      ASN  48   9.018  -0.294  -2.104
  389   HD21  ASN  48          HD21      ASN  48   6.723   0.419  -3.655
  390   HD22  ASN  48          HD22      ASN  48   7.049   1.877  -4.461
  391    H    LYS  49           HN       LYS  49   5.615  -0.480   0.852
  392    HA   LYS  49           HA       LYS  49   7.693  -2.132   2.265
  393    HB2  LYS  49           HB2      LYS  49   6.871  -0.135   3.494
  394    HB3  LYS  49           HB1      LYS  49   5.234  -0.793   3.425
  395    HG2  LYS  49           HG2      LYS  49   5.954  -2.788   4.660
  396    HG3  LYS  49           HG1      LYS  49   7.615  -2.198   4.676
  397    HD2  LYS  49           HD2      LYS  49   6.897  -0.222   5.975
  398    HD3  LYS  49           HD1      LYS  49   5.239  -0.826   5.970
  399    HE2  LYS  49           HE2      LYS  49   6.313  -1.437   8.078
  400    HE3  LYS  49           HE1      LYS  49   6.027  -2.893   7.125
  401    HZ1  LYS  49           HZ1      LYS  49   8.460  -1.904   8.094
  402    HZ2  LYS  49           HZ2      LYS  49   8.514  -1.845   6.397
  403    HZ3  LYS  49           HZ3      LYS  49   8.185  -3.311   7.189
  404    H    ILE  50           HN       ILE  50   7.286  -4.199   2.739
  405    HA   ILE  50           HA       ILE  50   4.928  -5.477   1.527
  406    HB   ILE  50           HB       ILE  50   7.097  -6.813   3.167
  407   HG12  ILE  50          HG12      ILE  50   8.250  -5.503   1.486
  408   HG13  ILE  50          HG11      ILE  50   8.219  -7.176   0.927
  409   HG21  ILE  50          HG21      ILE  50   5.037  -8.095   2.546
  410   HG22  ILE  50          HG22      ILE  50   6.504  -8.756   1.822
  411   HG23  ILE  50          HG23      ILE  50   5.400  -7.784   0.850
  412   HD11  ILE  50          HD11      ILE  50   6.554  -4.848  -0.026
  413   HD12  ILE  50          HD12      ILE  50   6.047  -6.510  -0.323
  414   HD13  ILE  50          HD13      ILE  50   7.574  -5.924  -0.975
  415    H    LEU  51           HN       LEU  51   3.110  -5.730   2.601
  416    HA   LEU  51           HA       LEU  51   3.160  -6.009   5.594
  417    HB2  LEU  51           HB2      LEU  51   1.027  -4.687   3.887
  418    HB3  LEU  51           HB1      LEU  51   1.012  -4.842   5.644
  419    HG   LEU  51           HG       LEU  51   3.114  -3.352   4.045
  420   HD11  LEU  51          HD11      LEU  51   1.045  -2.198   5.922
  421   HD12  LEU  51          HD12      LEU  51   0.759  -2.347   4.188
  422   HD13  LEU  51          HD13      LEU  51   2.078  -1.337   4.783
  423   HD21  LEU  51          HD21      LEU  51   3.525  -2.482   6.520
  424   HD22  LEU  51          HD22      LEU  51   4.237  -4.001   5.988
  425   HD23  LEU  51          HD23      LEU  51   2.769  -4.013   6.966
  426    H    GLN  52           HN       GLN  52   1.743  -7.454   6.505
  427    HA   GLN  52           HA       GLN  52   1.027  -9.752   4.859
  428    HB2  GLN  52           HB2      GLN  52   0.393  -9.123   7.763
  429    HB3  GLN  52           HB1      GLN  52   0.204 -10.697   6.988
  430    HG2  GLN  52           HG2      GLN  52   2.641 -10.696   6.467
  431    HG3  GLN  52           HG1      GLN  52   2.805  -9.178   7.340
  432   HE21  GLN  52          HE21      GLN  52   2.764  -9.241   9.662
  433   HE22  GLN  52          HE22      GLN  52   2.736 -10.697  10.536
  434    H    THR  53           HN       THR  53  -0.610  -9.369   3.466
  435    HA   THR  53           HA       THR  53  -3.031  -7.898   4.343
  436    HB   THR  53           HB       THR  53  -2.175  -9.004   1.649
  437    HG1  THR  53           HG1      THR  53  -2.642  -6.361   1.849
  438   HG21  THR  53          HG21      THR  53  -4.150  -7.523   0.889
  439   HG22  THR  53          HG22      THR  53  -4.696  -7.616   2.563
  440   HG23  THR  53          HG23      THR  53  -4.538  -9.088   1.603
  441    H    ASN  54           HN       ASN  54  -4.742  -8.914   5.087
  442    HA   ASN  54           HA       ASN  54  -5.117 -11.845   4.529
  443    HB2  ASN  54           HB2      ASN  54  -6.050 -10.108   6.840
  444    HB3  ASN  54           HB1      ASN  54  -6.566 -11.775   6.591
  445   HD21  ASN  54          HD21      ASN  54  -3.635 -12.157   5.433
  446   HD22  ASN  54          HD22      ASN  54  -2.726 -12.416   6.840
  447    H    THR  55           HN       THR  55  -6.253 -11.568   2.594
  448    HA   THR  55           HA       THR  55  -8.678  -9.869   2.554
  449    HB   THR  55           HB       THR  55  -7.540 -11.659   0.385
  450    HG1  THR  55           HG1      THR  55  -7.097  -8.979   1.131
  451   HG21  THR  55          HG21      THR  55  -8.899 -10.040  -1.042
  452   HG22  THR  55          HG22      THR  55  -9.650  -9.495   0.457
  453   HG23  THR  55          HG23      THR  55  -9.837 -11.169  -0.064
  454    H    TYR  56           HN       TYR  56 -10.628 -10.628   2.962
  455    HA   TYR  56           HA       TYR  56 -11.041 -13.561   3.287
  456    HB2  TYR  56           HB2      TYR  56 -12.748 -11.183   4.095
  457    HB3  TYR  56           HB1      TYR  56 -13.164 -12.869   4.395
  458    HD1  TYR  56           HD2      TYR  56 -10.713 -10.188   5.164
  459    HD2  TYR  56           HD1      TYR  56 -12.126 -14.124   6.146
  460    HE1  TYR  56           HE2      TYR  56  -9.325 -10.174   7.222
  461    HE2  TYR  56           HE1      TYR  56 -10.740 -14.106   8.204
  462    HH   TYR  56           HH       TYR  56  -9.292 -11.286   9.423
  463    H    TYR  57           HN       TYR  57 -12.406 -14.679   1.997
  464    HA   TYR  57           HA       TYR  57 -14.061 -13.193  -0.006
  465    HB2  TYR  57           HB2      TYR  57 -13.314 -14.645  -1.792
  466    HB3  TYR  57           HB1      TYR  57 -11.901 -13.899  -1.052
  467    HD1  TYR  57           HD2      TYR  57 -10.748 -15.261   0.878
  468    HD2  TYR  57           HD1      TYR  57 -13.392 -16.981  -2.040
  469    HE1  TYR  57           HE2      TYR  57  -9.803 -17.509   1.339
  470    HE2  TYR  57           HE1      TYR  57 -12.441 -19.224  -1.580
  471    HH   TYR  57           HH       TYR  57 -10.563 -19.903   1.116
  472    H    SER  58           HN       SER  58 -16.054 -13.910  -0.048
  473    HA   SER  58           HA       SER  58 -16.656 -16.744   0.654
  474    HB2  SER  58           HB2      SER  58 -18.243 -16.201   2.279
  475    HB3  SER  58           HB1      SER  58 -16.959 -15.042   2.607
  476    HG   SER  58           HG       SER  58 -19.506 -14.607   1.874
  477    H    ASP  59           HN       ASP  59 -18.931 -17.287   0.084
  478    HA   ASP  59           HA       ASP  59 -19.477 -16.713  -2.655
  479    HB2  ASP  59           HB2      ASP  59 -21.176 -17.880  -0.428
  480    HB3  ASP  59           HB1      ASP  59 -21.757 -17.750  -2.086
  481    H    THR  60           HN       THR  60 -20.975 -15.507   0.336
  482    HA   THR  60           HA       THR  60 -22.913 -13.802  -0.934
  483    HB   THR  60           HB       THR  60 -21.640 -13.375   1.790
  484    HG1  THR  60           HG1      THR  60 -23.899 -14.665   2.010
  485   HG21  THR  60          HG21      THR  60 -24.435 -12.810   0.785
  486   HG22  THR  60          HG22      THR  60 -23.145 -11.610   0.839
  487   HG23  THR  60          HG23      THR  60 -23.742 -12.328   2.333
  488    H    LEU  61           HN       LEU  61 -19.653 -13.179   0.359
  489    HA   LEU  61           HA       LEU  61 -19.598 -10.374  -0.161
  490    HB2  LEU  61           HB2      LEU  61 -17.376 -12.436  -0.022
  491    HB3  LEU  61           HB1      LEU  61 -17.072 -10.708  -0.168
  492    HG   LEU  61           HG       LEU  61 -18.715 -11.960   2.056
  493   HD11  LEU  61          HD11      LEU  61 -15.799 -11.158   1.925
  494   HD12  LEU  61          HD12      LEU  61 -16.465 -12.733   2.357
  495   HD13  LEU  61          HD13      LEU  61 -16.664 -11.360   3.447
  496   HD21  LEU  61          HD21      LEU  61 -17.822  -9.159   1.375
  497   HD22  LEU  61          HD22      LEU  61 -17.993  -9.611   3.069
  498   HD23  LEU  61          HD23      LEU  61 -19.376  -9.715   1.992
  499    H    HIS  62           HN       HIS  62 -18.617 -13.125  -2.158
  500    HA   HIS  62           HA       HIS  62 -17.569 -11.611  -4.349
  501    HB2  HIS  62           HB2      HIS  62 -17.199 -14.047  -4.078
  502    HB3  HIS  62           HB1      HIS  62 -18.914 -14.339  -4.376
  503    HD1  HIS  62           HD1      HIS  62 -16.093 -12.457  -6.141
  504    HD2  HIS  62           HD2      HIS  62 -19.366 -14.878  -7.038
  505    HE1  HIS  62           HE1      HIS  62 -16.100 -12.748  -8.657
  506    H    LYS  63           HN       LYS  63 -20.819 -12.803  -3.606
  507    HA   LYS  63           HA       LYS  63 -22.061 -11.996  -6.061
  508    HB2  LYS  63           HB2      LYS  63 -23.083 -13.578  -4.421
  509    HB3  LYS  63           HB1      LYS  63 -23.320 -12.231  -3.304
  510    HG2  LYS  63           HG2      LYS  63 -24.748 -11.096  -4.920
  511    HG3  LYS  63           HG1      LYS  63 -24.454 -12.363  -6.111
  512    HD2  LYS  63           HD2      LYS  63 -25.508 -14.015  -4.604
  513    HD3  LYS  63           HD1      LYS  63 -25.820 -12.736  -3.429
  514    HE2  LYS  63           HE2      LYS  63 -27.218 -11.550  -5.072
  515    HE3  LYS  63           HE1      LYS  63 -26.891 -12.805  -6.267
  516    HZ1  LYS  63           HZ1      LYS  63 -28.638 -13.871  -5.449
  517    HZ2  LYS  63           HZ2      LYS  63 -28.782 -12.792  -4.144
  518    HZ3  LYS  63           HZ3      LYS  63 -27.753 -14.139  -4.027
  519    H    SER  64           HN       SER  64 -21.545 -10.339  -2.972
  520    HA   SER  64           HA       SER  64 -22.987  -7.934  -3.826
  521    HB2  SER  64           HB2      SER  64 -22.232  -7.003  -1.679
  522    HB3  SER  64           HB1      SER  64 -22.909  -8.611  -1.446
  523    HG   SER  64           HG       SER  64 -20.526  -7.755  -0.759
  524    H    ASN  65           HN       ASN  65 -20.065  -9.221  -4.627
  525    HA   ASN  65           HA       ASN  65 -18.143  -8.399  -5.663
  526    HB2  ASN  65           HB2      ASN  65 -19.991  -6.035  -6.062
  527    HB3  ASN  65           HB1      ASN  65 -18.370  -6.112  -6.737
  528   HD21  ASN  65          HD21      ASN  65 -20.649  -5.987  -8.433
  529   HD22  ASN  65          HD22      ASN  65 -20.796  -7.461  -9.261
  530    H    ILE  66           HN       ILE  66 -18.364  -8.152  -2.813
  531    HA   ILE  66           HA       ILE  66 -16.814  -5.624  -2.299
  532    HB   ILE  66           HB       ILE  66 -18.257  -7.383  -0.291
  533   HG12  ILE  66          HG12      ILE  66 -19.905  -6.370  -1.769
  534   HG13  ILE  66          HG11      ILE  66 -19.917  -5.496  -0.240
  535   HG21  ILE  66          HG21      ILE  66 -17.028  -4.615  -0.120
  536   HG22  ILE  66          HG22      ILE  66 -16.399  -6.077   0.637
  537   HG23  ILE  66          HG23      ILE  66 -17.936  -5.397   1.173
  538   HD11  ILE  66          HD11      ILE  66 -19.892  -3.752  -1.800
  539   HD12  ILE  66          HD12      ILE  66 -18.839  -4.627  -2.909
  540   HD13  ILE  66          HD13      ILE  66 -18.177  -3.921  -1.437
  541    H    TYR  67           HN       TYR  67 -14.748  -5.822  -1.768
  542    HA   TYR  67           HA       TYR  67 -13.679  -8.534  -1.033
  543    HB2  TYR  67           HB2      TYR  67 -12.252  -6.311  -2.500
  544    HB3  TYR  67           HB1      TYR  67 -11.603  -7.905  -2.118
  545    HD1  TYR  67           HD1      TYR  67 -14.027  -6.047  -4.194
  546    HD2  TYR  67           HD2      TYR  67 -12.327  -9.892  -3.309
  547    HE1  TYR  67           HE1      TYR  67 -15.026  -6.968  -6.270
  548    HE2  TYR  67           HE2      TYR  67 -13.326 -10.811  -5.384
  549    HH   TYR  67           HH       TYR  67 -15.184  -8.734  -7.606
  550    HA   PRO  68           HA       PRO  68 -12.678  -5.722   2.489
  551    HB2  PRO  68           HB2      PRO  68 -13.287  -7.465   4.500
  552    HB3  PRO  68           HB1      PRO  68 -14.502  -6.443   3.711
  553    HG2  PRO  68           HG2      PRO  68 -13.941  -9.336   3.344
  554    HG3  PRO  68           HG1      PRO  68 -15.478  -8.467   3.248
  555    HD2  PRO  68           HD2      PRO  68 -13.952  -9.299   1.055
  556    HD3  PRO  68           HD1      PRO  68 -15.225  -8.063   0.996
  557    H    PHE  69           HN       PHE  69 -10.783  -5.667   3.683
  558    HA   PHE  69           HA       PHE  69  -9.167  -8.117   3.991
  559    HB2  PHE  69           HB2      PHE  69  -7.230  -7.209   2.818
  560    HB3  PHE  69           HB1      PHE  69  -8.605  -7.283   1.718
  561    HD1  PHE  69           HD1      PHE  69  -9.793  -5.231   1.035
  562    HD2  PHE  69           HD2      PHE  69  -6.348  -5.075   3.599
  563    HE1  PHE  69           HE1      PHE  69  -9.586  -2.796   0.613
  564    HE2  PHE  69           HE2      PHE  69  -6.145  -2.639   3.176
  565    HZ   PHE  69           HZ       PHE  69  -7.764  -1.499   1.683
  566    H    ILE  70           HN       ILE  70  -7.357  -7.821   5.373
  567    HA   ILE  70           HA       ILE  70  -7.268  -5.271   6.937
  568    HB   ILE  70           HB       ILE  70  -7.328  -8.071   8.113
  569   HG12  ILE  70          HG12      ILE  70  -9.228  -5.749   8.550
  570   HG13  ILE  70          HG11      ILE  70  -9.534  -7.032   7.381
  571   HG21  ILE  70          HG21      ILE  70  -5.801  -6.791   9.413
  572   HG22  ILE  70          HG22      ILE  70  -7.333  -6.666  10.277
  573   HG23  ILE  70          HG23      ILE  70  -6.777  -5.331   9.269
  574   HD11  ILE  70          HD11      ILE  70  -9.418  -8.712   9.181
  575   HD12  ILE  70          HD12      ILE  70 -10.651  -7.505   9.539
  576   HD13  ILE  70          HD13      ILE  70  -9.090  -7.436  10.353
  577    H    LEU  71           HN       LEU  71  -5.230  -4.652   7.469
  578    HA   LEU  71           HA       LEU  71  -2.981  -6.367   6.475
  579    HB2  LEU  71           HB2      LEU  71  -2.929  -3.416   7.166
  580    HB3  LEU  71           HB1      LEU  71  -1.709  -4.332   6.285
  581    HG   LEU  71           HG       LEU  71  -4.523  -3.688   5.366
  582   HD11  LEU  71          HD11      LEU  71  -1.900  -3.087   3.995
  583   HD12  LEU  71          HD12      LEU  71  -2.597  -1.984   5.179
  584   HD13  LEU  71          HD13      LEU  71  -3.479  -2.361   3.699
  585   HD21  LEU  71          HD21      LEU  71  -2.465  -5.630   4.307
  586   HD22  LEU  71          HD22      LEU  71  -3.636  -4.879   3.225
  587   HD23  LEU  71          HD23      LEU  71  -4.192  -5.882   4.559
  588    H    TYR  72           HN       TYR  72  -1.535  -7.150   7.813
  589    HA   TYR  72           HA       TYR  72  -1.517  -6.237  10.678
  590    HB2  TYR  72           HB2      TYR  72  -1.124  -9.023   9.542
  591    HB3  TYR  72           HB1      TYR  72  -0.870  -8.585  11.230
  592    HD1  TYR  72           HD2      TYR  72  -2.796  -7.673  12.575
  593    HD2  TYR  72           HD1      TYR  72  -3.316  -9.408   8.681
  594    HE1  TYR  72           HE2      TYR  72  -5.218  -7.954  13.024
  595    HE2  TYR  72           HE1      TYR  72  -5.739  -9.691   9.132
  596    HH   TYR  72           HH       TYR  72  -7.112  -8.977  12.309
  597    H    TYR  73           HN       TYR  73   0.442  -5.923  11.600
  598    HA   TYR  73           HA       TYR  73   2.925  -6.700  10.191
  599    HB2  TYR  73           HB2      TYR  73   2.353  -4.482   9.254
  600    HB3  TYR  73           HB1      TYR  73   2.301  -3.812  10.885
  601    HD1  TYR  73           HD1      TYR  73   4.523  -5.554   8.445
  602    HD2  TYR  73           HD2      TYR  73   4.292  -3.123  11.980
  603    HE1  TYR  73           HE1      TYR  73   6.980  -5.223   8.379
  604    HE2  TYR  73           HE2      TYR  73   6.749  -2.792  11.912
  605    HH   TYR  73           HH       TYR  73   8.803  -4.664  10.009
  606    H    GLN  74           HN       GLN  74   4.046  -7.655  11.721
  607    HA   GLN  74           HA       GLN  74   4.863  -8.285  13.819
  608    HB2  GLN  74           HB2      GLN  74   6.138  -6.174  13.222
  609    HB3  GLN  74           HB1      GLN  74   5.033  -5.305  14.288
  610    HG2  GLN  74           HG2      GLN  74   5.687  -6.725  16.173
  611    HG3  GLN  74           HG1      GLN  74   6.731  -7.677  15.116
  612   HE21  GLN  74          HE21      GLN  74   7.757  -6.268  17.406
  613   HE22  GLN  74          HE22      GLN  74   8.784  -5.036  16.852
  614    H    LYS  75           HN       LYS  75   2.389  -8.779  14.041
  615    HA   LYS  75           HA       LYS  75   0.458  -8.791  15.362
  616    HB2  LYS  75           HB2      LYS  75   2.403  -9.636  16.842
  617    HB3  LYS  75           HB1      LYS  75   2.295  -8.074  17.649
  618    HG2  LYS  75           HG2      LYS  75  -0.052  -8.470  18.193
  619    HG3  LYS  75           HG1      LYS  75  -0.042  -9.980  17.288
  620    HD2  LYS  75           HD2      LYS  75   1.911  -9.541  19.550
  621    HD3  LYS  75           HD1      LYS  75   0.265 -10.074  19.885
  622    HE2  LYS  75           HE2      LYS  75   0.653 -11.958  18.216
  623    HE3  LYS  75           HE1      LYS  75   2.352 -11.491  18.205
  624    HZ1  LYS  75           HZ1      LYS  75   1.130 -11.837  20.812
  625    HZ2  LYS  75           HZ2      LYS  75   2.677 -12.279  20.263
  626    HZ3  LYS  75           HZ3      LYS  75   1.332 -13.249  19.894
  627    H    GLN  76           HN       GLN  76   0.013  -6.692  14.163
  628    HA   GLN  76           HA       GLN  76  -1.090  -4.795  16.015
  629    HB2  GLN  76           HB2      GLN  76   1.270  -4.096  16.209
  630    HB3  GLN  76           HB1      GLN  76   1.337  -3.857  14.465
  631    HG2  GLN  76           HG2      GLN  76  -0.317  -2.106  14.568
  632    HG3  GLN  76           HG1      GLN  76  -0.638  -2.441  16.269
  633   HE21  GLN  76          HE21      GLN  76   0.209   0.157  15.393
  634   HE22  GLN  76          HE22      GLN  76   1.762   0.449  16.013
  635    H    LEU  77           HN       LEU  77  -2.624  -3.576  15.028
  636    HA   LEU  77           HA       LEU  77  -3.270  -4.173  12.243
  637    HB2  LEU  77           HB2      LEU  77  -4.582  -2.582  14.450
  638    HB3  LEU  77           HB1      LEU  77  -5.184  -2.469  12.799
  639    HG   LEU  77           HG       LEU  77  -6.339  -4.220  14.209
  640   HD11  LEU  77          HD11      LEU  77  -4.923  -5.692  12.006
  641   HD12  LEU  77          HD12      LEU  77  -5.865  -4.270  11.567
  642   HD13  LEU  77          HD13      LEU  77  -6.637  -5.620  12.390
  643   HD21  LEU  77          HD21      LEU  77  -5.172  -6.197  14.870
  644   HD22  LEU  77          HD22      LEU  77  -4.131  -4.860  15.360
  645   HD23  LEU  77          HD23      LEU  77  -3.763  -5.776  13.898
  646    H    ILE  78           HN       ILE  78  -2.841  -2.969  10.528
  647    HA   ILE  78           HA       ILE  78  -1.601  -0.263  10.944
  648    HB   ILE  78           HB       ILE  78  -1.354  -2.168   8.591
  649   HG12  ILE  78          HG12      ILE  78  -0.240  -3.074  10.575
  650   HG13  ILE  78          HG11      ILE  78   0.972  -2.492   9.436
  651   HG21  ILE  78          HG21      ILE  78  -0.145   0.519   9.256
  652   HG22  ILE  78          HG22      ILE  78  -1.022   0.050   7.799
  653   HG23  ILE  78          HG23      ILE  78   0.602  -0.575   8.094
  654   HD11  ILE  78          HD11      ILE  78   1.756  -1.566  11.424
  655   HD12  ILE  78          HD12      ILE  78   0.139  -1.333  12.076
  656   HD13  ILE  78          HD13      ILE  78   0.754  -0.241  10.842
  657    H    ALA  79           HN       ALA  79  -4.059  -2.071   9.149
  658    HA   ALA  79           HA       ALA  79  -5.602   0.341   8.766
  659    HB1  ALA  79           HB1      ALA  79  -4.290  -0.826   6.303
  660    HB2  ALA  79           HB2      ALA  79  -3.895   0.727   7.037
  661    HB3  ALA  79           HB3      ALA  79  -5.485   0.469   6.320
  662    H    ILE  80           HN       ILE  80  -7.669  -0.086   8.198
  663    HA   ILE  80           HA       ILE  80  -8.421  -2.880   7.413
  664    HB   ILE  80           HB       ILE  80  -9.752  -1.133   9.515
  665   HG12  ILE  80          HG12      ILE  80  -8.530  -3.887   9.790
  666   HG13  ILE  80          HG11      ILE  80  -7.641  -2.407  10.145
  667   HG21  ILE  80          HG21      ILE  80 -11.166  -3.280   9.768
  668   HG22  ILE  80          HG22      ILE  80 -10.553  -3.717   8.173
  669   HG23  ILE  80          HG23      ILE  80 -11.506  -2.248   8.379
  670   HD11  ILE  80          HD11      ILE  80  -8.725  -3.477  12.162
  671   HD12  ILE  80          HD12      ILE  80 -10.290  -3.120  11.430
  672   HD13  ILE  80          HD13      ILE  80  -9.207  -1.804  11.881
  673    H    GLY  81           HN       GLY  81  -9.719  -2.887   5.655
  674    HA2  GLY  81           HA2      GLY  81 -11.792  -0.928   5.199
  675    HA3  GLY  81           HA1      GLY  81 -10.394  -0.573   4.188
  676    H    PHE  82           HN       PHE  82 -12.424  -1.046   2.721
  677    HA   PHE  82           HA       PHE  82 -11.986  -3.743   1.573
  678    HB2  PHE  82           HB2      PHE  82 -14.362  -4.245   1.441
  679    HB3  PHE  82           HB1      PHE  82 -13.951  -3.931   3.126
  680    HD1  PHE  82           HD2      PHE  82 -15.659  -2.608   0.134
  681    HD2  PHE  82           HD1      PHE  82 -14.709  -1.923   4.267
  682    HE1  PHE  82           HE2      PHE  82 -17.358  -0.803   0.225
  683    HE2  PHE  82           HE1      PHE  82 -16.413  -0.124   4.360
  684    HZ   PHE  82           HZ       PHE  82 -17.735   0.438   2.339
  685    H    ILE  83           HN       ILE  83 -12.879  -3.908  -0.605
  686    HA   ILE  83           HA       ILE  83 -12.855  -1.257  -2.000
  687    HB   ILE  83           HB       ILE  83 -12.324  -4.042  -3.084
  688   HG12  ILE  83          HG12      ILE  83 -10.401  -1.757  -2.551
  689   HG13  ILE  83          HG11      ILE  83 -10.622  -3.124  -1.462
  690   HG21  ILE  83          HG21      ILE  83 -11.438  -2.695  -5.035
  691   HG22  ILE  83          HG22      ILE  83 -12.164  -1.269  -4.293
  692   HG23  ILE  83          HG23      ILE  83 -13.186  -2.604  -4.822
  693   HD11  ILE  83          HD11      ILE  83  -9.617  -3.205  -4.317
  694   HD12  ILE  83          HD12      ILE  83 -10.051  -4.646  -3.396
  695   HD13  ILE  83          HD13      ILE  83  -8.721  -3.621  -2.855
  696    H    ASP  84           HN       ASP  84 -14.635  -0.575  -2.959
  697    HA   ASP  84           HA       ASP  84 -17.021  -2.347  -3.067
  698    HB2  ASP  84           HB2      ASP  84 -17.082  -0.036  -2.004
  699    HB3  ASP  84           HB1      ASP  84 -16.896   0.624  -3.629
  700    H    GLU  85           HN       GLU  85 -17.591  -3.241  -4.886
  701    HA   GLU  85           HA       GLU  85 -17.812  -3.756  -7.150
  702    HB2  GLU  85           HB2      GLU  85 -18.941  -1.509  -7.106
  703    HB3  GLU  85           HB1      GLU  85 -17.402  -0.785  -7.563
  704    HG2  GLU  85           HG2      GLU  85 -18.649  -1.109  -9.592
  705    HG3  GLU  85           HG1      GLU  85 -17.374  -2.321  -9.576
  706    H    ASN  86           HN       ASN  86 -15.628  -1.004  -7.548
  707    HA   ASN  86           HA       ASN  86 -13.397  -2.858  -8.258
  708    HB2  ASN  86           HB2      ASN  86 -14.583  -0.710 -10.042
  709    HB3  ASN  86           HB1      ASN  86 -12.974  -1.386 -10.292
  710   HD21  ASN  86          HD21      ASN  86 -15.068  -1.724 -12.227
  711   HD22  ASN  86          HD22      ASN  86 -15.475  -3.370 -12.287
  712    H    HIS  87           HN       HIS  87 -14.567   0.320  -7.307
  713    HA   HIS  87           HA       HIS  87 -11.830   0.957  -6.274
  714    HB2  HIS  87           HB2      HIS  87 -12.410   2.145  -8.519
  715    HB3  HIS  87           HB1      HIS  87 -13.544   3.097  -7.562
  716    HD1  HIS  87           HD1      HIS  87 -12.574   5.099  -6.406
  717    HD2  HIS  87           HD2      HIS  87  -9.635   2.304  -7.370
  718    HE1  HIS  87           HE1      HIS  87 -10.357   6.139  -5.761
  719    H    ASP  88           HN       ASP  88 -12.922   3.662  -5.608
  720    HA   ASP  88           HA       ASP  88 -13.805   4.710  -3.729
  721    HB2  ASP  88           HB2      ASP  88 -15.903   2.628  -4.316
  722    HB3  ASP  88           HB1      ASP  88 -16.089   3.808  -3.019
  723    H    MET  89           HN       MET  89 -11.812   3.621  -2.767
  724    HA   MET  89           HA       MET  89 -12.202   1.318  -1.044
  725    HB2  MET  89           HB2      MET  89 -10.007   3.412  -1.167
  726    HB3  MET  89           HB1      MET  89  -9.956   1.989  -0.127
  727    HG2  MET  89           HG2      MET  89 -10.155   0.530  -2.108
  728    HG3  MET  89           HG1      MET  89 -10.191   1.952  -3.150
  729    HE1  MET  89           HE1      MET  89  -8.208  -0.197  -3.819
  730    HE2  MET  89           HE2      MET  89  -6.715   0.710  -4.049
  731    HE3  MET  89           HE3      MET  89  -8.242   1.386  -4.609
  732    H    ASP  90           HN       ASP  90 -12.688   1.264   1.081
  733    HA   ASP  90           HA       ASP  90 -13.129   3.864   2.525
  734    HB2  ASP  90           HB2      ASP  90 -15.289   2.915   1.802
  735    HB3  ASP  90           HB1      ASP  90 -14.895   1.402   2.618
  736    H    PHE  91           HN       PHE  91 -11.720   3.931   4.124
  737    HA   PHE  91           HA       PHE  91 -10.807   1.411   5.417
  738    HB2  PHE  91           HB2      PHE  91  -9.718   4.226   5.708
  739    HB3  PHE  91           HB1      PHE  91  -8.991   2.750   6.341
  740    HD1  PHE  91           HD1      PHE  91  -8.049   1.045   4.804
  741    HD2  PHE  91           HD2      PHE  91  -9.536   4.813   3.374
  742    HE1  PHE  91           HE1      PHE  91  -6.877   0.690   2.648
  743    HE2  PHE  91           HE2      PHE  91  -8.364   4.457   1.219
  744    HZ   PHE  91           HZ       PHE  91  -7.036   2.397   0.855
  745    H    LEU  92           HN       LEU  92 -11.983   0.846   7.113
  746    HA   LEU  92           HA       LEU  92 -13.630   2.622   8.669
  747    HB2  LEU  92           HB2      LEU  92 -12.617  -0.216   9.006
  748    HB3  LEU  92           HB1      LEU  92 -13.496   0.566  10.315
  749    HG   LEU  92           HG       LEU  92 -14.981  -0.766   8.802
  750   HD11  LEU  92          HD11      LEU  92 -15.488   1.680   9.955
  751   HD12  LEU  92          HD12      LEU  92 -16.691   0.722   9.112
  752   HD13  LEU  92          HD13      LEU  92 -15.868   2.028   8.269
  753   HD21  LEU  92          HD21      LEU  92 -15.312  -0.113   6.523
  754   HD22  LEU  92          HD22      LEU  92 -13.562  -0.174   6.745
  755   HD23  LEU  92          HD23      LEU  92 -14.400   1.378   6.745
  756    H    TYR  93           HN       TYR  93 -10.452   1.200   9.067
  757    HA   TYR  93           HA       TYR  93  -9.743   3.312  11.053
  758    HB2  TYR  93           HB2      TYR  93 -10.331   0.968  12.090
  759    HB3  TYR  93           HB1      TYR  93  -8.785   0.462  11.415
  760    HD1  TYR  93           HD1      TYR  93 -10.376   3.021  13.619
  761    HD2  TYR  93           HD2      TYR  93  -6.747   0.992  12.529
  762    HE1  TYR  93           HE1      TYR  93  -9.215   4.060  15.548
  763    HE2  TYR  93           HE2      TYR  93  -5.587   2.035  14.461
  764    HH   TYR  93           HH       TYR  93  -5.830   4.021  15.895
  765    H    LEU  94           HN       LEU  94  -7.717   4.124  10.668
  766    HA   LEU  94           HA       LEU  94  -5.881   2.652   8.851
  767    HB2  LEU  94           HB2      LEU  94  -7.193   4.086   7.376
  768    HB3  LEU  94           HB1      LEU  94  -6.881   5.482   8.405
  769    HG   LEU  94           HG       LEU  94  -4.497   5.384   7.896
  770   HD11  LEU  94          HD11      LEU  94  -3.931   3.123   7.670
  771   HD12  LEU  94          HD12      LEU  94  -3.882   3.663   5.995
  772   HD13  LEU  94          HD13      LEU  94  -5.287   2.782   6.594
  773   HD21  LEU  94          HD21      LEU  94  -4.626   5.724   5.401
  774   HD22  LEU  94          HD22      LEU  94  -5.823   6.642   6.315
  775   HD23  LEU  94          HD23      LEU  94  -6.297   5.167   5.470
  776    H    HIS  95           HN       HIS  95  -4.196   2.443  10.194
  777    HA   HIS  95           HA       HIS  95  -3.136   4.886  11.583
  778    HB2  HIS  95           HB2      HIS  95  -4.013   3.178  13.149
  779    HB3  HIS  95           HB1      HIS  95  -2.905   1.993  12.456
  780    HD1  HIS  95           HD1      HIS  95  -0.258   2.968  12.454
  781    HD2  HIS  95           HD2      HIS  95  -2.897   4.438  15.327
  782    HE1  HIS  95           HE1      HIS  95   1.171   3.932  14.311
  783    H    ASN  96           HN       ASN  96  -1.157   5.483  11.032
  784    HA   ASN  96           HA       ASN  96   0.462   3.749   9.233
  785    HB2  ASN  96           HB2      ASN  96   0.556   6.704   9.900
  786    HB3  ASN  96           HB1      ASN  96   1.785   5.898   8.925
  787   HD21  ASN  96          HD21      ASN  96   1.191   7.048   6.966
  788   HD22  ASN  96          HD22      ASN  96  -0.266   6.733   6.154
  789    H    THR  97           HN       THR  97   2.439   3.028   9.807
  790    HA   THR  97           HA       THR  97   3.152   2.559  12.470
  791    HB   THR  97           HB       THR  97   5.447   2.087  11.583
  792    HG1  THR  97           HG1      THR  97   5.387   2.264   9.136
  793   HG21  THR  97          HG21      THR  97   3.119   1.081   9.928
  794   HG22  THR  97          HG22      THR  97   3.722   0.373  11.427
  795   HG23  THR  97          HG23      THR  97   4.718   0.337   9.973
  796    H    VAL  98           HN       VAL  98   3.345   5.517  10.779
  797    HA   VAL  98           HA       VAL  98   5.198   6.624  12.884
  798    HB   VAL  98           HB       VAL  98   4.897   7.402   9.968
  799   HG11  VAL  98          HG11      VAL  98   6.321   8.727  12.284
  800   HG12  VAL  98          HG12      VAL  98   5.189   9.451  11.141
  801   HG13  VAL  98          HG13      VAL  98   6.809   8.999  10.611
  802   HG21  VAL  98          HG21      VAL  98   7.112   6.173  11.633
  803   HG22  VAL  98          HG22      VAL  98   7.388   6.863  10.036
  804   HG23  VAL  98          HG23      VAL  98   6.314   5.476  10.224
  805    H    MET  99           HN       MET  99   3.092   8.171  10.440
  806    HA   MET  99           HA       MET  99   1.793   9.672  12.699
  807    HB2  MET  99           HB2      MET  99   1.487  11.518  11.096
  808    HB3  MET  99           HB1      MET  99   3.171  11.154  11.449
  809    HG2  MET  99           HG2      MET  99   3.461  11.101   9.184
  810    HG3  MET  99           HG1      MET  99   2.665   9.530   9.236
  811    HE1  MET  99           HE1      MET  99   2.528  12.125   6.719
  812    HE2  MET  99           HE2      MET  99   1.237  11.093   6.106
  813    HE3  MET  99           HE3      MET  99   2.662  10.365   6.844
  814    HA   PRO 100           HA       PRO 100  -1.657   7.167  10.953
  815    HB2  PRO 100           HB2      PRO 100  -2.884   8.501  13.350
  816    HB3  PRO 100           HB1      PRO 100  -3.006   6.811  12.824
  817    HG2  PRO 100           HG2      PRO 100  -1.441   7.472  14.849
  818    HG3  PRO 100           HG1      PRO 100  -0.907   6.271  13.656
  819    HD2  PRO 100           HD2      PRO 100  -0.069   9.132  13.958
  820    HD3  PRO 100           HD1      PRO 100   0.894   7.711  13.480
  821    H    LEU 101           HN       LEU 101  -3.296   7.803   9.652
  822    HA   LEU 101           HA       LEU 101  -3.687  10.723   9.229
  823    HB2  LEU 101           HB2      LEU 101  -4.754   8.373   7.613
  824    HB3  LEU 101           HB1      LEU 101  -4.722  10.065   7.124
  825    HG   LEU 101           HG       LEU 101  -2.274   8.367   7.685
  826   HD11  LEU 101          HD11      LEU 101  -3.184   9.458   5.016
  827   HD12  LEU 101          HD12      LEU 101  -3.665   7.857   5.580
  828   HD13  LEU 101          HD13      LEU 101  -1.959   8.229   5.334
  829   HD21  LEU 101          HD21      LEU 101  -2.704  11.250   6.889
  830   HD22  LEU 101          HD22      LEU 101  -1.218  10.410   6.444
  831   HD23  LEU 101          HD23      LEU 101  -1.648  10.595   8.141
  832    H    LEU 102           HN       LEU 102  -5.904   7.977   8.904
  833    HA   LEU 102           HA       LEU 102  -7.929   9.488  10.530
  834    HB2  LEU 102           HB2      LEU 102  -8.421   7.465   8.316
  835    HB3  LEU 102           HB1      LEU 102  -9.646   8.392   9.185
  836    HG   LEU 102           HG       LEU 102  -7.451   9.586   7.459
  837   HD11  LEU 102          HD11      LEU 102 -10.441   9.409   6.963
  838   HD12  LEU 102          HD12      LEU 102  -9.235   8.384   6.183
  839   HD13  LEU 102          HD13      LEU 102  -9.239  10.123   5.889
  840   HD21  LEU 102          HD21      LEU 102  -7.951  11.226   9.077
  841   HD22  LEU 102          HD22      LEU 102  -9.650  10.759   9.166
  842   HD23  LEU 102          HD23      LEU 102  -9.048  11.638   7.762
  843    H    ASP 103           HN       ASP 103  -8.765   8.532  12.228
  844    HA   ASP 103           HA       ASP 103  -8.729   5.612  12.565
  845    HB2  ASP 103           HB2      ASP 103  -7.471   5.687  14.672
  846    HB3  ASP 103           HB1      ASP 103  -6.483   6.280  13.340
  847    H    GLN 104           HN       GLN 104 -11.025   6.210  12.475
  848    HA   GLN 104           HA       GLN 104 -12.061   7.421  15.023
  849    HB2  GLN 104           HB2      GLN 104 -13.315   7.139  12.278
  850    HB3  GLN 104           HB1      GLN 104 -14.210   7.652  13.709
  851    HG2  GLN 104           HG2      GLN 104 -11.717   9.039  12.683
  852    HG3  GLN 104           HG1      GLN 104 -13.360   9.565  12.323
  853   HE21  GLN 104          HE21      GLN 104 -14.556  10.636  13.994
  854   HE22  GLN 104          HE22      GLN 104 -13.870  11.057  15.488
  855    H    ARG 105           HN       ARG 105 -12.650   5.957  16.444
  856    HA   ARG 105           HA       ARG 105 -13.087   3.175  15.879
  857    HB2  ARG 105           HB2      ARG 105 -12.386   4.053  18.113
  858    HB3  ARG 105           HB1      ARG 105 -13.984   4.775  18.304
  859    HG2  ARG 105           HG2      ARG 105 -15.029   2.562  18.140
  860    HG3  ARG 105           HG1      ARG 105 -13.451   1.820  17.881
  861    HD2  ARG 105           HD2      ARG 105 -12.727   2.698  20.111
  862    HD3  ARG 105           HD1      ARG 105 -14.365   3.296  20.365
  863    HE   ARG 105           HE       ARG 105 -15.120   1.048  20.659
  864   HH11  ARG 105          HH21      ARG 105 -11.802   1.235  19.656
  865   HH12  ARG 105          HH22      ARG 105 -11.483  -0.431  20.006
  866   HH21  ARG 105          HH11      ARG 105 -14.695  -1.106  21.114
  867   HH22  ARG 105          HH12      ARG 105 -13.112  -1.749  20.828
  868    H    TYR 106           HN       TYR 106 -15.256   5.934  16.358
  869    HA   TYR 106           HA       TYR 106 -17.749   4.732  16.567
  870    HB2  TYR 106           HB2      TYR 106 -17.176   7.062  14.700
  871    HB3  TYR 106           HB1      TYR 106 -18.688   6.714  15.536
  872    HD1  TYR 106           HD1      TYR 106 -18.749   6.806  18.071
  873    HD2  TYR 106           HD2      TYR 106 -15.435   8.288  15.773
  874    HE1  TYR 106           HE1      TYR 106 -17.979   8.122  20.026
  875    HE2  TYR 106           HE2      TYR 106 -14.666   9.604  17.728
  876    HH   TYR 106           HH       TYR 106 -14.918   9.473  20.244
  877    H    LEU 107           HN       LEU 107 -16.042   5.464  13.524
  878    HA   LEU 107           HA       LEU 107 -17.960   4.188  11.805
  879    HB2  LEU 107           HB2      LEU 107 -14.983   4.562  11.298
  880    HB3  LEU 107           HB1      LEU 107 -16.248   4.370  10.084
  881    HG   LEU 107           HG       LEU 107 -16.044   6.682  12.040
  882   HD11  LEU 107          HD11      LEU 107 -14.308   6.603  10.190
  883   HD12  LEU 107          HD12      LEU 107 -15.355   8.021  10.162
  884   HD13  LEU 107          HD13      LEU 107 -15.640   6.694   9.037
  885   HD21  LEU 107          HD21      LEU 107 -17.798   7.598  10.328
  886   HD22  LEU 107          HD22      LEU 107 -18.338   6.452  11.549
  887   HD23  LEU 107          HD23      LEU 107 -18.030   5.901   9.901
  888    H    LEU 108           HN       LEU 108 -15.020   3.074  13.422
  889    HA   LEU 108           HA       LEU 108 -14.860   0.509  12.188
  890    HB2  LEU 108           HB2      LEU 108 -13.220   1.805  13.847
  891    HB3  LEU 108           HB1      LEU 108 -14.084   0.892  15.083
  892    HG   LEU 108           HG       LEU 108 -12.719  -0.321  12.659
  893   HD11  LEU 108          HD11      LEU 108 -10.980  -1.026  14.115
  894   HD12  LEU 108          HD12      LEU 108 -11.889  -0.561  15.552
  895   HD13  LEU 108          HD13      LEU 108 -11.233   0.680  14.484
  896   HD21  LEU 108          HD21      LEU 108 -13.083  -2.419  14.240
  897   HD22  LEU 108          HD22      LEU 108 -14.379  -1.859  13.193
  898   HD23  LEU 108          HD23      LEU 108 -14.387  -1.432  14.904
  899    H    THR 109           HN       THR 109 -16.501   1.567  15.170
  900    HA   THR 109           HA       THR 109 -17.655  -1.119  15.585
  901    HB   THR 109           HB       THR 109 -18.062   1.503  17.065
  902    HG1  THR 109           HG1      THR 109 -16.776   0.375  18.623
  903   HG21  THR 109          HG21      THR 109 -20.014   0.214  17.459
  904   HG22  THR 109          HG22      THR 109 -18.966  -0.133  18.834
  905   HG23  THR 109          HG23      THR 109 -19.103  -1.295  17.516
  906    H    GLY 110           HN       GLY 110 -18.524   1.863  14.066
  907    HA2  GLY 110           HA2      GLY 110 -20.398   2.406  12.756
  908    HA3  GLY 110           HA1      GLY 110 -20.936   0.734  12.932
  909    H    GLY 111           HN       GLY 111 -20.267   2.236  15.890
  910    HA2  GLY 111           HA2      GLY 111 -23.018   2.073  16.764
  911    HA3  GLY 111           HA1      GLY 111 -21.678   2.732  17.701
  912    H    GLN 112           HN       GLN 112 -24.467   3.701  17.205
  913    HA   GLN 112           HA       GLN 112 -24.024   6.257  15.756
  914    HB2  GLN 112           HB2      GLN 112 -26.126   4.907  15.425
  915    HB3  GLN 112           HB1      GLN 112 -26.552   5.246  17.105
  916    HG2  GLN 112           HG2      GLN 112 -26.556   7.640  16.672
  917    HG3  GLN 112           HG1      GLN 112 -25.971   7.378  15.030
  918   HE21  GLN 112          HE21      GLN 112 -28.408   8.764  15.465
  919   HE22  GLN 112          HE22      GLN 112 -29.695   7.804  14.913
  920    H    LEU 113           HN       LEU 113 -22.406   6.730  17.545
  921    HA   LEU 113           HA       LEU 113 -23.647   7.725  20.071
  922    HB2  LEU 113           HB2      LEU 113 -20.717   7.586  19.248
  923    HB3  LEU 113           HB1      LEU 113 -21.333   7.983  20.853
  924    HG   LEU 113           HG       LEU 113 -21.757   5.341  19.419
  925   HD11  LEU 113          HD11      LEU 113 -19.960   6.146  21.724
  926   HD12  LEU 113          HD12      LEU 113 -19.459   5.508  20.157
  927   HD13  LEU 113          HD13      LEU 113 -20.317   4.473  21.300
  928   HD21  LEU 113          HD21      LEU 113 -22.755   6.502  22.018
  929   HD22  LEU 113          HD22      LEU 113 -22.489   4.763  21.887
  930   HD23  LEU 113          HD23      LEU 113 -23.628   5.560  20.810
  931    H    GLU 114           HN       GLU 114 -23.369   8.866  17.075
  932    HA   GLU 114           HA       GLU 114 -22.022  11.336  17.161
  933    HB2  GLU 114           HB2      GLU 114 -24.621  10.628  15.756
  934    HB3  GLU 114           HB1      GLU 114 -23.663  12.070  15.418
  935    HG2  GLU 114           HG2      GLU 114 -22.621   9.232  15.190
  936    HG3  GLU 114           HG1      GLU 114 -23.184  10.200  13.829
  937    H    HIS 115           HN       HIS 115 -22.421  13.268  18.055
  938    HA   HIS 115           HA       HIS 115 -24.597  13.484  20.034
  939    HB2  HIS 115           HB2      HIS 115 -22.251  15.258  19.288
  940    HB3  HIS 115           HB1      HIS 115 -23.465  15.735  20.475
  941    HD1  HIS 115           HD1      HIS 115 -20.742  13.187  19.887
  942    HD2  HIS 115           HD2      HIS 115 -23.275  14.417  22.962
  943    HE1  HIS 115           HE1      HIS 115 -19.926  12.036  21.992
  944    H    HIS 116           HN       HIS 116 -24.032  14.313  16.778
  945    HA   HIS 116           HA       HIS 116 -25.823  16.652  16.743
  946    HB2  HIS 116           HB2      HIS 116 -24.403  15.108  14.550
  947    HB3  HIS 116           HB1      HIS 116 -25.454  16.491  14.242
  948    HD1  HIS 116           HD1      HIS 116 -22.112  15.573  15.678
  949    HD2  HIS 116           HD2      HIS 116 -24.404  19.006  15.095
  950    HE1  HIS 116           HE1      HIS 116 -20.579  17.542  16.113
  951    H    HIS 117           HN       HIS 117 -27.943  16.430  16.724
  952    HA   HIS 117           HA       HIS 117 -29.248  14.415  15.021
  953    HB2  HIS 117           HB2      HIS 117 -28.817  13.313  17.270
  954    HB3  HIS 117           HB1      HIS 117 -29.914  14.503  17.973
  955    HD1  HIS 117           HD1      HIS 117 -32.429  14.430  17.161
  956    HD2  HIS 117           HD2      HIS 117 -30.077  11.262  15.818
  957    HE1  HIS 117           HE1      HIS 117 -34.028  12.673  16.282
  958    H    HIS 118           HN       HIS 118 -31.136  15.164  14.262
  959    HA   HIS 118           HA       HIS 118 -32.636  16.871  13.632
  960    HB2  HIS 118           HB2      HIS 118 -33.845  15.507  15.287
  961    HB3  HIS 118           HB1      HIS 118 -33.259  16.555  16.579
  962    HD1  HIS 118           HD1      HIS 118 -35.231  16.852  13.323
  963    HD2  HIS 118           HD2      HIS 118 -34.902  18.737  17.026
  964    HE1  HIS 118           HE1      HIS 118 -37.015  18.649  13.373
  965    H    HIS 119           HN       HIS 119 -31.167  18.551  13.168
  966    HA   HIS 119           HA       HIS 119 -31.430  20.864  14.992
  967    HB2  HIS 119           HB2      HIS 119 -29.327  19.809  15.716
  968    HB3  HIS 119           HB1      HIS 119 -28.733  19.833  14.055
  969    HD1  HIS 119           HD1      HIS 119 -29.951  22.279  16.710
  970    HD2  HIS 119           HD2      HIS 119 -27.438  22.199  13.385
  971    HE1  HIS 119           HE1      HIS 119 -28.821  24.543  16.612
  972    H    HIS 120           HN       HIS 120 -30.936  22.862  13.927
  973    HA   HIS 120           HA       HIS 120 -30.394  22.855  11.030
  974    HB2  HIS 120           HB2      HIS 120 -33.028  23.867  12.157
  975    HB3  HIS 120           HB1      HIS 120 -32.482  24.079  10.493
  976    HD1  HIS 120           HD1      HIS 120 -31.999  21.744   9.162
  977    HD2  HIS 120           HD2      HIS 120 -34.346  21.465  12.596
  978    HE1  HIS 120           HE1      HIS 120 -33.199  19.515   9.031
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1  -8.806  -8.183  17.750
    2    H2   MET   1           HT2      MET   1  -7.446  -9.147  18.076
    3    H3   MET   1           HT3      MET   1  -8.230  -8.319  19.337
    4    HA   MET   1           HA       MET   1  -9.005 -10.780  17.960
    5    HB2  MET   1           HB2      MET   1  -9.252  -9.699  20.787
    6    HB3  MET   1           HB1      MET   1  -9.768 -11.308  20.281
    7    HG2  MET   1           HG2      MET   1  -6.941 -10.253  19.981
    8    HG3  MET   1           HG1      MET   1  -7.476 -11.282  21.309
    9    HE1  MET   1           HE1      MET   1  -8.750 -13.224  21.074
   10    HE2  MET   1           HE2      MET   1  -7.320 -14.233  20.881
   11    HE3  MET   1           HE3      MET   1  -8.679 -14.431  19.781
   12    H    THR   2           HN       THR   2 -10.343  -7.766  19.182
   13    HA   THR   2           HA       THR   2 -13.116  -8.684  18.539
   14    HB   THR   2           HB       THR   2 -12.158  -6.160  19.935
   15    HG1  THR   2           HG1      THR   2 -11.929  -7.470  21.544
   16   HG21  THR   2          HG21      THR   2 -14.313  -5.742  19.019
   17   HG22  THR   2          HG22      THR   2 -14.606  -6.189  20.701
   18   HG23  THR   2          HG23      THR   2 -14.878  -7.365  19.415
   19    H    LEU   3           HN       LEU   3 -10.518  -6.901  17.262
   20    HA   LEU   3           HA       LEU   3 -11.901  -4.848  15.805
   21    HB2  LEU   3           HB2      LEU   3  -9.361  -6.286  14.972
   22    HB3  LEU   3           HB1      LEU   3  -9.865  -4.662  14.500
   23    HG   LEU   3           HG       LEU   3  -9.243  -5.538  17.336
   24   HD11  LEU   3          HD11      LEU   3  -7.677  -3.774  15.430
   25   HD12  LEU   3          HD12      LEU   3  -7.228  -5.412  15.906
   26   HD13  LEU   3          HD13      LEU   3  -7.246  -4.117  17.104
   27   HD21  LEU   3          HD21      LEU   3 -10.199  -2.959  16.089
   28   HD22  LEU   3          HD22      LEU   3  -9.250  -2.929  17.576
   29   HD23  LEU   3          HD23      LEU   3 -10.793  -3.778  17.535
   30    H    GLU   4           HN       GLU   4 -11.053  -8.198  14.987
   31    HA   GLU   4           HA       GLU   4 -11.973  -8.111  12.270
   32    HB2  GLU   4           HB2      GLU   4 -10.558  -9.944  13.305
   33    HB3  GLU   4           HB1      GLU   4 -12.011 -10.510  14.127
   34    HG2  GLU   4           HG2      GLU   4 -11.786 -11.806  12.107
   35    HG3  GLU   4           HG1      GLU   4 -13.121 -10.681  11.859
   36    H    LEU   5           HN       LEU   5 -13.570  -9.071  15.297
   37    HA   LEU   5           HA       LEU   5 -16.105  -9.737  14.122
   38    HB2  LEU   5           HB2      LEU   5 -15.370  -8.808  16.919
   39    HB3  LEU   5           HB1      LEU   5 -16.966  -9.411  16.476
   40    HG   LEU   5           HG       LEU   5 -14.391 -10.981  16.131
   41   HD11  LEU   5          HD11      LEU   5 -15.304 -12.333  18.060
   42   HD12  LEU   5          HD12      LEU   5 -16.493 -11.056  18.312
   43   HD13  LEU   5          HD13      LEU   5 -14.774 -10.708  18.498
   44   HD21  LEU   5          HD21      LEU   5 -15.894 -11.957  14.628
   45   HD22  LEU   5          HD22      LEU   5 -17.305 -11.539  15.598
   46   HD23  LEU   5          HD23      LEU   5 -16.258 -12.870  16.089
   47    H    GLN   6           HN       GLN   6 -14.802  -6.745  15.483
   48    HA   GLN   6           HA       GLN   6 -17.207  -5.200  15.281
   49    HB2  GLN   6           HB2      GLN   6 -15.147  -4.577  16.610
   50    HB3  GLN   6           HB1      GLN   6 -14.350  -4.198  15.084
   51    HG2  GLN   6           HG2      GLN   6 -15.243  -2.140  16.003
   52    HG3  GLN   6           HG1      GLN   6 -16.204  -2.575  14.589
   53   HE21  GLN   6          HE21      GLN   6 -18.283  -1.837  15.169
   54   HE22  GLN   6          HE22      GLN   6 -19.098  -2.311  16.580
   55    H    LEU   7           HN       LEU   7 -14.449  -5.602  13.071
   56    HA   LEU   7           HA       LEU   7 -15.394  -3.759  11.104
   57    HB2  LEU   7           HB2      LEU   7 -13.055  -4.646  11.175
   58    HB3  LEU   7           HB1      LEU   7 -13.668  -6.223  10.676
   59    HG   LEU   7           HG       LEU   7 -14.598  -5.168   8.613
   60   HD11  LEU   7          HD11      LEU   7 -14.946  -2.911   9.023
   61   HD12  LEU   7          HD12      LEU   7 -13.423  -2.835   8.143
   62   HD13  LEU   7          HD13      LEU   7 -13.431  -2.719   9.904
   63   HD21  LEU   7          HD21      LEU   7 -12.522  -6.226   8.278
   64   HD22  LEU   7          HD22      LEU   7 -11.644  -5.004   9.198
   65   HD23  LEU   7          HD23      LEU   7 -12.285  -4.617   7.601
   66    H    LYS   8           HN       LYS   8 -15.834  -7.243  11.506
   67    HA   LYS   8           HA       LYS   8 -17.261  -7.722   9.076
   68    HB2  LYS   8           HB2      LYS   8 -16.310  -9.510  10.550
   69    HB3  LYS   8           HB1      LYS   8 -17.565  -9.157  11.737
   70    HG2  LYS   8           HG2      LYS   8 -19.305  -9.735  10.106
   71    HG3  LYS   8           HG1      LYS   8 -18.076 -10.030   8.876
   72    HD2  LYS   8           HD2      LYS   8 -17.120 -11.839  10.270
   73    HD3  LYS   8           HD1      LYS   8 -18.364 -11.552  11.487
   74    HE2  LYS   8           HE2      LYS   8 -19.045 -13.425  10.080
   75    HE3  LYS   8           HE1      LYS   8 -20.107 -12.052   9.769
   76    HZ1  LYS   8           HZ1      LYS   8 -19.469 -12.940   7.685
   77    HZ2  LYS   8           HZ2      LYS   8 -17.826 -12.981   8.117
   78    HZ3  LYS   8           HZ3      LYS   8 -18.606 -11.492   7.874
   79    H    HIS   9           HN       HIS   9 -18.374  -6.907  12.348
   80    HA   HIS   9           HA       HIS   9 -21.171  -6.999  11.799
   81    HB2  HIS   9           HB2      HIS   9 -20.238  -6.868  14.094
   82    HB3  HIS   9           HB1      HIS   9 -19.698  -5.219  13.767
   83    HD1  HIS   9           HD1      HIS   9 -22.885  -7.266  13.986
   84    HD2  HIS   9           HD2      HIS   9 -21.688  -3.274  14.045
   85    HE1  HIS   9           HE1      HIS   9 -24.953  -5.908  14.520
   86    H    TYR  10           HN       TYR  10 -18.832  -4.320  11.600
   87    HA   TYR  10           HA       TYR  10 -20.706  -2.289  10.852
   88    HB2  TYR  10           HB2      TYR  10 -18.422  -1.725  11.569
   89    HB3  TYR  10           HB1      TYR  10 -17.759  -2.558  10.162
   90    HD1  TYR  10           HD2      TYR  10 -19.734   0.360  11.287
   91    HD2  TYR  10           HD1      TYR  10 -17.820  -1.562   7.958
   92    HE1  TYR  10           HE2      TYR  10 -20.020   2.419   9.935
   93    HE2  TYR  10           HE1      TYR  10 -18.107   0.497   6.604
   94    HH   TYR  10           HH       TYR  10 -19.101   2.506   6.507
   95    H    ILE  11           HN       ILE  11 -18.635  -4.396   8.870
   96    HA   ILE  11           HA       ILE  11 -19.522  -3.401   6.333
   97    HB   ILE  11           HB       ILE  11 -18.355  -6.087   7.136
   98   HG12  ILE  11          HG12      ILE  11 -17.075  -3.742   5.702
   99   HG13  ILE  11          HG11      ILE  11 -16.961  -3.993   7.444
  100   HG21  ILE  11          HG21      ILE  11 -19.474  -6.475   5.067
  101   HG22  ILE  11          HG22      ILE  11 -17.792  -6.176   4.630
  102   HG23  ILE  11          HG23      ILE  11 -18.997  -4.903   4.429
  103   HD11  ILE  11          HD11      ILE  11 -16.016  -5.920   5.299
  104   HD12  ILE  11          HD12      ILE  11 -15.953  -6.230   7.034
  105   HD13  ILE  11          HD13      ILE  11 -14.985  -4.932   6.333
  106    H    THR  12           HN       THR  12 -20.596  -6.163   8.308
  107    HA   THR  12           HA       THR  12 -22.560  -7.095   6.426
  108    HB   THR  12           HB       THR  12 -23.525  -8.273   8.463
  109    HG1  THR  12           HG1      THR  12 -21.433  -7.834  10.047
  110   HG21  THR  12          HG21      THR  12 -20.573  -8.488   7.835
  111   HG22  THR  12          HG22      THR  12 -21.890  -9.441   7.151
  112   HG23  THR  12          HG23      THR  12 -21.435  -9.652   8.841
  113    H    ASN  13           HN       ASN  13 -22.768  -4.943   9.241
  114    HA   ASN  13           HA       ASN  13 -25.619  -4.549   9.091
  115    HB2  ASN  13           HB2      ASN  13 -24.333  -4.036  11.130
  116    HB3  ASN  13           HB1      ASN  13 -23.450  -2.777  10.270
  117   HD21  ASN  13          HD21      ASN  13 -24.969  -2.105  12.578
  118   HD22  ASN  13          HD22      ASN  13 -26.309  -1.176  12.105
  119    H    LEU  14           HN       LEU  14 -22.840  -2.808   7.757
  120    HA   LEU  14           HA       LEU  14 -24.277  -0.607   6.635
  121    HB2  LEU  14           HB2      LEU  14 -21.817  -0.600   6.864
  122    HB3  LEU  14           HB1      LEU  14 -21.697  -1.921   5.706
  123    HG   LEU  14           HG       LEU  14 -22.628  -0.498   3.935
  124   HD11  LEU  14          HD11      LEU  14 -24.140   0.975   4.929
  125   HD12  LEU  14          HD12      LEU  14 -22.781   2.050   4.616
  126   HD13  LEU  14          HD13      LEU  14 -23.036   1.400   6.235
  127   HD21  LEU  14          HD21      LEU  14 -20.419   0.927   5.455
  128   HD22  LEU  14          HD22      LEU  14 -20.778   1.104   3.738
  129   HD23  LEU  14          HD23      LEU  14 -20.180  -0.434   4.358
  130    H    PHE  15           HN       PHE  15 -23.359  -3.762   5.280
  131    HA   PHE  15           HA       PHE  15 -24.951  -3.168   2.824
  132    HB2  PHE  15           HB2      PHE  15 -22.915  -5.291   3.536
  133    HB3  PHE  15           HB1      PHE  15 -23.912  -5.402   2.085
  134    HD1  PHE  15           HD2      PHE  15 -23.864  -3.486   0.417
  135    HD2  PHE  15           HD1      PHE  15 -21.012  -3.859   3.608
  136    HE1  PHE  15           HE2      PHE  15 -22.345  -1.917  -0.758
  137    HE2  PHE  15           HE1      PHE  15 -19.493  -2.288   2.433
  138    HZ   PHE  15           HZ       PHE  15 -20.160  -1.317   0.250
  139    H    ASN  16           HN       ASN  16 -25.507  -4.364   5.818
  140    HA   ASN  16           HA       ASN  16 -27.153  -5.730   6.760
  141    HB2  ASN  16           HB2      ASN  16 -28.529  -4.161   5.347
  142    HB3  ASN  16           HB1      ASN  16 -28.547  -5.400   4.089
  143   HD21  ASN  16          HD21      ASN  16 -29.438  -4.867   7.534
  144   HD22  ASN  16          HD22      ASN  16 -30.681  -6.024   7.550
  145    H    LEU  17           HN       LEU  17 -24.997  -7.100   5.680
  146    HA   LEU  17           HA       LEU  17 -26.085  -9.373   4.147
  147    HB2  LEU  17           HB2      LEU  17 -23.281  -8.915   5.205
  148    HB3  LEU  17           HB1      LEU  17 -23.757 -10.159   4.057
  149    HG   LEU  17           HG       LEU  17 -24.222  -7.224   3.516
  150   HD11  LEU  17          HD11      LEU  17 -21.804  -7.605   3.897
  151   HD12  LEU  17          HD12      LEU  17 -22.146  -7.237   2.207
  152   HD13  LEU  17          HD13      LEU  17 -21.831  -8.900   2.700
  153   HD21  LEU  17          HD21      LEU  17 -25.507  -8.627   2.062
  154   HD22  LEU  17          HD22      LEU  17 -24.165  -9.748   1.834
  155   HD23  LEU  17          HD23      LEU  17 -24.100  -8.136   1.128
  156    HA   PRO  18           HA       PRO  18 -26.787 -11.854   7.761
  157    HB2  PRO  18           HB2      PRO  18 -26.486 -14.370   6.692
  158    HB3  PRO  18           HB1      PRO  18 -27.899 -13.340   6.380
  159    HG2  PRO  18           HG2      PRO  18 -25.477 -13.781   4.684
  160    HG3  PRO  18           HG1      PRO  18 -27.183 -13.714   4.210
  161    HD2  PRO  18           HD2      PRO  18 -25.524 -11.605   3.872
  162    HD3  PRO  18           HD1      PRO  18 -27.245 -11.392   4.251
  163    H    ARG  19           HN       ARG  19 -25.631 -12.791   9.413
  164    HA   ARG  19           HA       ARG  19 -22.685 -12.965   9.071
  165    HB2  ARG  19           HB2      ARG  19 -24.495 -12.965  11.504
  166    HB3  ARG  19           HB1      ARG  19 -22.746 -13.167  11.593
  167    HG2  ARG  19           HG2      ARG  19 -22.410 -10.997  10.513
  168    HG3  ARG  19           HG1      ARG  19 -24.153 -10.796  10.333
  169    HD2  ARG  19           HD2      ARG  19 -24.420 -10.841  12.781
  170    HD3  ARG  19           HD1      ARG  19 -22.681 -11.070  12.969
  171    HE   ARG  19           HE       ARG  19 -22.349  -8.777  12.422
  172   HH11  ARG  19          HH21      ARG  19 -25.611  -9.813  11.881
  173   HH12  ARG  19          HH22      ARG  19 -26.213  -8.202  11.670
  174   HH21  ARG  19          HH11      ARG  19 -23.132  -6.693  12.156
  175   HH22  ARG  19          HH12      ARG  19 -24.815  -6.442  11.826
  176    H    ASP  20           HN       ASP  20 -25.160 -15.012   8.592
  177    HA   ASP  20           HA       ASP  20 -24.144 -17.346  10.069
  178    HB2  ASP  20           HB2      ASP  20 -25.994 -18.542   9.070
  179    HB3  ASP  20           HB1      ASP  20 -26.597 -16.962   9.559
  180    H    GLU  21           HN       GLU  21 -23.037 -15.704   7.476
  181    HA   GLU  21           HA       GLU  21 -22.258 -18.114   5.894
  182    HB2  GLU  21           HB2      GLU  21 -23.202 -16.101   4.717
  183    HB3  GLU  21           HB1      GLU  21 -21.794 -15.186   5.255
  184    HG2  GLU  21           HG2      GLU  21 -21.336 -15.975   3.019
  185    HG3  GLU  21           HG1      GLU  21 -20.340 -16.919   4.123
  186    H    LYS  22           HN       LYS  22 -20.366 -19.017   6.343
  187    HA   LYS  22           HA       LYS  22 -18.392 -17.772   8.064
  188    HB2  LYS  22           HB2      LYS  22 -18.796 -20.233   7.982
  189    HB3  LYS  22           HB1      LYS  22 -18.122 -20.258   6.352
  190    HG2  LYS  22           HG2      LYS  22 -15.988 -19.389   7.192
  191    HG3  LYS  22           HG1      LYS  22 -16.655 -19.286   8.822
  192    HD2  LYS  22           HD2      LYS  22 -17.008 -21.733   8.830
  193    HD3  LYS  22           HD1      LYS  22 -16.319 -21.832   7.208
  194    HE2  LYS  22           HE2      LYS  22 -14.190 -20.916   8.043
  195    HE3  LYS  22           HE1      LYS  22 -14.874 -20.793   9.664
  196    HZ1  LYS  22           HZ1      LYS  22 -14.956 -23.081   9.893
  197    HZ2  LYS  22           HZ2      LYS  22 -13.488 -22.847   9.071
  198    HZ3  LYS  22           HZ3      LYS  22 -14.865 -23.366   8.223
  199    H    TRP  23           HN       TRP  23 -16.652 -16.613   7.503
  200    HA   TRP  23           HA       TRP  23 -16.204 -16.020   4.634
  201    HB2  TRP  23           HB2      TRP  23 -15.264 -14.745   7.207
  202    HB3  TRP  23           HB1      TRP  23 -14.606 -14.280   5.642
  203    HD1  TRP  23           HD1      TRP  23 -18.215 -15.215   5.463
  204    HE1  TRP  23           HE1      TRP  23 -19.663 -13.103   5.236
  205    HE3  TRP  23           HE3      TRP  23 -14.724 -11.633   6.507
  206    HZ2  TRP  23           HZ2      TRP  23 -19.387 -10.268   5.463
  207    HZ3  TRP  23           HZ3      TRP  23 -15.347  -9.235   6.493
  208    HH2  TRP  23           HH2      TRP  23 -17.672  -8.548   5.973
  209    H    GLU  24           HN       GLU  24 -14.190 -16.249   3.642
  210    HA   GLU  24           HA       GLU  24 -12.341 -18.201   4.974
  211    HB2  GLU  24           HB2      GLU  24 -13.397 -18.975   2.864
  212    HB3  GLU  24           HB1      GLU  24 -12.692 -17.593   2.022
  213    HG2  GLU  24           HG2      GLU  24 -10.438 -18.360   2.596
  214    HG3  GLU  24           HG1      GLU  24 -11.109 -19.704   3.518
  215    H    CYS  25           HN       CYS  25 -10.523 -17.366   5.664
  216    HA   CYS  25           HA       CYS  25  -9.608 -14.714   4.723
  217    HB2  CYS  25           HB2      CYS  25  -8.216 -16.341   6.842
  218    HB3  CYS  25           HB1      CYS  25  -8.396 -14.589   6.721
  219    HG   CYS  25           HG       CYS  25 -10.876 -14.822   7.475
  220    H    GLU  26           HN       GLU  26  -7.683 -14.364   3.687
  221    HA   GLU  26           HA       GLU  26  -5.889 -16.681   3.121
  222    HB2  GLU  26           HB2      GLU  26  -7.473 -16.479   1.214
  223    HB3  GLU  26           HB1      GLU  26  -6.971 -14.802   0.996
  224    HG2  GLU  26           HG2      GLU  26  -4.667 -15.516   0.571
  225    HG3  GLU  26           HG1      GLU  26  -5.114 -17.195   0.868
  226    H    SER  27           HN       SER  27  -4.207 -15.837   4.298
  227    HA   SER  27           HA       SER  27  -3.439 -13.015   4.054
  228    HB2  SER  27           HB2      SER  27  -2.037 -13.395   5.873
  229    HB3  SER  27           HB1      SER  27  -3.280 -14.613   6.144
  230    HG   SER  27           HG       SER  27  -1.576 -15.872   6.169
  231    H    ILE  28           HN       ILE  28  -1.907 -12.217   2.785
  232    HA   ILE  28           HA       ILE  28   0.185 -13.957   1.641
  233    HB   ILE  28           HB       ILE  28  -1.706 -14.027   0.010
  234   HG12  ILE  28          HG12      ILE  28  -0.364 -13.296  -1.961
  235   HG13  ILE  28          HG11      ILE  28   0.751 -12.473  -0.874
  236   HG21  ILE  28          HG21      ILE  28  -2.439 -12.034  -1.114
  237   HG22  ILE  28          HG22      ILE  28  -1.190 -11.062  -0.335
  238   HG23  ILE  28          HG23      ILE  28  -2.529 -11.705   0.616
  239   HD11  ILE  28          HD11      ILE  28   1.213 -14.968  -1.710
  240   HD12  ILE  28          HD12      ILE  28   0.183 -15.365  -0.334
  241   HD13  ILE  28          HD13      ILE  28   1.668 -14.442  -0.091
  242    H    GLU  29           HN       GLU  29   2.085 -12.863   1.401
  243    HA   GLU  29           HA       GLU  29   2.228 -10.119   2.411
  244    HB2  GLU  29           HB2      GLU  29   4.338 -12.042   1.399
  245    HB3  GLU  29           HB1      GLU  29   4.701 -10.435   2.029
  246    HG2  GLU  29           HG2      GLU  29   3.674 -11.012   4.176
  247    HG3  GLU  29           HG1      GLU  29   3.222 -12.599   3.555
  248    H    GLU  30           HN       GLU  30   2.028  -8.369   1.171
  249    HA   GLU  30           HA       GLU  30   3.154  -8.361  -1.573
  250    HB2  GLU  30           HB2      GLU  30   0.730  -9.049  -1.744
  251    HB3  GLU  30           HB1      GLU  30   0.307  -7.486  -1.043
  252    HG2  GLU  30           HG2      GLU  30   1.274  -6.294  -2.880
  253    HG3  GLU  30           HG1      GLU  30   2.024  -7.754  -3.521
  254    H    VAL  31           HN       VAL  31   3.307  -6.184  -2.446
  255    HA   VAL  31           HA       VAL  31   4.265  -4.274  -0.536
  256    HB   VAL  31           HB       VAL  31   3.519  -3.862  -3.440
  257   HG11  VAL  31          HG11      VAL  31   3.760  -1.746  -2.268
  258   HG12  VAL  31          HG12      VAL  31   5.187  -2.003  -3.266
  259   HG13  VAL  31          HG13      VAL  31   5.264  -2.286  -1.526
  260   HG21  VAL  31          HG21      VAL  31   6.038  -4.809  -2.056
  261   HG22  VAL  31          HG22      VAL  31   6.066  -4.125  -3.681
  262   HG23  VAL  31          HG23      VAL  31   5.153  -5.599  -3.361
  263    H    ALA  32           HN       ALA  32   3.311  -2.524   0.376
  264    HA   ALA  32           HA       ALA  32   0.485  -2.431   0.704
  265    HB1  ALA  32           HB1      ALA  32   2.476  -0.165   1.050
  266    HB2  ALA  32           HB2      ALA  32   2.143  -1.401   2.263
  267    HB3  ALA  32           HB3      ALA  32   0.878  -0.264   1.791
  268    H    ASP  33           HN       ASP  33   2.607  -0.633  -1.496
  269    HA   ASP  33           HA       ASP  33   0.668   1.211  -2.477
  270    HB2  ASP  33           HB2      ASP  33   3.155   0.014  -3.723
  271    HB3  ASP  33           HB1      ASP  33   2.199   1.258  -4.529
  272    H    ASP  34           HN       ASP  34   0.728  -2.126  -2.750
  273    HA   ASP  34           HA       ASP  34  -0.329  -2.474  -5.432
  274    HB2  ASP  34           HB2      ASP  34   0.802  -4.275  -4.106
  275    HB3  ASP  34           HB1      ASP  34  -0.581  -4.291  -3.015
  276    H    ILE  35           HN       ILE  35  -2.017  -3.364  -2.453
  277    HA   ILE  35           HA       ILE  35  -4.600  -2.630  -3.679
  278    HB   ILE  35           HB       ILE  35  -5.610  -3.876  -1.915
  279   HG12  ILE  35          HG12      ILE  35  -4.476  -2.888   0.029
  280   HG13  ILE  35          HG11      ILE  35  -4.311  -4.640   0.093
  281   HG21  ILE  35          HG21      ILE  35  -4.382  -6.004  -1.949
  282   HG22  ILE  35          HG22      ILE  35  -2.925  -5.167  -2.484
  283   HG23  ILE  35          HG23      ILE  35  -4.334  -5.243  -3.540
  284   HD11  ILE  35          HD11      ILE  35  -2.215  -2.627  -0.747
  285   HD12  ILE  35          HD12      ILE  35  -2.051  -4.356  -1.054
  286   HD13  ILE  35          HD13      ILE  35  -2.150  -3.761   0.597
  287    H    LEU  36           HN       LEU  36  -2.277  -0.977  -2.002
  288    HA   LEU  36           HA       LEU  36  -4.276   0.754  -0.641
  289    HB2  LEU  36           HB2      LEU  36  -2.179  -0.491   0.557
  290    HB3  LEU  36           HB1      LEU  36  -1.403   1.025   0.095
  291    HG   LEU  36           HG       LEU  36  -2.362   1.300   2.297
  292   HD11  LEU  36          HD11      LEU  36  -4.370   2.703   0.536
  293   HD12  LEU  36          HD12      LEU  36  -2.661   3.101   0.390
  294   HD13  LEU  36          HD13      LEU  36  -3.488   3.320   1.930
  295   HD21  LEU  36          HD21      LEU  36  -4.402   0.486   2.964
  296   HD22  LEU  36          HD22      LEU  36  -4.273  -0.540   1.537
  297   HD23  LEU  36          HD23      LEU  36  -5.195   0.960   1.465
  298    HA   PRO  37           HA       PRO  37  -3.001   3.219  -4.300
  299    HB2  PRO  37           HB2      PRO  37  -5.083   4.972  -3.042
  300    HB3  PRO  37           HB1      PRO  37  -4.879   4.509  -4.744
  301    HG2  PRO  37           HG2      PRO  37  -6.772   3.399  -3.230
  302    HG3  PRO  37           HG1      PRO  37  -5.890   2.453  -4.442
  303    HD2  PRO  37           HD2      PRO  37  -5.612   2.433  -1.466
  304    HD3  PRO  37           HD1      PRO  37  -5.384   1.109  -2.633
  305    H    ASP  38           HN       ASP  38  -1.567   4.880  -4.429
  306    HA   ASP  38           HA       ASP  38  -0.051   5.744  -2.235
  307    HB2  ASP  38           HB2      ASP  38  -0.537   7.023  -4.935
  308    HB3  ASP  38           HB1      ASP  38   0.635   7.663  -3.782
  309    H    GLN  39           HN       GLN  39  -3.219   6.582  -2.963
  310    HA   GLN  39           HA       GLN  39  -3.396   9.318  -2.234
  311    HB2  GLN  39           HB2      GLN  39  -5.350   7.034  -1.840
  312    HB3  GLN  39           HB1      GLN  39  -5.757   8.725  -1.541
  313    HG2  GLN  39           HG2      GLN  39  -5.225   9.292  -3.864
  314    HG3  GLN  39           HG1      GLN  39  -4.743   7.625  -4.180
  315   HE21  GLN  39          HE21      GLN  39  -7.337   9.732  -4.508
  316   HE22  GLN  39          HE22      GLN  39  -8.594   8.594  -4.587
  317    H    TYR  40           HN       TYR  40  -2.352   6.724  -0.360
  318    HA   TYR  40           HA       TYR  40  -2.491   8.398   2.091
  319    HB2  TYR  40           HB2      TYR  40  -3.678   5.631   1.807
  320    HB3  TYR  40           HB1      TYR  40  -3.202   6.282   3.376
  321    HD1  TYR  40           HD1      TYR  40  -4.253   8.381   4.226
  322    HD2  TYR  40           HD2      TYR  40  -5.645   6.408   0.676
  323    HE1  TYR  40           HE1      TYR  40  -6.360   9.673   4.342
  324    HE2  TYR  40           HE2      TYR  40  -7.757   7.703   0.786
  325    HH   TYR  40           HH       TYR  40  -9.031   9.031   2.107
  326    H    VAL  41           HN       VAL  41  -0.618   6.850   0.014
  327    HA   VAL  41           HA       VAL  41   1.305   5.896   2.120
  328    HB   VAL  41           HB       VAL  41   1.401   4.828  -0.695
  329   HG11  VAL  41          HG11      VAL  41   3.172   4.267   0.915
  330   HG12  VAL  41          HG12      VAL  41   2.234   2.836   0.482
  331   HG13  VAL  41          HG13      VAL  41   1.960   3.636   2.029
  332   HG21  VAL  41          HG21      VAL  41  -0.925   4.531  -0.145
  333   HG22  VAL  41          HG22      VAL  41  -0.528   3.966   1.476
  334   HG23  VAL  41          HG23      VAL  41  -0.127   2.976   0.071
  335    H    ARG  42           HN       ARG  42   0.670   8.203  -0.204
  336    HA   ARG  42           HA       ARG  42   2.921   8.697  -1.717
  337    HB2  ARG  42           HB2      ARG  42   2.529  11.227  -0.959
  338    HB3  ARG  42           HB1      ARG  42   1.321  10.390  -1.932
  339    HG2  ARG  42           HG2      ARG  42   0.028   9.843   0.072
  340    HG3  ARG  42           HG1      ARG  42   1.262  10.569   1.099
  341    HD2  ARG  42           HD2      ARG  42  -0.543  12.163   0.800
  342    HD3  ARG  42           HD1      ARG  42   0.889  12.744  -0.051
  343    HE   ARG  42           HE       ARG  42  -0.221  12.351  -2.123
  344   HH11  ARG  42          HH21      ARG  42  -1.962  11.072   0.584
  345   HH12  ARG  42          HH22      ARG  42  -3.410  10.799  -0.324
  346   HH21  ARG  42          HH11      ARG  42  -2.098  12.001  -3.296
  347   HH22  ARG  42          HH12      ARG  42  -3.487  11.326  -2.515
  348    H    LEU  43           HN       LEU  43   2.592   9.677   1.702
  349    HA   LEU  43           HA       LEU  43   5.528  10.129   1.847
  350    HB2  LEU  43           HB2      LEU  43   3.153  10.930   3.523
  351    HB3  LEU  43           HB1      LEU  43   4.748  10.881   4.272
  352    HG   LEU  43           HG       LEU  43   5.609  12.378   2.493
  353   HD11  LEU  43          HD11      LEU  43   3.883  13.546   1.070
  354   HD12  LEU  43          HD12      LEU  43   2.712  12.343   1.611
  355   HD13  LEU  43          HD13      LEU  43   4.121  11.845   0.673
  356   HD21  LEU  43          HD21      LEU  43   3.173  13.360   4.007
  357   HD22  LEU  43          HD22      LEU  43   4.343  14.418   3.217
  358   HD23  LEU  43          HD23      LEU  43   4.847  13.394   4.562
  359    H    GLY  44           HN       GLY  44   2.921   8.284   3.402
  360    HA2  GLY  44           HA2      GLY  44   4.132   6.922   5.418
  361    HA3  GLY  44           HA1      GLY  44   3.029   6.110   4.317
  362    HA   PRO  45           HA       PRO  45   7.827   5.383   3.134
  363    HB2  PRO  45           HB2      PRO  45   8.286   4.176   5.842
  364    HB3  PRO  45           HB1      PRO  45   9.404   5.105   4.823
  365    HG2  PRO  45           HG2      PRO  45   8.247   6.174   6.993
  366    HG3  PRO  45           HG1      PRO  45   8.584   7.133   5.542
  367    HD2  PRO  45           HD2      PRO  45   5.977   6.103   6.553
  368    HD3  PRO  45           HD1      PRO  45   6.326   7.561   5.604
  369    H    LEU  46           HN       LEU  46   5.117   3.924   4.373
  370    HA   LEU  46           HA       LEU  46   5.827   1.135   4.301
  371    HB2  LEU  46           HB2      LEU  46   3.073   2.336   3.869
  372    HB3  LEU  46           HB1      LEU  46   3.457   0.748   4.531
  373    HG   LEU  46           HG       LEU  46   4.177   3.390   5.846
  374   HD11  LEU  46          HD11      LEU  46   2.442   2.685   7.518
  375   HD12  LEU  46          HD12      LEU  46   1.971   1.390   6.417
  376   HD13  LEU  46          HD13      LEU  46   1.777   3.075   5.932
  377   HD21  LEU  46          HD21      LEU  46   4.529   1.752   7.817
  378   HD22  LEU  46          HD22      LEU  46   5.758   1.766   6.554
  379   HD23  LEU  46          HD23      LEU  46   4.550   0.483   6.593
  380    H    SER  47           HN       SER  47   5.749   3.382   1.896
  381    HA   SER  47           HA       SER  47   4.324   2.123  -0.233
  382    HB2  SER  47           HB2      SER  47   5.786   3.496  -1.714
  383    HB3  SER  47           HB1      SER  47   5.103   4.441  -0.394
  384    HG   SER  47           HG       SER  47   7.681   3.235  -0.427
  385    H    ASN  48           HN       ASN  48   7.729   1.817   0.771
  386    HA   ASN  48           HA       ASN  48   8.115  -0.338  -1.254
  387    HB2  ASN  48           HB2      ASN  48  10.022   1.154   0.574
  388    HB3  ASN  48           HB1      ASN  48  10.520  -0.217  -0.417
  389   HD21  ASN  48          HD21      ASN  48  11.642   2.371  -0.872
  390   HD22  ASN  48          HD22      ASN  48  11.090   2.945  -2.371
  391    H    LYS  49           HN       LYS  49   6.820  -0.206   1.729
  392    HA   LYS  49           HA       LYS  49   8.267  -2.541   2.844
  393    HB2  LYS  49           HB2      LYS  49   7.508  -0.562   4.271
  394    HB3  LYS  49           HB1      LYS  49   5.868  -1.175   4.053
  395    HG2  LYS  49           HG2      LYS  49   6.477  -2.265   6.032
  396    HG3  LYS  49           HG1      LYS  49   6.926  -3.475   4.829
  397    HD2  LYS  49           HD2      LYS  49   9.254  -2.723   4.889
  398    HD3  LYS  49           HD1      LYS  49   8.829  -1.418   5.995
  399    HE2  LYS  49           HE2      LYS  49   9.774  -3.276   7.253
  400    HE3  LYS  49           HE1      LYS  49   8.060  -3.115   7.642
  401    HZ1  LYS  49           HZ1      LYS  49   7.513  -4.962   6.395
  402    HZ2  LYS  49           HZ2      LYS  49   8.996  -5.428   7.083
  403    HZ3  LYS  49           HZ3      LYS  49   8.932  -4.904   5.468
  404    H    ILE  50           HN       ILE  50   7.438  -4.541   3.031
  405    HA   ILE  50           HA       ILE  50   5.019  -5.173   1.441
  406    HB   ILE  50           HB       ILE  50   7.146  -6.934   2.687
  407   HG12  ILE  50          HG12      ILE  50   6.562  -6.347  -0.229
  408   HG13  ILE  50          HG11      ILE  50   7.773  -5.472   0.706
  409   HG21  ILE  50          HG21      ILE  50   5.102  -8.193   2.596
  410   HG22  ILE  50          HG22      ILE  50   6.066  -8.688   1.204
  411   HG23  ILE  50          HG23      ILE  50   4.721  -7.568   0.993
  412   HD11  ILE  50          HD11      ILE  50   8.978  -7.555   1.156
  413   HD12  ILE  50          HD12      ILE  50   8.763  -7.357  -0.583
  414   HD13  ILE  50          HD13      ILE  50   7.736  -8.479   0.310
  415    H    LEU  51           HN       LEU  51   3.174  -5.036   2.566
  416    HA   LEU  51           HA       LEU  51   3.130  -5.874   5.440
  417    HB2  LEU  51           HB2      LEU  51   1.400  -4.063   3.764
  418    HB3  LEU  51           HB1      LEU  51   0.766  -4.759   5.253
  419    HG   LEU  51           HG       LEU  51   2.733  -3.833   6.479
  420   HD11  LEU  51          HD11      LEU  51   4.426  -3.596   4.858
  421   HD12  LEU  51          HD12      LEU  51   3.930  -1.936   5.164
  422   HD13  LEU  51          HD13      LEU  51   3.358  -2.776   3.722
  423   HD21  LEU  51          HD21      LEU  51   2.014  -1.400   6.213
  424   HD22  LEU  51          HD22      LEU  51   0.722  -2.546   6.571
  425   HD23  LEU  51          HD23      LEU  51   0.944  -1.954   4.924
  426    H    GLN  52           HN       GLN  52   1.710  -7.424   6.150
  427    HA   GLN  52           HA       GLN  52   1.015  -9.509   4.296
  428    HB2  GLN  52           HB2      GLN  52   1.533  -9.856   6.725
  429    HB3  GLN  52           HB1      GLN  52  -0.008  -9.095   7.118
  430    HG2  GLN  52           HG2      GLN  52  -0.333 -11.497   7.117
  431    HG3  GLN  52           HG1      GLN  52  -1.150 -10.834   5.703
  432   HE21  GLN  52          HE21      GLN  52  -0.906 -12.601   4.250
  433   HE22  GLN  52          HE22      GLN  52   0.603 -13.204   3.759
  434    H    THR  53           HN       THR  53  -0.622  -9.437   2.914
  435    HA   THR  53           HA       THR  53  -2.946  -7.650   3.435
  436    HB   THR  53           HB       THR  53  -2.186  -9.200   0.938
  437    HG1  THR  53           HG1      THR  53  -1.973  -6.441   1.112
  438   HG21  THR  53          HG21      THR  53  -3.755  -7.653  -0.165
  439   HG22  THR  53          HG22      THR  53  -4.130  -6.921   1.396
  440   HG23  THR  53          HG23      THR  53  -4.573  -8.598   1.080
  441    H    ASN  54           HN       ASN  54  -4.619  -8.582   4.447
  442    HA   ASN  54           HA       ASN  54  -5.148 -11.496   4.052
  443    HB2  ASN  54           HB2      ASN  54  -4.852 -10.666   6.386
  444    HB3  ASN  54           HB1      ASN  54  -6.255  -9.620   6.157
  445   HD21  ASN  54          HD21      ASN  54  -6.358 -11.619   8.146
  446   HD22  ASN  54          HD22      ASN  54  -7.440 -12.833   7.666
  447    H    THR  55           HN       THR  55  -6.332 -11.601   2.230
  448    HA   THR  55           HA       THR  55  -8.640  -9.766   1.838
  449    HB   THR  55           HB       THR  55  -7.555 -11.948   0.033
  450    HG1  THR  55           HG1      THR  55  -7.249  -9.344  -0.706
  451   HG21  THR  55          HG21      THR  55  -8.851 -10.589  -1.683
  452   HG22  THR  55          HG22      THR  55  -9.588  -9.738  -0.326
  453   HG23  THR  55          HG23      THR  55  -9.838 -11.473  -0.520
  454    H    TYR  56           HN       TYR  56 -10.706 -10.431   2.118
  455    HA   TYR  56           HA       TYR  56 -11.138 -13.236   3.065
  456    HB2  TYR  56           HB2      TYR  56 -12.796 -10.722   3.423
  457    HB3  TYR  56           HB1      TYR  56 -13.236 -12.318   4.036
  458    HD1  TYR  56           HD2      TYR  56 -10.823  -9.530   4.327
  459    HD2  TYR  56           HD1      TYR  56 -12.082 -13.319   5.908
  460    HE1  TYR  56           HE2      TYR  56  -9.395  -9.171   6.322
  461    HE2  TYR  56           HE1      TYR  56 -10.653 -12.960   7.902
  462    HH   TYR  56           HH       TYR  56  -9.717 -10.718   9.109
  463    H    TYR  57           HN       TYR  57 -12.326 -14.587   1.903
  464    HA   TYR  57           HA       TYR  57 -13.901 -13.534  -0.429
  465    HB2  TYR  57           HB2      TYR  57 -12.317 -16.104  -0.151
  466    HB3  TYR  57           HB1      TYR  57 -13.404 -15.751  -1.495
  467    HD1  TYR  57           HD1      TYR  57 -12.971 -13.707  -2.923
  468    HD2  TYR  57           HD2      TYR  57 -10.109 -15.200  -0.089
  469    HE1  TYR  57           HE1      TYR  57 -11.180 -12.420  -4.057
  470    HE2  TYR  57           HE2      TYR  57  -8.317 -13.912  -1.223
  471    HH   TYR  57           HH       TYR  57  -9.007 -11.978  -4.139
  472    H    SER  58           HN       SER  58 -15.999 -13.761  -0.041
  473    HA   SER  58           HA       SER  58 -16.996 -16.279   1.222
  474    HB2  SER  58           HB2      SER  58 -18.092 -13.547   1.899
  475    HB3  SER  58           HB1      SER  58 -18.511 -15.087   2.640
  476    HG   SER  58           HG       SER  58 -15.884 -14.027   2.627
  477    H    ASP  59           HN       ASP  59 -19.219 -16.728   0.695
  478    HA   ASP  59           HA       ASP  59 -19.885 -16.316  -2.050
  479    HB2  ASP  59           HB2      ASP  59 -20.729 -18.220  -0.711
  480    HB3  ASP  59           HB1      ASP  59 -21.672 -17.105   0.276
  481    H    THR  60           HN       THR  60 -21.137 -14.803   0.916
  482    HA   THR  60           HA       THR  60 -23.049 -13.096  -0.398
  483    HB   THR  60           HB       THR  60 -22.912 -11.789   1.779
  484    HG1  THR  60           HG1      THR  60 -21.490 -12.409   3.275
  485   HG21  THR  60          HG21      THR  60 -24.542 -13.515   1.685
  486   HG22  THR  60          HG22      THR  60 -23.662 -13.790   3.189
  487   HG23  THR  60          HG23      THR  60 -23.316 -14.781   1.772
  488    H    LEU  61           HN       LEU  61 -19.721 -12.565   0.716
  489    HA   LEU  61           HA       LEU  61 -19.541  -9.805  -0.014
  490    HB2  LEU  61           HB2      LEU  61 -17.443 -11.968   0.281
  491    HB3  LEU  61           HB1      LEU  61 -17.039 -10.275  -0.011
  492    HG   LEU  61           HG       LEU  61 -18.704 -11.271   2.325
  493   HD11  LEU  61          HD11      LEU  61 -16.504 -12.074   2.720
  494   HD12  LEU  61          HD12      LEU  61 -16.588 -10.560   3.611
  495   HD13  LEU  61          HD13      LEU  61 -15.766 -10.621   2.054
  496   HD21  LEU  61          HD21      LEU  61 -17.806  -8.565   1.367
  497   HD22  LEU  61          HD22      LEU  61 -17.859  -8.847   3.107
  498   HD23  LEU  61          HD23      LEU  61 -19.318  -9.036   2.142
  499    H    HIS  62           HN       HIS  62 -18.707 -12.749  -1.803
  500    HA   HIS  62           HA       HIS  62 -17.651 -11.384  -4.107
  501    HB2  HIS  62           HB2      HIS  62 -17.257 -13.806  -3.589
  502    HB3  HIS  62           HB1      HIS  62 -18.946 -14.126  -3.980
  503    HD1  HIS  62           HD1      HIS  62 -19.607 -14.180  -6.454
  504    HD2  HIS  62           HD2      HIS  62 -15.648 -13.017  -5.858
  505    HE1  HIS  62           HE1      HIS  62 -18.517 -14.150  -8.740
  506    H    LYS  63           HN       LYS  63 -20.851 -12.622  -3.262
  507    HA   LYS  63           HA       LYS  63 -22.140 -12.014  -5.750
  508    HB2  LYS  63           HB2      LYS  63 -23.105 -13.484  -3.961
  509    HB3  LYS  63           HB1      LYS  63 -23.354 -12.050  -2.965
  510    HG2  LYS  63           HG2      LYS  63 -24.830 -11.090  -4.662
  511    HG3  LYS  63           HG1      LYS  63 -24.539 -12.465  -5.724
  512    HD2  LYS  63           HD2      LYS  63 -25.530 -13.974  -4.031
  513    HD3  LYS  63           HD1      LYS  63 -25.839 -12.589  -2.985
  514    HE2  LYS  63           HE2      LYS  63 -27.306 -11.603  -4.692
  515    HE3  LYS  63           HE1      LYS  63 -26.971 -12.952  -5.778
  516    HZ1  LYS  63           HZ1      LYS  63 -28.826 -12.794  -3.632
  517    HZ2  LYS  63           HZ2      LYS  63 -27.754 -14.091  -3.399
  518    HZ3  LYS  63           HZ3      LYS  63 -28.669 -13.988  -4.827
  519    H    SER  64           HN       SER  64 -21.705 -10.179  -2.755
  520    HA   SER  64           HA       SER  64 -23.145  -7.835  -3.726
  521    HB2  SER  64           HB2      SER  64 -21.179  -7.916  -1.429
  522    HB3  SER  64           HB1      SER  64 -22.551  -6.833  -1.640
  523    HG   SER  64           HG       SER  64 -23.672  -8.280  -0.625
  524    H    ASN  65           HN       ASN  65 -20.234  -9.157  -4.524
  525    HA   ASN  65           HA       ASN  65 -18.372  -8.378  -5.698
  526    HB2  ASN  65           HB2      ASN  65 -20.266  -7.160  -6.944
  527    HB3  ASN  65           HB1      ASN  65 -19.813  -5.738  -6.007
  528   HD21  ASN  65          HD21      ASN  65 -18.848  -4.523  -7.734
  529   HD22  ASN  65          HD22      ASN  65 -17.465  -5.044  -8.567
  530    H    ILE  66           HN       ILE  66 -18.340  -8.163  -2.896
  531    HA   ILE  66           HA       ILE  66 -16.731  -5.656  -2.492
  532    HB   ILE  66           HB       ILE  66 -18.373  -7.189  -0.454
  533   HG12  ILE  66          HG12      ILE  66 -18.721  -4.381  -1.554
  534   HG13  ILE  66          HG11      ILE  66 -19.619  -5.778  -2.147
  535   HG21  ILE  66          HG21      ILE  66 -16.461  -4.849  -0.280
  536   HG22  ILE  66          HG22      ILE  66 -16.521  -6.298   0.722
  537   HG23  ILE  66          HG23      ILE  66 -17.753  -5.056   0.904
  538   HD11  ILE  66          HD11      ILE  66 -20.993  -4.666  -0.501
  539   HD12  ILE  66          HD12      ILE  66 -19.663  -4.637   0.656
  540   HD13  ILE  66          HD13      ILE  66 -20.413  -6.171   0.213
  541    H    TYR  67           HN       TYR  67 -14.675  -5.946  -1.903
  542    HA   TYR  67           HA       TYR  67 -13.778  -8.693  -1.054
  543    HB2  TYR  67           HB2      TYR  67 -12.289  -6.674  -2.747
  544    HB3  TYR  67           HB1      TYR  67 -11.677  -8.246  -2.233
  545    HD1  TYR  67           HD1      TYR  67 -12.792 -10.346  -3.009
  546    HD2  TYR  67           HD2      TYR  67 -13.842  -6.484  -4.568
  547    HE1  TYR  67           HE1      TYR  67 -13.915 -11.429  -4.937
  548    HE2  TYR  67           HE2      TYR  67 -14.966  -7.568  -6.496
  549    HH   TYR  67           HH       TYR  67 -14.607 -10.011  -7.696
  550    HA   PRO  68           HA       PRO  68 -12.771  -5.739   2.362
  551    HB2  PRO  68           HB2      PRO  68 -12.865  -8.273   3.916
  552    HB3  PRO  68           HB1      PRO  68 -13.676  -6.727   4.237
  553    HG2  PRO  68           HG2      PRO  68 -15.023  -8.856   3.351
  554    HG3  PRO  68           HG1      PRO  68 -15.446  -7.213   2.841
  555    HD2  PRO  68           HD2      PRO  68 -13.945  -9.328   1.324
  556    HD3  PRO  68           HD1      PRO  68 -15.138  -8.154   0.734
  557    H    PHE  69           HN       PHE  69 -10.762  -5.369   3.288
  558    HA   PHE  69           HA       PHE  69  -8.716  -7.516   3.182
  559    HB2  PHE  69           HB2      PHE  69  -7.130  -6.104   1.976
  560    HB3  PHE  69           HB1      PHE  69  -8.584  -6.337   1.006
  561    HD1  PHE  69           HD2      PHE  69  -6.689  -3.943   3.093
  562    HD2  PHE  69           HD1      PHE  69 -10.123  -4.510   0.574
  563    HE1  PHE  69           HE2      PHE  69  -7.009  -1.487   2.974
  564    HE2  PHE  69           HE1      PHE  69 -10.440  -2.052   0.454
  565    HZ   PHE  69           HZ       PHE  69  -8.885  -0.541   1.652
  566    H    ILE  70           HN       ILE  70  -7.120  -7.275   4.690
  567    HA   ILE  70           HA       ILE  70  -7.076  -4.785   6.346
  568    HB   ILE  70           HB       ILE  70  -7.113  -7.614   7.437
  569   HG12  ILE  70          HG12      ILE  70  -9.113  -5.354   7.772
  570   HG13  ILE  70          HG11      ILE  70  -9.320  -6.684   6.634
  571   HG21  ILE  70          HG21      ILE  70  -6.797  -4.881   8.707
  572   HG22  ILE  70          HG22      ILE  70  -5.673  -6.237   8.788
  573   HG23  ILE  70          HG23      ILE  70  -7.219  -6.323   9.633
  574   HD11  ILE  70          HD11      ILE  70  -8.990  -8.239   8.668
  575   HD12  ILE  70          HD12      ILE  70 -10.518  -7.370   8.557
  576   HD13  ILE  70          HD13      ILE  70  -9.259  -6.799   9.649
  577    H    LEU  71           HN       LEU  71  -5.059  -4.214   7.033
  578    HA   LEU  71           HA       LEU  71  -2.771  -5.821   5.957
  579    HB2  LEU  71           HB2      LEU  71  -2.838  -2.923   6.849
  580    HB3  LEU  71           HB1      LEU  71  -1.514  -3.737   6.015
  581    HG   LEU  71           HG       LEU  71  -4.300  -3.309   4.894
  582   HD11  LEU  71          HD11      LEU  71  -3.337  -1.638   3.490
  583   HD12  LEU  71          HD12      LEU  71  -1.697  -2.090   3.955
  584   HD13  LEU  71          HD13      LEU  71  -2.751  -1.283   5.116
  585   HD21  LEU  71          HD21      LEU  71  -3.530  -5.274   3.860
  586   HD22  LEU  71          HD22      LEU  71  -1.844  -4.758   3.904
  587   HD23  LEU  71          HD23      LEU  71  -2.963  -4.031   2.752
  588    H    TYR  72           HN       TYR  72  -1.438  -6.786   7.331
  589    HA   TYR  72           HA       TYR  72  -1.419  -5.935  10.212
  590    HB2  TYR  72           HB2      TYR  72  -1.299  -8.725   9.039
  591    HB3  TYR  72           HB1      TYR  72  -0.924  -8.355  10.722
  592    HD1  TYR  72           HD2      TYR  72  -2.706  -7.056  12.078
  593    HD2  TYR  72           HD1      TYR  72  -3.542  -9.085   8.385
  594    HE1  TYR  72           HE2      TYR  72  -5.121  -7.086  12.641
  595    HE2  TYR  72           HE1      TYR  72  -5.957  -9.114   8.948
  596    HH   TYR  72           HH       TYR  72  -7.153  -7.666  11.983
  597    H    TYR  73           HN       TYR  73   0.555  -5.855  11.197
  598    HA   TYR  73           HA       TYR  73   2.990  -6.653   9.683
  599    HB2  TYR  73           HB2      TYR  73   2.618  -4.327   9.052
  600    HB3  TYR  73           HB1      TYR  73   2.441  -3.866  10.746
  601    HD1  TYR  73           HD2      TYR  73   4.854  -5.467   8.367
  602    HD2  TYR  73           HD1      TYR  73   4.330  -3.219  11.989
  603    HE1  TYR  73           HE2      TYR  73   7.309  -5.162   8.534
  604    HE2  TYR  73           HE1      TYR  73   6.783  -2.912  12.155
  605    HH   TYR  73           HH       TYR  73   8.991  -4.482   9.867
  606    H    GLN  74           HN       GLN  74   3.544  -8.165  11.185
  607    HA   GLN  74           HA       GLN  74   4.329  -9.081  13.168
  608    HB2  GLN  74           HB2      GLN  74   5.926  -7.057  12.698
  609    HB3  GLN  74           HB1      GLN  74   5.132  -6.332  14.096
  610    HG2  GLN  74           HG2      GLN  74   6.494  -9.048  14.058
  611    HG3  GLN  74           HG1      GLN  74   7.172  -7.579  14.761
  612   HE21  GLN  74          HE21      GLN  74   5.453 -10.351  15.577
  613   HE22  GLN  74          HE22      GLN  74   4.721  -9.796  17.004
  614    H    LYS  75           HN       LYS  75   1.902  -9.229  13.525
  615    HA   LYS  75           HA       LYS  75   0.034  -9.038  14.927
  616    HB2  LYS  75           HB2      LYS  75   2.334  -8.814  16.891
  617    HB3  LYS  75           HB1      LYS  75   0.651  -9.058  17.370
  618    HG2  LYS  75           HG2      LYS  75   0.557 -11.128  16.038
  619    HG3  LYS  75           HG1      LYS  75   2.230 -10.886  15.534
  620    HD2  LYS  75           HD2      LYS  75   2.938 -10.984  17.913
  621    HD3  LYS  75           HD1      LYS  75   1.266 -11.304  18.377
  622    HE2  LYS  75           HE2      LYS  75   2.904 -13.033  16.499
  623    HE3  LYS  75           HE1      LYS  75   2.595 -13.397  18.197
  624    HZ1  LYS  75           HZ1      LYS  75   0.956 -13.911  15.979
  625    HZ2  LYS  75           HZ2      LYS  75   0.152 -12.808  16.990
  626    HZ3  LYS  75           HZ3      LYS  75   0.681 -14.301  17.607
  627    H    GLN  76           HN       GLN  76   0.745  -6.619  13.650
  628    HA   GLN  76           HA       GLN  76  -0.346  -4.690  15.636
  629    HB2  GLN  76           HB2      GLN  76   2.248  -4.534  15.281
  630    HB3  GLN  76           HB1      GLN  76   1.820  -3.782  13.746
  631    HG2  GLN  76           HG2      GLN  76   0.863  -2.873  16.479
  632    HG3  GLN  76           HG1      GLN  76   2.117  -2.084  15.526
  633   HE21  GLN  76          HE21      GLN  76   1.432  -1.021  13.485
  634   HE22  GLN  76          HE22      GLN  76  -0.190  -0.586  13.250
  635    H    LEU  77           HN       LEU  77  -2.148  -3.921  14.810
  636    HA   LEU  77           HA       LEU  77  -2.915  -4.224  12.062
  637    HB2  LEU  77           HB2      LEU  77  -4.573  -4.127  13.872
  638    HB3  LEU  77           HB1      LEU  77  -4.082  -2.479  14.254
  639    HG   LEU  77           HG       LEU  77  -4.824  -1.719  12.035
  640   HD11  LEU  77          HD11      LEU  77  -6.254  -3.527  10.751
  641   HD12  LEU  77          HD12      LEU  77  -5.245  -4.676  11.630
  642   HD13  LEU  77          HD13      LEU  77  -4.504  -3.498  10.548
  643   HD21  LEU  77          HD21      LEU  77  -6.422  -1.972  14.024
  644   HD22  LEU  77          HD22      LEU  77  -7.020  -3.424  13.218
  645   HD23  LEU  77          HD23      LEU  77  -7.164  -1.854  12.429
  646    H    ILE  78           HN       ILE  78  -2.610  -2.882  10.371
  647    HA   ILE  78           HA       ILE  78  -1.283  -0.246  10.871
  648    HB   ILE  78           HB       ILE  78  -1.335  -1.994   8.399
  649   HG12  ILE  78          HG12      ILE  78   0.029  -2.678  10.544
  650   HG13  ILE  78          HG11      ILE  78   0.821  -2.725   8.973
  651   HG21  ILE  78          HG21      ILE  78  -1.104   0.236   7.634
  652   HG22  ILE  78          HG22      ILE  78   0.555  -0.349   7.753
  653   HG23  ILE  78          HG23      ILE  78  -0.104   0.694   9.012
  654   HD11  ILE  78          HD11      ILE  78   2.074  -0.801   9.392
  655   HD12  ILE  78          HD12      ILE  78   2.028  -1.543  10.988
  656   HD13  ILE  78          HD13      ILE  78   0.953  -0.200  10.610
  657    H    ALA  79           HN       ALA  79  -3.824  -1.812   8.928
  658    HA   ALA  79           HA       ALA  79  -5.407   0.626   9.017
  659    HB1  ALA  79           HB1      ALA  79  -5.287   1.315   6.766
  660    HB2  ALA  79           HB2      ALA  79  -4.492  -0.175   6.258
  661    HB3  ALA  79           HB3      ALA  79  -3.607   1.013   7.214
  662    H    ILE  80           HN       ILE  80  -7.467   0.382   7.958
  663    HA   ILE  80           HA       ILE  80  -8.200  -2.418   7.199
  664    HB   ILE  80           HB       ILE  80  -9.718  -0.614   9.104
  665   HG12  ILE  80          HG12      ILE  80  -8.529  -3.366   9.546
  666   HG13  ILE  80          HG11      ILE  80  -7.707  -1.870   9.987
  667   HG21  ILE  80          HG21      ILE  80 -11.188  -2.708   9.255
  668   HG22  ILE  80          HG22      ILE  80 -10.394  -3.244   7.776
  669   HG23  ILE  80          HG23      ILE  80 -11.336  -1.754   7.781
  670   HD11  ILE  80          HD11      ILE  80 -10.503  -2.470  10.957
  671   HD12  ILE  80          HD12      ILE  80  -9.344  -1.310  11.605
  672   HD13  ILE  80          HD13      ILE  80  -9.081  -3.039  11.831
  673    H    GLY  81           HN       GLY  81  -9.657  -2.548   5.545
  674    HA2  GLY  81           HA2      GLY  81 -11.440  -0.449   4.750
  675    HA3  GLY  81           HA1      GLY  81  -9.979  -0.363   3.767
  676    H    PHE  82           HN       PHE  82 -12.555  -0.964   2.765
  677    HA   PHE  82           HA       PHE  82 -12.047  -3.691   1.664
  678    HB2  PHE  82           HB2      PHE  82 -14.449  -4.226   1.802
  679    HB3  PHE  82           HB1      PHE  82 -13.783  -3.931   3.407
  680    HD1  PHE  82           HD1      PHE  82 -14.264  -1.811   4.598
  681    HD2  PHE  82           HD2      PHE  82 -16.079  -2.734   0.813
  682    HE1  PHE  82           HE1      PHE  82 -15.963  -0.046   4.983
  683    HE2  PHE  82           HE2      PHE  82 -17.778  -0.965   1.201
  684    HZ   PHE  82           HZ       PHE  82 -17.717   0.380   3.281
  685    H    ILE  83           HN       ILE  83 -12.855  -4.011  -0.443
  686    HA   ILE  83           HA       ILE  83 -13.084  -1.497  -1.992
  687    HB   ILE  83           HB       ILE  83 -12.853  -4.390  -2.877
  688   HG12  ILE  83          HG12      ILE  83 -10.798  -2.158  -2.938
  689   HG13  ILE  83          HG11      ILE  83 -10.883  -3.364  -1.655
  690   HG21  ILE  83          HG21      ILE  83 -13.906  -3.189  -4.648
  691   HG22  ILE  83          HG22      ILE  83 -12.194  -3.224  -5.069
  692   HG23  ILE  83          HG23      ILE  83 -12.903  -1.766  -4.378
  693   HD11  ILE  83          HD11      ILE  83  -9.237  -4.058  -3.325
  694   HD12  ILE  83          HD12      ILE  83 -10.444  -3.920  -4.604
  695   HD13  ILE  83          HD13      ILE  83 -10.615  -5.157  -3.360
  696    H    ASP  84           HN       ASP  84 -14.989  -0.708  -2.554
  697    HA   ASP  84           HA       ASP  84 -17.450  -2.253  -2.121
  698    HB2  ASP  84           HB2      ASP  84 -17.240   0.548  -3.230
  699    HB3  ASP  84           HB1      ASP  84 -18.594  -0.182  -2.368
  700    H    GLU  85           HN       GLU  85 -19.214  -1.761  -3.865
  701    HA   GLU  85           HA       GLU  85 -18.539  -3.212  -6.229
  702    HB2  GLU  85           HB2      GLU  85 -20.840  -3.017  -5.250
  703    HB3  GLU  85           HB1      GLU  85 -20.892  -1.343  -5.802
  704    HG2  GLU  85           HG2      GLU  85 -20.600  -2.073  -8.122
  705    HG3  GLU  85           HG1      GLU  85 -20.473  -3.749  -7.596
  706    H    ASN  86           HN       ASN  86 -18.504   0.203  -5.481
  707    HA   ASN  86           HA       ASN  86 -18.180   0.998  -8.307
  708    HB2  ASN  86           HB2      ASN  86 -18.097   2.562  -5.707
  709    HB3  ASN  86           HB1      ASN  86 -17.889   3.294  -7.299
  710   HD21  ASN  86          HD21      ASN  86 -19.950   1.002  -8.174
  711   HD22  ASN  86          HD22      ASN  86 -21.441   1.726  -7.814
  712    H    HIS  87           HN       HIS  87 -16.236  -0.775  -6.831
  713    HA   HIS  87           HA       HIS  87 -13.918  -1.074  -6.682
  714    HB2  HIS  87           HB2      HIS  87 -14.063   1.085  -8.808
  715    HB3  HIS  87           HB1      HIS  87 -12.566   0.274  -8.355
  716    HD1  HIS  87           HD1      HIS  87 -15.986  -0.467  -9.824
  717    HD2  HIS  87           HD2      HIS  87 -12.257  -2.291  -9.432
  718    HE1  HIS  87           HE1      HIS  87 -16.065  -2.573 -11.232
  719    H    ASP  88           HN       ASP  88 -15.454   1.480  -5.447
  720    HA   ASP  88           HA       ASP  88 -13.245   3.249  -4.786
  721    HB2  ASP  88           HB2      ASP  88 -16.053   2.971  -3.694
  722    HB3  ASP  88           HB1      ASP  88 -14.915   4.196  -3.131
  723    H    MET  89           HN       MET  89 -12.053   3.325  -2.932
  724    HA   MET  89           HA       MET  89 -12.144   0.907  -1.187
  725    HB2  MET  89           HB2      MET  89 -10.027   3.012  -1.688
  726    HB3  MET  89           HB1      MET  89  -9.874   1.757  -0.457
  727    HG2  MET  89           HG2      MET  89 -10.144   0.020  -2.191
  728    HG3  MET  89           HG1      MET  89 -10.291   1.271  -3.424
  729    HE1  MET  89           HE1      MET  89  -6.862   0.145  -4.459
  730    HE2  MET  89           HE2      MET  89  -8.559   0.416  -4.846
  731    HE3  MET  89           HE3      MET  89  -8.100  -0.956  -3.841
  732    H    ASP  90           HN       ASP  90 -13.277   1.151   0.615
  733    HA   ASP  90           HA       ASP  90 -13.569   3.843   1.863
  734    HB2  ASP  90           HB2      ASP  90 -15.581   2.379   1.358
  735    HB3  ASP  90           HB1      ASP  90 -14.992   1.281   2.608
  736    H    PHE  91           HN       PHE  91 -12.107   4.297   3.383
  737    HA   PHE  91           HA       PHE  91 -10.849   2.087   4.943
  738    HB2  PHE  91           HB2      PHE  91 -10.094   5.000   4.590
  739    HB3  PHE  91           HB1      PHE  91  -9.221   3.862   5.618
  740    HD1  PHE  91           HD1      PHE  91  -8.433   1.648   4.515
  741    HD2  PHE  91           HD2      PHE  91  -9.557   5.147   2.296
  742    HE1  PHE  91           HE1      PHE  91  -7.196   0.800   2.552
  743    HE2  PHE  91           HE2      PHE  91  -8.311   4.300   0.326
  744    HZ   PHE  91           HZ       PHE  91  -7.126   2.125   0.453
  745    H    LEU  92           HN       LEU  92 -11.577   1.698   6.915
  746    HA   LEU  92           HA       LEU  92 -13.251   3.723   8.331
  747    HB2  LEU  92           HB2      LEU  92 -12.758   0.788   8.939
  748    HB3  LEU  92           HB1      LEU  92 -13.935   1.828   9.741
  749    HG   LEU  92           HG       LEU  92 -13.936   1.157   6.783
  750   HD11  LEU  92          HD11      LEU  92 -15.947  -0.175   7.336
  751   HD12  LEU  92          HD12      LEU  92 -15.706   0.183   9.046
  752   HD13  LEU  92          HD13      LEU  92 -14.519  -0.781   8.172
  753   HD21  LEU  92          HD21      LEU  92 -15.632   2.922   8.544
  754   HD22  LEU  92          HD22      LEU  92 -16.364   2.131   7.148
  755   HD23  LEU  92          HD23      LEU  92 -15.010   3.235   6.925
  756    H    TYR  93           HN       TYR  93 -10.129   2.254   8.366
  757    HA   TYR  93           HA       TYR  93  -9.394   3.901  10.690
  758    HB2  TYR  93           HB2      TYR  93 -10.181   1.847  11.783
  759    HB3  TYR  93           HB1      TYR  93  -9.096   0.886  10.779
  760    HD1  TYR  93           HD2      TYR  93  -9.200   3.568  13.352
  761    HD2  TYR  93           HD1      TYR  93  -6.788   0.653  11.326
  762    HE1  TYR  93           HE2      TYR  93  -7.357   3.979  14.959
  763    HE2  TYR  93           HE1      TYR  93  -4.943   1.062  12.933
  764    HH   TYR  93           HH       TYR  93  -4.906   1.992  15.488
  765    H    LEU  94           HN       LEU  94  -7.613   4.868   9.992
  766    HA   LEU  94           HA       LEU  94  -5.630   3.287   8.404
  767    HB2  LEU  94           HB2      LEU  94  -6.782   5.126   7.118
  768    HB3  LEU  94           HB1      LEU  94  -6.091   6.279   8.262
  769    HG   LEU  94           HG       LEU  94  -3.814   5.427   7.682
  770   HD11  LEU  94          HD11      LEU  94  -3.882   4.167   5.327
  771   HD12  LEU  94          HD12      LEU  94  -5.448   3.620   5.931
  772   HD13  LEU  94          HD13      LEU  94  -3.979   3.278   6.842
  773   HD21  LEU  94          HD21      LEU  94  -4.969   7.394   6.528
  774   HD22  LEU  94          HD22      LEU  94  -5.290   6.287   5.193
  775   HD23  LEU  94          HD23      LEU  94  -3.628   6.652   5.653
  776    H    HIS  95           HN       HIS  95  -3.812   2.961   9.477
  777    HA   HIS  95           HA       HIS  95  -2.806   5.066  11.338
  778    HB2  HIS  95           HB2      HIS  95  -3.951   3.335  12.681
  779    HB3  HIS  95           HB1      HIS  95  -2.921   2.102  11.954
  780    HD1  HIS  95           HD1      HIS  95  -0.492   4.442  12.080
  781    HD2  HIS  95           HD2      HIS  95  -2.584   2.625  15.188
  782    HE1  HIS  95           HE1      HIS  95   0.970   4.653  14.127
  783    H    ASN  96           HN       ASN  96  -0.892   5.644  10.581
  784    HA   ASN  96           HA       ASN  96   0.772   3.721   9.044
  785    HB2  ASN  96           HB2      ASN  96   0.441   5.988   8.117
  786    HB3  ASN  96           HB1      ASN  96   1.153   6.686   9.572
  787   HD21  ASN  96          HD21      ASN  96   2.486   7.322   7.271
  788   HD22  ASN  96          HD22      ASN  96   3.918   6.423   7.121
  789    H    THR  97           HN       THR  97   2.626   2.915   9.806
  790    HA   THR  97           HA       THR  97   3.207   2.390  12.414
  791    HB   THR  97           HB       THR  97   5.622   2.219  11.718
  792    HG1  THR  97           HG1      THR  97   4.874   2.919   9.135
  793   HG21  THR  97          HG21      THR  97   5.163   0.621   9.815
  794   HG22  THR  97          HG22      THR  97   3.485   1.165   9.848
  795   HG23  THR  97          HG23      THR  97   4.175   0.348  11.251
  796    H    VAL  98           HN       VAL  98   3.746   5.448  10.819
  797    HA   VAL  98           HA       VAL  98   5.524   6.572  12.797
  798    HB   VAL  98           HB       VAL  98   3.601   8.113  11.043
  799   HG11  VAL  98          HG11      VAL  98   5.044   9.240  12.840
  800   HG12  VAL  98          HG12      VAL  98   5.194   9.873  11.201
  801   HG13  VAL  98          HG13      VAL  98   6.433   8.796  11.847
  802   HG21  VAL  98          HG21      VAL  98   5.424   8.065   9.328
  803   HG22  VAL  98          HG22      VAL  98   4.721   6.474   9.621
  804   HG23  VAL  98          HG23      VAL  98   6.283   6.889  10.324
  805    H    MET  99           HN       MET  99   2.010   6.838  12.262
  806    HA   MET  99           HA       MET  99   1.392   6.788  15.005
  807    HB2  MET  99           HB2      MET  99   0.658   9.248  15.220
  808    HB3  MET  99           HB1      MET  99   2.380   8.906  15.364
  809    HG2  MET  99           HG2      MET  99   2.726   9.528  13.020
  810    HG3  MET  99           HG1      MET  99   0.994   9.796  12.820
  811    HE1  MET  99           HE1      MET  99   2.793  13.216  12.638
  812    HE2  MET  99           HE2      MET  99   1.178  12.663  12.201
  813    HE3  MET  99           HE3      MET  99   2.578  11.665  11.814
  814    HA   PRO 100           HA       PRO 100  -2.702   6.118  13.392
  815    HB2  PRO 100           HB2      PRO 100  -3.694   7.989  15.513
  816    HB3  PRO 100           HB1      PRO 100  -4.222   6.337  15.131
  817    HG2  PRO 100           HG2      PRO 100  -2.676   6.848  17.243
  818    HG3  PRO 100           HG1      PRO 100  -2.477   5.371  16.283
  819    HD2  PRO 100           HD2      PRO 100  -0.750   7.805  16.368
  820    HD3  PRO 100           HD1      PRO 100  -0.325   6.109  16.057
  821    H    LEU 101           HN       LEU 101  -3.785   7.026  11.728
  822    HA   LEU 101           HA       LEU 101  -3.605   9.991  11.325
  823    HB2  LEU 101           HB2      LEU 101  -4.246   7.791   9.338
  824    HB3  LEU 101           HB1      LEU 101  -4.023   9.498   8.961
  825    HG   LEU 101           HG       LEU 101  -1.913   7.662  10.140
  826   HD11  LEU 101          HD11      LEU 101  -2.187   7.080   7.845
  827   HD12  LEU 101          HD12      LEU 101  -0.814   8.183   7.881
  828   HD13  LEU 101          HD13      LEU 101  -2.397   8.764   7.363
  829   HD21  LEU 101          HD21      LEU 101  -0.475   9.748   9.419
  830   HD22  LEU 101          HD22      LEU 101  -1.353   9.799  10.944
  831   HD23  LEU 101          HD23      LEU 101  -2.006  10.617   9.525
  832    H    LEU 102           HN       LEU 102  -5.898   7.441  10.332
  833    HA   LEU 102           HA       LEU 102  -8.133   9.285  11.138
  834    HB2  LEU 102           HB2      LEU 102  -8.181   7.058   9.077
  835    HB3  LEU 102           HB1      LEU 102  -9.469   8.215   9.409
  836    HG   LEU 102           HG       LEU 102  -6.701   8.935   8.395
  837   HD11  LEU 102          HD11      LEU 102  -9.392   8.871   6.992
  838   HD12  LEU 102          HD12      LEU 102  -8.034   7.787   6.682
  839   HD13  LEU 102          HD13      LEU 102  -7.901   9.504   6.296
  840   HD21  LEU 102          HD21      LEU 102  -9.144  10.541   9.157
  841   HD22  LEU 102          HD22      LEU 102  -8.014  11.157   7.952
  842   HD23  LEU 102          HD23      LEU 102  -7.458  10.824   9.589
  843    H    ASP 103           HN       ASP 103  -9.404   8.626  12.728
  844    HA   ASP 103           HA       ASP 103  -9.929   5.770  13.190
  845    HB2  ASP 103           HB2      ASP 103  -7.837   6.222  14.470
  846    HB3  ASP 103           HB1      ASP 103  -8.691   7.476  15.370
  847    H    GLN 104           HN       GLN 104 -12.099   6.118  12.893
  848    HA   GLN 104           HA       GLN 104 -13.468   8.136  14.644
  849    HB2  GLN 104           HB2      GLN 104 -14.335   6.803  12.066
  850    HB3  GLN 104           HB1      GLN 104 -15.403   7.794  13.057
  851    HG2  GLN 104           HG2      GLN 104 -13.853   9.701  12.830
  852    HG3  GLN 104           HG1      GLN 104 -12.780   8.713  11.838
  853   HE21  GLN 104          HE21      GLN 104 -13.028   9.505   9.724
  854   HE22  GLN 104          HE22      GLN 104 -14.521   9.768   8.963
  855    H    ARG 105           HN       ARG 105 -14.286   7.263  16.409
  856    HA   ARG 105           HA       ARG 105 -14.672   4.441  16.825
  857    HB2  ARG 105           HB2      ARG 105 -15.592   6.888  18.360
  858    HB3  ARG 105           HB1      ARG 105 -15.879   5.238  18.919
  859    HG2  ARG 105           HG2      ARG 105 -13.455   4.794  18.876
  860    HG3  ARG 105           HG1      ARG 105 -13.159   6.435  18.304
  861    HD2  ARG 105           HD2      ARG 105 -14.553   5.793  20.920
  862    HD3  ARG 105           HD1      ARG 105 -12.829   6.143  20.786
  863    HE   ARG 105           HE       ARG 105 -14.251   8.258  19.524
  864   HH11  ARG 105          HH21      ARG 105 -13.722   6.850  22.644
  865   HH12  ARG 105          HH22      ARG 105 -13.985   8.338  23.492
  866   HH21  ARG 105          HH11      ARG 105 -14.593  10.183  20.624
  867   HH22  ARG 105          HH12      ARG 105 -14.477  10.217  22.351
  868    H    TYR 106           HN       TYR 106 -16.781   7.077  15.838
  869    HA   TYR 106           HA       TYR 106 -19.309   5.846  16.205
  870    HB2  TYR 106           HB2      TYR 106 -18.445   7.700  13.959
  871    HB3  TYR 106           HB1      TYR 106 -20.106   7.404  14.466
  872    HD1  TYR 106           HD1      TYR 106 -20.906   8.190  16.679
  873    HD2  TYR 106           HD2      TYR 106 -16.969   9.132  15.237
  874    HE1  TYR 106           HE1      TYR 106 -20.697   9.965  18.401
  875    HE2  TYR 106           HE2      TYR 106 -16.762  10.906  16.960
  876    HH   TYR 106           HH       TYR 106 -18.805  12.377  18.338
  877    H    LEU 107           HN       LEU 107 -17.163   5.806  13.374
  878    HA   LEU 107           HA       LEU 107 -18.802   4.090  11.756
  879    HB2  LEU 107           HB2      LEU 107 -15.807   4.585  11.730
  880    HB3  LEU 107           HB1      LEU 107 -16.691   3.750  10.454
  881    HG   LEU 107           HG       LEU 107 -17.200   6.599  11.360
  882   HD11  LEU 107          HD11      LEU 107 -15.026   5.986  10.014
  883   HD12  LEU 107          HD12      LEU 107 -16.011   7.351   9.487
  884   HD13  LEU 107          HD13      LEU 107 -16.137   5.803   8.654
  885   HD21  LEU 107          HD21      LEU 107 -18.461   6.455   9.000
  886   HD22  LEU 107          HD22      LEU 107 -19.262   5.967  10.490
  887   HD23  LEU 107          HD23      LEU 107 -18.566   4.744   9.427
  888    H    LEU 108           HN       LEU 108 -16.165   3.428  14.021
  889    HA   LEU 108           HA       LEU 108 -16.283   0.538  13.476
  890    HB2  LEU 108           HB2      LEU 108 -14.766   2.093  15.599
  891    HB3  LEU 108           HB1      LEU 108 -14.522   0.392  15.203
  892    HG   LEU 108           HG       LEU 108 -14.126   2.709  13.283
  893   HD11  LEU 108          HD11      LEU 108 -12.414   2.586  15.083
  894   HD12  LEU 108          HD12      LEU 108 -11.735   2.201  13.500
  895   HD13  LEU 108          HD13      LEU 108 -12.097   0.908  14.643
  896   HD21  LEU 108          HD21      LEU 108 -12.905   0.715  12.036
  897   HD22  LEU 108          HD22      LEU 108 -14.651   0.895  11.893
  898   HD23  LEU 108          HD23      LEU 108 -13.978  -0.292  13.011
  899    H    THR 109           HN       THR 109 -18.199   2.599  15.216
  900    HA   THR 109           HA       THR 109 -18.733   0.640  17.416
  901    HB   THR 109           HB       THR 109 -19.630   3.505  16.977
  902    HG1  THR 109           HG1      THR 109 -17.550   2.299  18.204
  903   HG21  THR 109          HG21      THR 109 -20.533   3.215  19.347
  904   HG22  THR 109          HG22      THR 109 -20.353   1.478  19.100
  905   HG23  THR 109          HG23      THR 109 -21.446   2.405  18.073
  906    H    GLY 110           HN       GLY 110 -19.909   1.751  14.388
  907    HA2  GLY 110           HA2      GLY 110 -21.700   0.936  13.088
  908    HA3  GLY 110           HA1      GLY 110 -22.070  -0.201  14.388
  909    H    GLY 111           HN       GLY 111 -21.789   3.082  15.302
  910    HA2  GLY 111           HA2      GLY 111 -24.456   3.234  16.325
  911    HA3  GLY 111           HA1      GLY 111 -23.356   4.598  16.147
  912    H    GLN 112           HN       GLN 112 -25.480   5.644  15.611
  913    HA   GLN 112           HA       GLN 112 -26.924   5.062  13.226
  914    HB2  GLN 112           HB2      GLN 112 -27.787   6.541  15.006
  915    HB3  GLN 112           HB1      GLN 112 -26.549   7.733  14.615
  916    HG2  GLN 112           HG2      GLN 112 -27.462   8.028  12.382
  917    HG3  GLN 112           HG1      GLN 112 -28.614   6.720  12.641
  918   HE21  GLN 112          HE21      GLN 112 -29.553   9.309  11.964
  919   HE22  GLN 112          HE22      GLN 112 -30.352   9.975  13.304
  920    H    LEU 113           HN       LEU 113 -26.494   5.466  11.150
  921    HA   LEU 113           HA       LEU 113 -23.896   6.431  10.334
  922    HB2  LEU 113           HB2      LEU 113 -24.602   5.964   8.094
  923    HB3  LEU 113           HB1      LEU 113 -25.292   4.701   9.109
  924    HG   LEU 113           HG       LEU 113 -26.782   7.176   8.145
  925   HD11  LEU 113          HD11      LEU 113 -26.188   5.388   6.434
  926   HD12  LEU 113          HD12      LEU 113 -27.902   5.761   6.616
  927   HD13  LEU 113          HD13      LEU 113 -27.233   4.304   7.352
  928   HD21  LEU 113          HD21      LEU 113 -28.753   5.722   8.999
  929   HD22  LEU 113          HD22      LEU 113 -27.772   6.544  10.208
  930   HD23  LEU 113          HD23      LEU 113 -27.527   4.825   9.895
  931    H    GLU 114           HN       GLU 114 -23.362   8.358   9.345
  932    HA   GLU 114           HA       GLU 114 -24.957  10.669  10.073
  933    HB2  GLU 114           HB2      GLU 114 -22.470  10.397   8.364
  934    HB3  GLU 114           HB1      GLU 114 -23.159  11.935   8.883
  935    HG2  GLU 114           HG2      GLU 114 -22.257   9.734  10.764
  936    HG3  GLU 114           HG1      GLU 114 -21.301  11.161  10.366
  937    H    HIS 115           HN       HIS 115 -25.170  12.429   8.291
  938    HA   HIS 115           HA       HIS 115 -26.415  13.163   6.461
  939    HB2  HIS 115           HB2      HIS 115 -25.145  10.704   5.229
  940    HB3  HIS 115           HB1      HIS 115 -26.009  11.945   4.322
  941    HD1  HIS 115           HD1      HIS 115 -22.811  11.304   6.152
  942    HD2  HIS 115           HD2      HIS 115 -24.655  14.463   4.150
  943    HE1  HIS 115           HE1      HIS 115 -21.032  13.077   5.815
  944    H    HIS 116           HN       HIS 116 -27.844  11.911   4.517
  945    HA   HIS 116           HA       HIS 116 -29.593   9.888   5.797
  946    HB2  HIS 116           HB2      HIS 116 -31.618  11.277   5.206
  947    HB3  HIS 116           HB1      HIS 116 -30.650  11.925   6.530
  948    HD1  HIS 116           HD1      HIS 116 -29.227  14.067   6.039
  949    HD2  HIS 116           HD2      HIS 116 -31.621  12.856   2.847
  950    HE1  HIS 116           HE1      HIS 116 -29.259  15.994   4.395
  951    H    HIS 117           HN       HIS 117 -30.830   8.729   4.292
  952    HA   HIS 117           HA       HIS 117 -29.934   9.004   1.450
  953    HB2  HIS 117           HB2      HIS 117 -31.072   6.694   3.048
  954    HB3  HIS 117           HB1      HIS 117 -30.883   6.637   1.297
  955    HD1  HIS 117           HD1      HIS 117 -28.854   6.889   4.481
  956    HD2  HIS 117           HD2      HIS 117 -28.236   6.295   0.401
  957    HE1  HIS 117           HE1      HIS 117 -26.424   6.226   4.213
  958    H    HIS 118           HN       HIS 118 -32.326  10.194   3.215
  959    HA   HIS 118           HA       HIS 118 -34.773   9.363   2.013
  960    HB2  HIS 118           HB2      HIS 118 -33.887  11.996   3.219
  961    HB3  HIS 118           HB1      HIS 118 -35.532  11.734   2.639
  962    HD1  HIS 118           HD1      HIS 118 -36.351   9.107   3.609
  963    HD2  HIS 118           HD2      HIS 118 -33.883  11.529   5.936
  964    HE1  HIS 118           HE1      HIS 118 -36.600   8.299   5.995
  965    H    HIS 119           HN       HIS 119 -32.439  11.857   1.072
  966    HA   HIS 119           HA       HIS 119 -34.009  12.527  -1.342
  967    HB2  HIS 119           HB2      HIS 119 -31.433  13.601  -0.176
  968    HB3  HIS 119           HB1      HIS 119 -32.100  14.154  -1.714
  969    HD1  HIS 119           HD1      HIS 119 -32.856  14.108   1.988
  970    HD2  HIS 119           HD2      HIS 119 -34.346  15.837  -1.500
  971    HE1  HIS 119           HE1      HIS 119 -34.576  15.820   2.715
  972    H    HIS 120           HN       HIS 120 -33.393  12.076  -3.407
  973    HA   HIS 120           HA       HIS 120 -32.444  10.830  -5.137
  974    HB2  HIS 120           HB2      HIS 120 -29.995  11.438  -3.459
  975    HB3  HIS 120           HB1      HIS 120 -29.914  10.671  -5.043
  976    HD1  HIS 120           HD1      HIS 120 -30.980  13.910  -3.389
  977    HD2  HIS 120           HD2      HIS 120 -30.264  12.420  -7.218
  978    HE1  HIS 120           HE1      HIS 120 -31.039  15.900  -4.956
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1  -8.634  -4.681  20.190
    2    H2   MET   1           HT2      MET   1  -7.962  -5.109  21.690
    3    H3   MET   1           HT3      MET   1  -9.585  -4.619  21.591
    4    HA   MET   1           HA       MET   1  -8.584  -7.000  20.156
    5    HB2  MET   1           HB2      MET   1  -9.644  -6.773  22.981
    6    HB3  MET   1           HB1      MET   1  -9.573  -8.291  22.085
    7    HG2  MET   1           HG2      MET   1  -7.154  -8.081  21.843
    8    HG3  MET   1           HG1      MET   1  -7.187  -6.503  22.627
    9    HE1  MET   1           HE1      MET   1  -7.930 -10.107  22.707
   10    HE2  MET   1           HE2      MET   1  -9.290  -9.853  23.798
   11    HE3  MET   1           HE3      MET   1  -7.833 -10.646  24.389
   12    H    THR   2           HN       THR   2 -10.666  -8.590  20.431
   13    HA   THR   2           HA       THR   2 -12.762  -8.966  19.433
   14    HB   THR   2           HB       THR   2 -14.576  -7.483  20.452
   15    HG1  THR   2           HG1      THR   2 -13.483  -6.413  22.402
   16   HG21  THR   2          HG21      THR   2 -14.106  -8.393  22.791
   17   HG22  THR   2          HG22      THR   2 -12.582  -8.998  22.144
   18   HG23  THR   2          HG23      THR   2 -14.111  -9.585  21.491
   19    H    LEU   3           HN       LEU   3 -10.885  -6.775  18.315
   20    HA   LEU   3           HA       LEU   3 -12.495  -4.788  17.038
   21    HB2  LEU   3           HB2      LEU   3 -10.006  -4.669  17.183
   22    HB3  LEU   3           HB1      LEU   3  -9.899  -6.025  16.061
   23    HG   LEU   3           HG       LEU   3 -11.111  -4.683  14.352
   24   HD11  LEU   3          HD11      LEU   3 -12.430  -3.113  15.457
   25   HD12  LEU   3          HD12      LEU   3 -11.079  -2.102  14.955
   26   HD13  LEU   3          HD13      LEU   3 -11.164  -2.700  16.614
   27   HD21  LEU   3          HD21      LEU   3  -8.663  -4.686  14.352
   28   HD22  LEU   3          HD22      LEU   3  -8.640  -3.368  15.525
   29   HD23  LEU   3          HD23      LEU   3  -9.259  -3.090  13.897
   30    H    GLU   4           HN       GLU   4 -11.479  -8.028  16.059
   31    HA   GLU   4           HA       GLU   4 -12.470  -8.026  13.399
   32    HB2  GLU   4           HB2      GLU   4 -12.261 -10.264  15.436
   33    HB3  GLU   4           HB1      GLU   4 -12.626 -10.528  13.731
   34    HG2  GLU   4           HG2      GLU   4 -10.497  -9.490  13.090
   35    HG3  GLU   4           HG1      GLU   4 -10.140  -9.140  14.780
   36    H    LEU   5           HN       LEU   5 -14.080  -8.698  16.472
   37    HA   LEU   5           HA       LEU   5 -16.598  -9.532  15.378
   38    HB2  LEU   5           HB2      LEU   5 -15.717  -8.399  18.026
   39    HB3  LEU   5           HB1      LEU   5 -17.429  -8.677  17.707
   40    HG   LEU   5           HG       LEU   5 -16.252 -10.600  18.844
   41   HD11  LEU   5          HD11      LEU   5 -18.276 -10.725  17.078
   42   HD12  LEU   5          HD12      LEU   5 -17.556 -12.176  17.769
   43   HD13  LEU   5          HD13      LEU   5 -17.084 -11.647  16.157
   44   HD21  LEU   5          HD21      LEU   5 -14.623 -11.892  17.666
   45   HD22  LEU   5          HD22      LEU   5 -14.116 -10.213  17.477
   46   HD23  LEU   5          HD23      LEU   5 -14.937 -11.042  16.154
   47    H    GLN   6           HN       GLN   6 -15.338  -6.364  16.333
   48    HA   GLN   6           HA       GLN   6 -17.784  -4.922  15.848
   49    HB2  GLN   6           HB2      GLN   6 -14.886  -4.039  15.892
   50    HB3  GLN   6           HB1      GLN   6 -16.242  -2.920  15.751
   51    HG2  GLN   6           HG2      GLN   6 -17.144  -3.709  17.889
   52    HG3  GLN   6           HG1      GLN   6 -15.838  -4.887  18.025
   53   HE21  GLN   6          HE21      GLN   6 -14.117  -2.553  16.681
   54   HE22  GLN   6          HE22      GLN   6 -13.691  -1.615  18.029
   55    H    LEU   7           HN       LEU   7 -14.864  -5.418  13.863
   56    HA   LEU   7           HA       LEU   7 -15.848  -3.963  11.599
   57    HB2  LEU   7           HB2      LEU   7 -13.441  -4.567  11.950
   58    HB3  LEU   7           HB1      LEU   7 -13.857  -6.247  11.615
   59    HG   LEU   7           HG       LEU   7 -14.743  -5.530   9.379
   60   HD11  LEU   7          HD11      LEU   7 -13.792  -2.862  10.398
   61   HD12  LEU   7          HD12      LEU   7 -15.259  -3.258   9.501
   62   HD13  LEU   7          HD13      LEU   7 -13.710  -3.203   8.669
   63   HD21  LEU   7          HD21      LEU   7 -11.853  -5.057  10.117
   64   HD22  LEU   7          HD22      LEU   7 -12.411  -4.969   8.444
   65   HD23  LEU   7          HD23      LEU   7 -12.577  -6.472   9.351
   66    H    LYS   8           HN       LYS   8 -15.968  -7.391  12.486
   67    HA   LYS   8           HA       LYS   8 -17.124  -8.391  10.079
   68    HB2  LYS   8           HB2      LYS   8 -16.233  -9.804  11.958
   69    HB3  LYS   8           HB1      LYS   8 -17.649  -9.355  12.907
   70    HG2  LYS   8           HG2      LYS   8 -19.129 -10.349  11.226
   71    HG3  LYS   8           HG1      LYS   8 -17.740 -10.757  10.220
   72    HD2  LYS   8           HD2      LYS   8 -16.862 -12.201  12.034
   73    HD3  LYS   8           HD1      LYS   8 -18.275 -11.813  13.015
   74    HE2  LYS   8           HE2      LYS   8 -19.746 -12.787  11.286
   75    HE3  LYS   8           HE1      LYS   8 -18.334 -13.176  10.306
   76    HZ1  LYS   8           HZ1      LYS   8 -18.556 -14.134  13.088
   77    HZ2  LYS   8           HZ2      LYS   8 -17.612 -14.753  11.818
   78    HZ3  LYS   8           HZ3      LYS   8 -19.295 -14.982  11.817
   79    H    HIS   9           HN       HIS   9 -18.627  -7.193  13.058
   80    HA   HIS   9           HA       HIS   9 -21.335  -7.497  12.098
   81    HB2  HIS   9           HB2      HIS   9 -20.658  -7.362  14.516
   82    HB3  HIS   9           HB1      HIS   9 -20.330  -5.647  14.268
   83    HD1  HIS   9           HD1      HIS   9 -22.331  -4.062  14.097
   84    HD2  HIS   9           HD2      HIS   9 -23.449  -8.073  14.296
   85    HE1  HIS   9           HE1      HIS   9 -24.841  -4.090  14.436
   86    H    TYR  10           HN       TYR  10 -19.040  -4.787  12.184
   87    HA   TYR  10           HA       TYR  10 -20.848  -2.758  11.297
   88    HB2  TYR  10           HB2      TYR  10 -18.644  -2.190  12.198
   89    HB3  TYR  10           HB1      TYR  10 -17.861  -3.021  10.856
   90    HD1  TYR  10           HD1      TYR  10 -20.024  -0.136  11.749
   91    HD2  TYR  10           HD2      TYR  10 -17.607  -1.980   8.715
   92    HE1  TYR  10           HE1      TYR  10 -20.164   1.928  10.381
   93    HE2  TYR  10           HE2      TYR  10 -17.750   0.084   7.346
   94    HH   TYR  10           HH       TYR  10 -18.264   2.328   7.457
   95    H    ILE  11           HN       ILE  11 -18.591  -4.793   9.426
   96    HA   ILE  11           HA       ILE  11 -19.344  -3.759   6.864
   97    HB   ILE  11           HB       ILE  11 -18.159  -6.425   7.683
   98   HG12  ILE  11          HG12      ILE  11 -16.903  -3.985   6.385
   99   HG13  ILE  11          HG11      ILE  11 -16.823  -4.343   8.109
  100   HG21  ILE  11          HG21      ILE  11 -17.473  -6.474   5.200
  101   HG22  ILE  11          HG22      ILE  11 -18.714  -5.247   4.955
  102   HG23  ILE  11          HG23      ILE  11 -19.157  -6.841   5.565
  103   HD11  ILE  11          HD11      ILE  11 -15.753  -6.549   7.532
  104   HD12  ILE  11          HD12      ILE  11 -14.782  -5.148   7.078
  105   HD13  ILE  11          HD13      ILE  11 -15.695  -6.021   5.850
  106    H    THR  12           HN       THR  12 -20.501  -6.599   8.681
  107    HA   THR  12           HA       THR  12 -22.340  -7.472   6.641
  108    HB   THR  12           HB       THR  12 -23.405  -8.740   8.572
  109    HG1  THR  12           HG1      THR  12 -22.662  -8.410  10.536
  110   HG21  THR  12          HG21      THR  12 -21.500 -10.243   8.819
  111   HG22  THR  12          HG22      THR  12 -20.398  -8.969   8.292
  112   HG23  THR  12          HG23      THR  12 -21.569  -9.648   7.159
  113    H    ASN  13           HN       ASN  13 -22.815  -5.546   9.602
  114    HA   ASN  13           HA       ASN  13 -25.642  -5.142   9.179
  115    HB2  ASN  13           HB2      ASN  13 -24.629  -4.830  11.389
  116    HB3  ASN  13           HB1      ASN  13 -23.630  -3.519  10.764
  117   HD21  ASN  13          HD21      ASN  13 -25.112  -2.655  12.812
  118   HD22  ASN  13          HD22      ASN  13 -26.498  -1.811  12.312
  119    H    LEU  14           HN       LEU  14 -22.757  -3.296   8.311
  120    HA   LEU  14           HA       LEU  14 -24.075  -0.969   7.333
  121    HB2  LEU  14           HB2      LEU  14 -21.657  -1.006   7.720
  122    HB3  LEU  14           HB1      LEU  14 -21.456  -2.236   6.475
  123    HG   LEU  14           HG       LEU  14 -22.218  -0.671   4.748
  124   HD11  LEU  14          HD11      LEU  14 -23.817   0.714   5.766
  125   HD12  LEU  14          HD12      LEU  14 -22.447   1.806   5.579
  126   HD13  LEU  14          HD13      LEU  14 -22.779   1.069   7.147
  127   HD21  LEU  14          HD21      LEU  14 -19.801  -0.683   5.596
  128   HD22  LEU  14          HD22      LEU  14 -20.210   0.791   6.475
  129   HD23  LEU  14          HD23      LEU  14 -20.312   0.757   4.715
  130    H    PHE  15           HN       PHE  15 -23.088  -3.945   5.646
  131    HA   PHE  15           HA       PHE  15 -24.566  -3.022   3.214
  132    HB2  PHE  15           HB2      PHE  15 -22.509  -5.184   3.709
  133    HB3  PHE  15           HB1      PHE  15 -23.423  -5.078   2.204
  134    HD1  PHE  15           HD1      PHE  15 -23.146  -3.171   0.692
  135    HD2  PHE  15           HD2      PHE  15 -20.817  -3.538   4.281
  136    HE1  PHE  15           HE1      PHE  15 -21.586  -1.436  -0.145
  137    HE2  PHE  15           HE2      PHE  15 -19.256  -1.801   3.447
  138    HZ   PHE  15           HZ       PHE  15 -19.641  -0.749   1.233
  139    H    ASN  16           HN       ASN  16 -25.132  -4.731   5.986
  140    HA   ASN  16           HA       ASN  16 -26.770  -6.259   6.657
  141    HB2  ASN  16           HB2      ASN  16 -28.085  -5.538   4.018
  142    HB3  ASN  16           HB1      ASN  16 -28.872  -6.244   5.430
  143   HD21  ASN  16          HD21      ASN  16 -27.698  -4.680   7.509
  144   HD22  ASN  16          HD22      ASN  16 -28.188  -3.066   7.317
  145    H    LEU  17           HN       LEU  17 -24.509  -7.336   5.397
  146    HA   LEU  17           HA       LEU  17 -25.505  -9.400   3.548
  147    HB2  LEU  17           HB2      LEU  17 -22.698  -9.013   4.593
  148    HB3  LEU  17           HB1      LEU  17 -23.185 -10.001   3.214
  149    HG   LEU  17           HG       LEU  17 -23.789  -7.046   3.321
  150   HD11  LEU  17          HD11      LEU  17 -21.741  -6.667   2.011
  151   HD12  LEU  17          HD12      LEU  17 -21.314  -8.368   2.182
  152   HD13  LEU  17          HD13      LEU  17 -21.357  -7.322   3.602
  153   HD21  LEU  17          HD21      LEU  17 -25.010  -8.296   1.630
  154   HD22  LEU  17          HD22      LEU  17 -23.529  -9.086   1.090
  155   HD23  LEU  17          HD23      LEU  17 -23.754  -7.357   0.831
  156    HA   PRO  18           HA       PRO  18 -26.108 -12.655   6.526
  157    HB2  PRO  18           HB2      PRO  18 -24.348 -14.301   4.740
  158    HB3  PRO  18           HB1      PRO  18 -25.958 -14.677   5.384
  159    HG2  PRO  18           HG2      PRO  18 -25.623 -13.933   2.849
  160    HG3  PRO  18           HG1      PRO  18 -27.035 -13.413   3.785
  161    HD2  PRO  18           HD2      PRO  18 -24.641 -11.831   2.957
  162    HD3  PRO  18           HD1      PRO  18 -26.320 -11.317   3.227
  163    H    ARG  19           HN       ARG  19 -25.065 -12.789   8.436
  164    HA   ARG  19           HA       ARG  19 -22.097 -12.637   8.552
  165    HB2  ARG  19           HB2      ARG  19 -22.428 -12.171  10.934
  166    HB3  ARG  19           HB1      ARG  19 -23.437 -11.097   9.968
  167    HG2  ARG  19           HG2      ARG  19 -25.377 -12.595  10.338
  168    HG3  ARG  19           HG1      ARG  19 -24.371 -13.648  11.331
  169    HD2  ARG  19           HD2      ARG  19 -23.944 -11.774  12.884
  170    HD3  ARG  19           HD1      ARG  19 -24.969 -10.733  11.898
  171    HE   ARG  19           HE       ARG  19 -26.889 -11.875  12.736
  172   HH11  ARG  19          HH21      ARG  19 -23.920 -13.373  13.689
  173   HH12  ARG  19          HH22      ARG  19 -24.672 -14.389  14.872
  174   HH21  ARG  19          HH11      ARG  19 -27.864 -13.187  14.278
  175   HH22  ARG  19          HH12      ARG  19 -26.898 -14.285  15.205
  176    H    ASP  20           HN       ASP  20 -24.748 -14.824   9.090
  177    HA   ASP  20           HA       ASP  20 -23.178 -16.734  10.663
  178    HB2  ASP  20           HB2      ASP  20 -25.908 -16.882   9.352
  179    HB3  ASP  20           HB1      ASP  20 -25.216 -18.204  10.293
  180    H    GLU  21           HN       GLU  21 -23.084 -15.862   7.498
  181    HA   GLU  21           HA       GLU  21 -23.000 -18.450   6.195
  182    HB2  GLU  21           HB2      GLU  21 -23.483 -16.421   4.927
  183    HB3  GLU  21           HB1      GLU  21 -21.907 -15.756   5.338
  184    HG2  GLU  21           HG2      GLU  21 -21.923 -16.708   3.057
  185    HG3  GLU  21           HG1      GLU  21 -20.805 -17.589   4.097
  186    H    LYS  22           HN       LYS  22 -21.113 -19.498   5.346
  187    HA   LYS  22           HA       LYS  22 -18.917 -19.619   7.221
  188    HB2  LYS  22           HB2      LYS  22 -19.328 -20.833   4.477
  189    HB3  LYS  22           HB1      LYS  22 -17.928 -21.175   5.494
  190    HG2  LYS  22           HG2      LYS  22 -19.387 -22.035   7.264
  191    HG3  LYS  22           HG1      LYS  22 -20.814 -21.613   6.321
  192    HD2  LYS  22           HD2      LYS  22 -20.565 -23.901   5.854
  193    HD3  LYS  22           HD1      LYS  22 -19.759 -23.146   4.480
  194    HE2  LYS  22           HE2      LYS  22 -18.412 -24.999   5.438
  195    HE3  LYS  22           HE1      LYS  22 -17.575 -23.454   5.569
  196    HZ1  LYS  22           HZ1      LYS  22 -17.878 -25.101   7.611
  197    HZ2  LYS  22           HZ2      LYS  22 -19.304 -24.196   7.790
  198    HZ3  LYS  22           HZ3      LYS  22 -17.793 -23.418   7.800
  199    H    TRP  23           HN       TRP  23 -17.048 -18.510   7.196
  200    HA   TRP  23           HA       TRP  23 -16.464 -16.750   4.847
  201    HB2  TRP  23           HB2      TRP  23 -16.617 -16.217   7.644
  202    HB3  TRP  23           HB1      TRP  23 -14.912 -16.078   7.221
  203    HD1  TRP  23           HD1      TRP  23 -14.751 -14.750   4.599
  204    HE1  TRP  23           HE1      TRP  23 -15.751 -12.430   4.089
  205    HE3  TRP  23           HE3      TRP  23 -18.230 -14.474   8.313
  206    HZ2  TRP  23           HZ2      TRP  23 -17.773 -10.686   5.134
  207    HZ3  TRP  23           HZ3      TRP  23 -19.679 -12.475   8.530
  208    HH2  TRP  23           HH2      TRP  23 -19.450 -10.591   6.943
  209    H    GLU  24           HN       GLU  24 -14.541 -16.849   3.842
  210    HA   GLU  24           HA       GLU  24 -12.618 -18.964   4.745
  211    HB2  GLU  24           HB2      GLU  24 -13.719 -19.337   2.537
  212    HB3  GLU  24           HB1      GLU  24 -13.031 -17.814   1.974
  213    HG2  GLU  24           HG2      GLU  24 -11.592 -19.632   1.245
  214    HG3  GLU  24           HG1      GLU  24 -10.748 -18.718   2.494
  215    H    CYS  25           HN       CYS  25 -10.795 -18.162   5.559
  216    HA   CYS  25           HA       CYS  25 -10.035 -15.344   5.034
  217    HB2  CYS  25           HB2      CYS  25  -8.610 -15.530   6.933
  218    HB3  CYS  25           HB1      CYS  25 -10.082 -16.401   7.363
  219    HG   CYS  25           HG       CYS  25  -7.316 -17.656   6.989
  220    H    GLU  26           HN       GLU  26  -8.233 -14.755   3.911
  221    HA   GLU  26           HA       GLU  26  -6.350 -16.890   2.991
  222    HB2  GLU  26           HB2      GLU  26  -8.082 -16.351   1.217
  223    HB3  GLU  26           HB1      GLU  26  -7.429 -14.711   1.185
  224    HG2  GLU  26           HG2      GLU  26  -5.207 -15.594   0.632
  225    HG3  GLU  26           HG1      GLU  26  -5.831 -17.239   0.694
  226    H    SER  27           HN       SER  27  -4.463 -16.271   3.849
  227    HA   SER  27           HA       SER  27  -3.821 -13.372   4.119
  228    HB2  SER  27           HB2      SER  27  -2.543 -15.809   5.359
  229    HB3  SER  27           HB1      SER  27  -2.038 -14.146   5.647
  230    HG   SER  27           HG       SER  27  -4.645 -15.184   6.110
  231    H    ILE  28           HN       ILE  28  -2.400 -12.464   2.811
  232    HA   ILE  28           HA       ILE  28  -0.240 -14.065   1.570
  233    HB   ILE  28           HB       ILE  28  -0.749 -13.381  -0.681
  234   HG12  ILE  28          HG12      ILE  28  -1.617 -11.134  -0.284
  235   HG13  ILE  28          HG11      ILE  28  -2.808 -12.053  -1.194
  236   HG21  ILE  28          HG21      ILE  28  -2.835 -14.552  -1.064
  237   HG22  ILE  28          HG22      ILE  28  -3.334 -14.276   0.602
  238   HG23  ILE  28          HG23      ILE  28  -1.979 -15.351   0.259
  239   HD11  ILE  28          HD11      ILE  28  -2.877 -11.210   1.695
  240   HD12  ILE  28          HD12      ILE  28  -3.815 -12.606   1.160
  241   HD13  ILE  28          HD13      ILE  28  -4.112 -11.018   0.452
  242    H    GLU  29           HN       GLU  29   1.391 -12.634   0.570
  243    HA   GLU  29           HA       GLU  29   1.537 -10.022   2.017
  244    HB2  GLU  29           HB2      GLU  29   3.650 -11.797   0.784
  245    HB3  GLU  29           HB1      GLU  29   3.987 -10.185   1.421
  246    HG2  GLU  29           HG2      GLU  29   3.149 -10.841   3.620
  247    HG3  GLU  29           HG1      GLU  29   2.710 -12.434   3.006
  248    H    GLU  30           HN       GLU  30   1.356  -8.188   0.924
  249    HA   GLU  30           HA       GLU  30   2.042  -8.092  -1.975
  250    HB2  GLU  30           HB2      GLU  30  -0.623  -7.320  -0.772
  251    HB3  GLU  30           HB1      GLU  30  -0.088  -6.765  -2.359
  252    HG2  GLU  30           HG2      GLU  30   0.140  -9.082  -3.122
  253    HG3  GLU  30           HG1      GLU  30  -0.315  -9.671  -1.525
  254    H    VAL  31           HN       VAL  31   2.472  -5.958  -2.714
  255    HA   VAL  31           HA       VAL  31   3.685  -4.245  -0.709
  256    HB   VAL  31           HB       VAL  31   3.236  -3.884  -3.684
  257   HG11  VAL  31          HG11      VAL  31   3.506  -1.695  -2.730
  258   HG12  VAL  31          HG12      VAL  31   5.070  -2.150  -3.406
  259   HG13  VAL  31          HG13      VAL  31   4.797  -2.253  -1.666
  260   HG21  VAL  31          HG21      VAL  31   5.631  -4.471  -3.813
  261   HG22  VAL  31          HG22      VAL  31   4.715  -5.764  -3.039
  262   HG23  VAL  31          HG23      VAL  31   5.682  -4.660  -2.061
  263    H    ALA  32           HN       ALA  32   2.849  -2.451   0.234
  264    HA   ALA  32           HA       ALA  32   0.045  -1.918   0.190
  265    HB1  ALA  32           HB1      ALA  32   2.449  -0.375   1.154
  266    HB2  ALA  32           HB2      ALA  32   1.220  -1.194   2.114
  267    HB3  ALA  32           HB3      ALA  32   0.830   0.310   1.279
  268    H    ASP  33           HN       ASP  33   2.744  -0.230  -1.403
  269    HA   ASP  33           HA       ASP  33   1.363   1.928  -2.548
  270    HB2  ASP  33           HB2      ASP  33   3.865   1.373  -2.673
  271    HB3  ASP  33           HB1      ASP  33   3.460   0.327  -4.030
  272    H    ASP  34           HN       ASP  34   0.850  -1.384  -3.125
  273    HA   ASP  34           HA       ASP  34  -0.283  -0.940  -5.844
  274    HB2  ASP  34           HB2      ASP  34   1.133  -2.946  -5.423
  275    HB3  ASP  34           HB1      ASP  34  -0.040  -3.485  -4.221
  276    H    ILE  35           HN       ILE  35  -1.272  -1.824  -2.560
  277    HA   ILE  35           HA       ILE  35  -4.138  -1.802  -3.434
  278    HB   ILE  35           HB       ILE  35  -4.535  -2.847  -1.175
  279   HG12  ILE  35          HG12      ILE  35  -1.506  -3.090  -1.164
  280   HG13  ILE  35          HG11      ILE  35  -2.416  -1.970  -0.147
  281   HG21  ILE  35          HG21      ILE  35  -2.593  -4.264  -3.024
  282   HG22  ILE  35          HG22      ILE  35  -4.343  -4.195  -3.227
  283   HG23  ILE  35          HG23      ILE  35  -3.648  -5.050  -1.851
  284   HD11  ILE  35          HD11      ILE  35  -3.717  -4.007   0.690
  285   HD12  ILE  35          HD12      ILE  35  -2.035  -3.899   1.209
  286   HD13  ILE  35          HD13      ILE  35  -2.486  -4.994  -0.098
  287    H    LEU  36           HN       LEU  36  -1.858   0.237  -2.177
  288    HA   LEU  36           HA       LEU  36  -3.955   1.877  -0.802
  289    HB2  LEU  36           HB2      LEU  36  -1.125   1.314   0.061
  290    HB3  LEU  36           HB1      LEU  36  -2.027   2.707   0.652
  291    HG   LEU  36           HG       LEU  36  -3.337  -0.001   0.782
  292   HD11  LEU  36          HD11      LEU  36  -2.333  -0.120   3.163
  293   HD12  LEU  36          HD12      LEU  36  -1.104   0.987   2.552
  294   HD13  LEU  36          HD13      LEU  36  -1.308  -0.601   1.813
  295   HD21  LEU  36          HD21      LEU  36  -3.367   2.313   2.744
  296   HD22  LEU  36          HD22      LEU  36  -4.523   0.990   2.622
  297   HD23  LEU  36          HD23      LEU  36  -4.468   2.228   1.371
  298    HA   PRO  37           HA       PRO  37  -2.320   4.244  -4.401
  299    HB2  PRO  37           HB2      PRO  37  -4.675   5.910  -3.601
  300    HB3  PRO  37           HB1      PRO  37  -4.193   5.338  -5.211
  301    HG2  PRO  37           HG2      PRO  37  -6.230   4.227  -3.880
  302    HG3  PRO  37           HG1      PRO  37  -5.149   3.262  -4.903
  303    HD2  PRO  37           HD2      PRO  37  -5.264   3.427  -1.918
  304    HD3  PRO  37           HD1      PRO  37  -4.826   2.052  -2.958
  305    H    ASP  38           HN       ASP  38  -1.398   6.350  -4.554
  306    HA   ASP  38           HA       ASP  38   0.037   7.301  -2.343
  307    HB2  ASP  38           HB2      ASP  38  -0.909   8.711  -4.849
  308    HB3  ASP  38           HB1      ASP  38   0.190   9.465  -3.693
  309    H    GLN  39           HN       GLN  39  -3.281   7.508  -2.872
  310    HA   GLN  39           HA       GLN  39  -3.985  10.040  -1.793
  311    HB2  GLN  39           HB2      GLN  39  -5.413   7.371  -1.605
  312    HB3  GLN  39           HB1      GLN  39  -6.151   8.926  -1.227
  313    HG2  GLN  39           HG2      GLN  39  -4.937   8.212  -3.913
  314    HG3  GLN  39           HG1      GLN  39  -6.662   8.144  -3.549
  315   HE21  GLN  39          HE21      GLN  39  -4.586  10.076  -5.134
  316   HE22  GLN  39          HE22      GLN  39  -5.244  11.601  -4.788
  317    H    TYR  40           HN       TYR  40  -2.997   7.047  -0.227
  318    HA   TYR  40           HA       TYR  40  -2.907   8.518   2.373
  319    HB2  TYR  40           HB2      TYR  40  -4.137   5.780   1.926
  320    HB3  TYR  40           HB1      TYR  40  -3.802   6.478   3.510
  321    HD1  TYR  40           HD2      TYR  40  -4.943   8.619   4.196
  322    HD2  TYR  40           HD1      TYR  40  -6.053   6.457   0.651
  323    HE1  TYR  40           HE2      TYR  40  -7.091   9.854   4.115
  324    HE2  TYR  40           HE1      TYR  40  -8.203   7.694   0.572
  325    HH   TYR  40           HH       TYR  40  -9.397   9.469   3.159
  326    H    VAL  41           HN       VAL  41  -0.727   8.006   0.656
  327    HA   VAL  41           HA       VAL  41   0.888   6.222   2.403
  328    HB   VAL  41           HB       VAL  41   0.797   5.948  -0.615
  329   HG11  VAL  41          HG11      VAL  41   3.040   5.575   0.076
  330   HG12  VAL  41          HG12      VAL  41   2.324   3.968  -0.050
  331   HG13  VAL  41          HG13      VAL  41   2.532   4.721   1.532
  332   HG21  VAL  41          HG21      VAL  41  -0.208   4.243   1.668
  333   HG22  VAL  41          HG22      VAL  41   0.102   3.572   0.067
  334   HG23  VAL  41          HG23      VAL  41  -1.108   4.836   0.274
  335    H    ARG  42           HN       ARG  42   1.068   8.211  -0.564
  336    HA   ARG  42           HA       ARG  42   2.719   9.735  -1.266
  337    HB2  ARG  42           HB2      ARG  42   2.612  10.355   1.702
  338    HB3  ARG  42           HB1      ARG  42   3.402  11.371   0.496
  339    HG2  ARG  42           HG2      ARG  42   1.279  11.643  -0.697
  340    HG3  ARG  42           HG1      ARG  42   0.474  10.602   0.477
  341    HD2  ARG  42           HD2      ARG  42   1.909  13.171   1.212
  342    HD3  ARG  42           HD1      ARG  42   0.171  13.060   0.930
  343    HE   ARG  42           HE       ARG  42   0.838  11.082   2.843
  344   HH11  ARG  42          HH21      ARG  42   0.845  14.516   2.465
  345   HH12  ARG  42          HH22      ARG  42   0.580  14.826   4.148
  346   HH21  ARG  42          HH11      ARG  42   0.495  11.477   5.028
  347   HH22  ARG  42          HH12      ARG  42   0.381  13.109   5.596
  348    H    LEU  43           HN       LEU  43   4.663  10.344   1.272
  349    HA   LEU  43           HA       LEU  43   6.739   8.428   0.320
  350    HB2  LEU  43           HB2      LEU  43   8.172  10.125   1.803
  351    HB3  LEU  43           HB1      LEU  43   7.677  10.560   0.169
  352    HG   LEU  43           HG       LEU  43   5.741  11.789   1.045
  353   HD11  LEU  43          HD11      LEU  43   6.738  10.694   3.679
  354   HD12  LEU  43          HD12      LEU  43   5.112  10.607   3.003
  355   HD13  LEU  43          HD13      LEU  43   5.733  12.141   3.610
  356   HD21  LEU  43          HD21      LEU  43   7.049  13.517   2.409
  357   HD22  LEU  43          HD22      LEU  43   7.714  13.121   0.824
  358   HD23  LEU  43          HD23      LEU  43   8.430  12.426   2.278
  359    H    GLY  44           HN       GLY  44   4.470   8.579   2.677
  360    HA2  GLY  44           HA2      GLY  44   5.664   8.152   5.153
  361    HA3  GLY  44           HA1      GLY  44   4.207   7.303   4.643
  362    HA   PRO  45           HA       PRO  45   7.913   4.377   5.115
  363    HB2  PRO  45           HB2      PRO  45   6.995   2.982   7.302
  364    HB3  PRO  45           HB1      PRO  45   8.007   4.434   7.431
  365    HG2  PRO  45           HG2      PRO  45   5.046   4.162   7.727
  366    HG3  PRO  45           HG1      PRO  45   6.186   5.132   8.675
  367    HD2  PRO  45           HD2      PRO  45   4.612   6.210   6.713
  368    HD3  PRO  45           HD1      PRO  45   6.216   6.861   7.119
  369    H    LEU  46           HN       LEU  46   4.494   4.171   4.818
  370    HA   LEU  46           HA       LEU  46   4.447   1.269   4.304
  371    HB2  LEU  46           HB2      LEU  46   2.266   3.321   3.829
  372    HB3  LEU  46           HB1      LEU  46   2.066   1.573   3.954
  373    HG   LEU  46           HG       LEU  46   3.049   3.395   6.173
  374   HD11  LEU  46          HD11      LEU  46   0.918   3.090   7.198
  375   HD12  LEU  46          HD12      LEU  46   0.468   1.822   6.057
  376   HD13  LEU  46          HD13      LEU  46   0.576   3.498   5.516
  377   HD21  LEU  46          HD21      LEU  46   2.719   0.404   5.919
  378   HD22  LEU  46          HD22      LEU  46   2.564   1.183   7.494
  379   HD23  LEU  46          HD23      LEU  46   4.071   1.317   6.591
  380    H    SER  47           HN       SER  47   5.763   3.638   2.640
  381    HA   SER  47           HA       SER  47   4.668   3.835   0.087
  382    HB2  SER  47           HB2      SER  47   6.972   4.121  -0.741
  383    HB3  SER  47           HB1      SER  47   6.740   4.984   0.779
  384    HG   SER  47           HG       SER  47   7.479   2.680   1.569
  385    H    ASN  48           HN       ASN  48   7.539   1.955  -0.121
  386    HA   ASN  48           HA       ASN  48   6.083  -0.121  -1.662
  387    HB2  ASN  48           HB2      ASN  48   9.033   0.502  -1.325
  388    HB3  ASN  48           HB1      ASN  48   8.413  -0.821  -2.313
  389   HD21  ASN  48          HD21      ASN  48   6.035   0.720  -3.249
  390   HD22  ASN  48          HD22      ASN  48   6.627   1.872  -4.343
  391    H    LYS  49           HN       LYS  49   6.243   0.151   1.399
  392    HA   LYS  49           HA       LYS  49   7.796  -2.100   2.343
  393    HB2  LYS  49           HB2      LYS  49   7.096  -0.210   3.796
  394    HB3  LYS  49           HB1      LYS  49   5.424  -0.747   3.649
  395    HG2  LYS  49           HG2      LYS  49   5.990  -2.895   4.675
  396    HG3  LYS  49           HG1      LYS  49   7.688  -2.430   4.761
  397    HD2  LYS  49           HD2      LYS  49   7.089  -0.542   6.245
  398    HD3  LYS  49           HD1      LYS  49   5.396  -1.032   6.172
  399    HE2  LYS  49           HE2      LYS  49   5.959  -3.202   7.175
  400    HE3  LYS  49           HE1      LYS  49   7.664  -2.754   7.216
  401    HZ1  LYS  49           HZ1      LYS  49   5.434  -1.728   8.828
  402    HZ2  LYS  49           HZ2      LYS  49   6.758  -0.711   8.512
  403    HZ3  LYS  49           HZ3      LYS  49   6.991  -2.189   9.316
  404    H    ILE  50           HN       ILE  50   7.193  -4.205   2.666
  405    HA   ILE  50           HA       ILE  50   4.745  -5.121   1.300
  406    HB   ILE  50           HB       ILE  50   7.031  -6.610   2.623
  407   HG12  ILE  50          HG12      ILE  50   7.429  -7.278   0.200
  408   HG13  ILE  50          HG11      ILE  50   6.219  -6.080  -0.249
  409   HG21  ILE  50          HG21      ILE  50   4.512  -7.583   1.270
  410   HG22  ILE  50          HG22      ILE  50   5.151  -8.042   2.847
  411   HG23  ILE  50          HG23      ILE  50   5.960  -8.585   1.377
  412   HD11  ILE  50          HD11      ILE  50   8.498  -5.225   1.517
  413   HD12  ILE  50          HD12      ILE  50   7.565  -4.288   0.351
  414   HD13  ILE  50          HD13      ILE  50   8.780  -5.428  -0.212
  415    H    LEU  51           HN       LEU  51   2.902  -5.321   2.381
  416    HA   LEU  51           HA       LEU  51   2.969  -5.756   5.350
  417    HB2  LEU  51           HB2      LEU  51   0.783  -4.551   3.636
  418    HB3  LEU  51           HB1      LEU  51   0.764  -4.693   5.393
  419    HG   LEU  51           HG       LEU  51   2.771  -3.094   3.768
  420   HD11  LEU  51          HD11      LEU  51   0.350  -2.238   3.996
  421   HD12  LEU  51          HD12      LEU  51   1.634  -1.144   4.515
  422   HD13  LEU  51          HD13      LEU  51   0.707  -2.048   5.711
  423   HD21  LEU  51          HD21      LEU  51   3.975  -3.705   5.682
  424   HD22  LEU  51          HD22      LEU  51   2.533  -3.773   6.697
  425   HD23  LEU  51          HD23      LEU  51   3.211  -2.214   6.228
  426    H    GLN  52           HN       GLN  52   1.752  -7.364   6.230
  427    HA   GLN  52           HA       GLN  52   1.046  -9.596   4.495
  428    HB2  GLN  52           HB2      GLN  52   0.731  -9.122   7.475
  429    HB3  GLN  52           HB1      GLN  52   0.322 -10.643   6.677
  430    HG2  GLN  52           HG2      GLN  52   2.623 -10.887   5.888
  431    HG3  GLN  52           HG1      GLN  52   3.053  -9.325   6.581
  432   HE21  GLN  52          HE21      GLN  52   4.649 -11.109   7.645
  433   HE22  GLN  52          HE22      GLN  52   4.132 -11.689   9.153
  434    H    THR  53           HN       THR  53  -0.710  -9.073   3.221
  435    HA   THR  53           HA       THR  53  -3.066  -7.745   4.351
  436    HB   THR  53           HB       THR  53  -2.458  -8.924   1.628
  437    HG1  THR  53           HG1      THR  53  -2.899  -6.271   2.514
  438   HG21  THR  53          HG21      THR  53  -4.602  -7.667   0.987
  439   HG22  THR  53          HG22      THR  53  -4.975  -7.655   2.711
  440   HG23  THR  53          HG23      THR  53  -4.813  -9.188   1.855
  441    H    ASN  54           HN       ASN  54  -5.173  -8.716   4.402
  442    HA   ASN  54           HA       ASN  54  -5.311 -11.675   4.269
  443    HB2  ASN  54           HB2      ASN  54  -4.748 -11.066   6.616
  444    HB3  ASN  54           HB1      ASN  54  -6.200 -10.066   6.676
  445   HD21  ASN  54          HD21      ASN  54  -7.381 -11.340   8.191
  446   HD22  ASN  54          HD22      ASN  54  -7.883 -12.929   7.869
  447    H    THR  55           HN       THR  55  -6.627 -11.455   2.475
  448    HA   THR  55           HA       THR  55  -9.063  -9.794   2.634
  449    HB   THR  55           HB       THR  55  -8.080 -11.615   0.428
  450    HG1  THR  55           HG1      THR  55  -6.950  -9.514   1.247
  451   HG21  THR  55          HG21      THR  55  -9.620 -10.239  -0.966
  452   HG22  THR  55          HG22      THR  55 -10.182  -9.432   0.499
  453   HG23  THR  55          HG23      THR  55 -10.474 -11.157   0.274
  454    H    TYR  56           HN       TYR  56 -11.105 -10.579   2.866
  455    HA   TYR  56           HA       TYR  56 -11.377 -13.499   3.478
  456    HB2  TYR  56           HB2      TYR  56 -13.048 -11.099   4.268
  457    HB3  TYR  56           HB1      TYR  56 -13.498 -12.769   4.611
  458    HD1  TYR  56           HD1      TYR  56 -11.085 -10.077   5.350
  459    HD2  TYR  56           HD2      TYR  56 -12.300 -14.098   6.244
  460    HE1  TYR  56           HE1      TYR  56  -9.622 -10.074   7.352
  461    HE2  TYR  56           HE2      TYR  56 -10.837 -14.096   8.246
  462    HH   TYR  56           HH       TYR  56  -9.759 -12.589   9.731
  463    H    TYR  57           HN       TYR  57 -12.686 -14.727   2.232
  464    HA   TYR  57           HA       TYR  57 -14.300 -13.364   0.095
  465    HB2  TYR  57           HB2      TYR  57 -12.737 -15.955   0.005
  466    HB3  TYR  57           HB1      TYR  57 -13.849 -15.427  -1.260
  467    HD1  TYR  57           HD2      TYR  57 -13.418 -13.288  -2.489
  468    HD2  TYR  57           HD1      TYR  57 -10.552 -14.982   0.225
  469    HE1  TYR  57           HE2      TYR  57 -11.648 -11.853  -3.466
  470    HE2  TYR  57           HE1      TYR  57  -8.781 -13.545  -0.752
  471    HH   TYR  57           HH       TYR  57  -9.535 -11.169  -3.293
  472    H    SER  58           HN       SER  58 -16.391 -13.790   0.132
  473    HA   SER  58           HA       SER  58 -17.386 -16.324   1.357
  474    HB2  SER  58           HB2      SER  58 -18.661 -13.631   1.862
  475    HB3  SER  58           HB1      SER  58 -19.085 -15.172   2.599
  476    HG   SER  58           HG       SER  58 -16.445 -14.289   2.812
  477    H    ASP  59           HN       ASP  59 -19.620 -16.789   0.677
  478    HA   ASP  59           HA       ASP  59 -20.000 -16.531  -2.145
  479    HB2  ASP  59           HB2      ASP  59 -21.853 -17.296   0.122
  480    HB3  ASP  59           HB1      ASP  59 -22.356 -17.352  -1.567
  481    H    THR  60           HN       THR  60 -21.507 -14.843   0.587
  482    HA   THR  60           HA       THR  60 -23.264 -13.208  -1.013
  483    HB   THR  60           HB       THR  60 -23.957 -13.252   1.209
  484    HG1  THR  60           HG1      THR  60 -23.996 -11.150   1.112
  485   HG21  THR  60          HG21      THR  60 -22.187 -14.435   2.245
  486   HG22  THR  60          HG22      THR  60 -22.237 -12.893   3.099
  487   HG23  THR  60          HG23      THR  60 -21.011 -13.176   1.864
  488    H    LEU  61           HN       LEU  61 -19.967 -12.801   0.179
  489    HA   LEU  61           HA       LEU  61 -19.659 -10.029  -0.449
  490    HB2  LEU  61           HB2      LEU  61 -17.724 -12.335  -0.229
  491    HB3  LEU  61           HB1      LEU  61 -17.163 -10.719  -0.651
  492    HG   LEU  61           HG       LEU  61 -18.826 -11.318   1.812
  493   HD11  LEU  61          HD11      LEU  61 -15.819 -10.949   1.647
  494   HD12  LEU  61          HD12      LEU  61 -16.612 -12.512   1.822
  495   HD13  LEU  61          HD13      LEU  61 -16.763 -11.300   3.094
  496   HD21  LEU  61          HD21      LEU  61 -17.407  -8.890   0.722
  497   HD22  LEU  61          HD22      LEU  61 -17.553  -9.084   2.468
  498   HD23  LEU  61          HD23      LEU  61 -19.000  -9.007   1.470
  499    H    HIS  62           HN       HIS  62 -19.110 -12.944  -2.377
  500    HA   HIS  62           HA       HIS  62 -18.026 -11.624  -4.675
  501    HB2  HIS  62           HB2      HIS  62 -19.488 -14.240  -4.287
  502    HB3  HIS  62           HB1      HIS  62 -18.879 -13.734  -5.860
  503    HD1  HIS  62           HD1      HIS  62 -17.878 -15.779  -3.173
  504    HD2  HIS  62           HD2      HIS  62 -15.908 -12.853  -5.394
  505    HE1  HIS  62           HE1      HIS  62 -15.397 -16.199  -2.872
  506    H    LYS  63           HN       LYS  63 -21.328 -12.484  -3.734
  507    HA   LYS  63           HA       LYS  63 -22.637 -11.636  -6.139
  508    HB2  LYS  63           HB2      LYS  63 -23.696 -13.008  -4.337
  509    HB3  LYS  63           HB1      LYS  63 -23.696 -11.584  -3.299
  510    HG2  LYS  63           HG2      LYS  63 -25.136 -10.393  -4.868
  511    HG3  LYS  63           HG1      LYS  63 -25.086 -11.756  -5.986
  512    HD2  LYS  63           HD2      LYS  63 -26.145 -13.192  -4.262
  513    HD3  LYS  63           HD1      LYS  63 -26.226 -11.806  -3.174
  514    HE2  LYS  63           HE2      LYS  63 -27.569 -11.994  -5.888
  515    HE3  LYS  63           HE1      LYS  63 -28.379 -12.139  -4.330
  516    HZ1  LYS  63           HZ1      LYS  63 -27.764  -9.810  -5.744
  517    HZ2  LYS  63           HZ2      LYS  63 -26.841  -9.799  -4.317
  518    HZ3  LYS  63           HZ3      LYS  63 -28.532  -9.949  -4.238
  519    H    SER  64           HN       SER  64 -21.906  -9.928  -3.112
  520    HA   SER  64           HA       SER  64 -23.026  -7.401  -4.077
  521    HB2  SER  64           HB2      SER  64 -21.341  -8.087  -1.651
  522    HB3  SER  64           HB1      SER  64 -22.046  -6.501  -1.951
  523    HG   SER  64           HG       SER  64 -24.057  -7.362  -1.744
  524    H    ASN  65           HN       ASN  65 -20.198  -9.069  -4.689
  525    HA   ASN  65           HA       ASN  65 -18.173  -8.474  -5.702
  526    HB2  ASN  65           HB2      ASN  65 -19.505  -5.800  -6.243
  527    HB3  ASN  65           HB1      ASN  65 -18.132  -6.496  -7.097
  528   HD21  ASN  65          HD21      ASN  65 -19.473  -9.263  -6.941
  529   HD22  ASN  65          HD22      ASN  65 -20.655  -9.213  -8.157
  530    H    ILE  66           HN       ILE  66 -18.463  -8.069  -2.885
  531    HA   ILE  66           HA       ILE  66 -16.785  -5.625  -2.428
  532    HB   ILE  66           HB       ILE  66 -18.485  -7.206  -0.483
  533   HG12  ILE  66          HG12      ILE  66 -18.821  -4.373  -1.504
  534   HG13  ILE  66          HG11      ILE  66 -19.660  -5.756  -2.206
  535   HG21  ILE  66          HG21      ILE  66 -17.944  -5.117   0.952
  536   HG22  ILE  66          HG22      ILE  66 -16.622  -4.843  -0.182
  537   HG23  ILE  66          HG23      ILE  66 -16.674  -6.325   0.770
  538   HD11  ILE  66          HD11      ILE  66 -20.702  -6.251  -0.044
  539   HD12  ILE  66          HD12      ILE  66 -21.054  -4.589  -0.516
  540   HD13  ILE  66          HD13      ILE  66 -19.823  -4.918   0.704
  541    H    TYR  67           HN       TYR  67 -14.735  -5.908  -1.811
  542    HA   TYR  67           HA       TYR  67 -13.856  -8.625  -0.881
  543    HB2  TYR  67           HB2      TYR  67 -12.278  -6.646  -2.536
  544    HB3  TYR  67           HB1      TYR  67 -11.738  -8.239  -2.005
  545    HD1  TYR  67           HD2      TYR  67 -13.218 -10.277  -2.674
  546    HD2  TYR  67           HD1      TYR  67 -13.425  -6.435  -4.584
  547    HE1  TYR  67           HE2      TYR  67 -14.284 -11.320  -4.657
  548    HE2  TYR  67           HE1      TYR  67 -14.490  -7.479  -6.565
  549    HH   TYR  67           HH       TYR  67 -15.963  -9.763  -6.871
  550    HA   PRO  68           HA       PRO  68 -12.632  -5.617   2.377
  551    HB2  PRO  68           HB2      PRO  68 -13.373  -7.094   4.530
  552    HB3  PRO  68           HB1      PRO  68 -14.543  -6.158   3.576
  553    HG2  PRO  68           HG2      PRO  68 -14.027  -9.085   3.586
  554    HG3  PRO  68           HG1      PRO  68 -15.543  -8.207   3.330
  555    HD2  PRO  68           HD2      PRO  68 -13.911  -9.300   1.303
  556    HD3  PRO  68           HD1      PRO  68 -15.217  -8.125   1.055
  557    H    PHE  69           HN       PHE  69 -10.686  -5.561   3.519
  558    HA   PHE  69           HA       PHE  69  -9.314  -8.079   4.167
  559    HB2  PHE  69           HB2      PHE  69  -7.313  -7.605   2.871
  560    HB3  PHE  69           HB1      PHE  69  -8.700  -7.659   1.788
  561    HD1  PHE  69           HD1      PHE  69  -6.261  -5.448   3.469
  562    HD2  PHE  69           HD2      PHE  69  -9.513  -5.666   0.668
  563    HE1  PHE  69           HE1      PHE  69  -5.724  -3.163   2.666
  564    HE2  PHE  69           HE2      PHE  69  -8.977  -3.379  -0.128
  565    HZ   PHE  69           HZ       PHE  69  -7.081  -2.129   0.868
  566    H    ILE  70           HN       ILE  70  -7.452  -7.761   5.507
  567    HA   ILE  70           HA       ILE  70  -7.279  -5.048   6.779
  568    HB   ILE  70           HB       ILE  70  -7.215  -7.759   8.139
  569   HG12  ILE  70          HG12      ILE  70  -9.145  -5.442   8.475
  570   HG13  ILE  70          HG11      ILE  70  -9.468  -6.831   7.440
  571   HG21  ILE  70          HG21      ILE  70  -5.651  -6.317   9.254
  572   HG22  ILE  70          HG22      ILE  70  -7.129  -6.278  10.214
  573   HG23  ILE  70          HG23      ILE  70  -6.743  -4.938   9.136
  574   HD11  ILE  70          HD11      ILE  70  -9.580  -8.321   9.260
  575   HD12  ILE  70          HD12      ILE  70 -10.372  -6.876   9.883
  576   HD13  ILE  70          HD13      ILE  70  -8.707  -7.228  10.334
  577    H    LEU  71           HN       LEU  71  -5.219  -4.390   7.350
  578    HA   LEU  71           HA       LEU  71  -2.984  -6.033   6.233
  579    HB2  LEU  71           HB2      LEU  71  -3.008  -3.109   7.020
  580    HB3  LEU  71           HB1      LEU  71  -1.745  -3.949   6.121
  581    HG   LEU  71           HG       LEU  71  -4.606  -3.538   5.199
  582   HD11  LEU  71          HD11      LEU  71  -2.042  -2.393   4.064
  583   HD12  LEU  71          HD12      LEU  71  -3.077  -1.519   5.193
  584   HD13  LEU  71          HD13      LEU  71  -3.694  -1.981   3.606
  585   HD21  LEU  71          HD21      LEU  71  -2.258  -5.065   4.068
  586   HD22  LEU  71          HD22      LEU  71  -3.475  -4.381   2.992
  587   HD23  LEU  71          HD23      LEU  71  -3.945  -5.566   4.202
  588    H    TYR  72           HN       TYR  72  -1.553  -6.922   7.558
  589    HA   TYR  72           HA       TYR  72  -1.371  -5.961  10.398
  590    HB2  TYR  72           HB2      TYR  72  -1.303  -8.798   9.337
  591    HB3  TYR  72           HB1      TYR  72  -0.875  -8.351  10.987
  592    HD1  TYR  72           HD2      TYR  72  -2.620  -6.996  12.336
  593    HD2  TYR  72           HD1      TYR  72  -3.559  -9.221   8.784
  594    HE1  TYR  72           HE2      TYR  72  -5.011  -7.029  12.990
  595    HE2  TYR  72           HE1      TYR  72  -5.950  -9.253   9.437
  596    HH   TYR  72           HH       TYR  72  -7.011  -8.250  12.575
  597    H    TYR  73           HN       TYR  73   0.693  -6.050  11.314
  598    HA   TYR  73           HA       TYR  73   2.962  -6.786   9.514
  599    HB2  TYR  73           HB2      TYR  73   2.655  -4.353   9.313
  600    HB3  TYR  73           HB1      TYR  73   2.731  -4.195  11.070
  601    HD1  TYR  73           HD1      TYR  73   4.658  -5.535   8.157
  602    HD2  TYR  73           HD2      TYR  73   4.814  -3.907  12.129
  603    HE1  TYR  73           HE1      TYR  73   7.134  -5.493   8.041
  604    HE2  TYR  73           HE2      TYR  73   7.291  -3.862  12.012
  605    HH   TYR  73           HH       TYR  73   9.017  -3.848   9.513
  606    H    GLN  74           HN       GLN  74   3.992  -8.323  10.593
  607    HA   GLN  74           HA       GLN  74   4.988  -9.546  12.319
  608    HB2  GLN  74           HB2      GLN  74   5.215  -6.768  13.519
  609    HB3  GLN  74           HB1      GLN  74   6.012  -8.200  14.164
  610    HG2  GLN  74           HG2      GLN  74   7.210  -8.517  12.046
  611    HG3  GLN  74           HG1      GLN  74   6.385  -7.120  11.355
  612   HE21  GLN  74          HE21      GLN  74   8.950  -6.625  11.213
  613   HE22  GLN  74          HE22      GLN  74   9.552  -5.698  12.501
  614    H    LYS  75           HN       LYS  75   3.395  -7.040  14.266
  615    HA   LYS  75           HA       LYS  75   1.244  -8.810  15.084
  616    HB2  LYS  75           HB2      LYS  75   3.332  -9.576  16.393
  617    HB3  LYS  75           HB1      LYS  75   3.204  -8.040  17.251
  618    HG2  LYS  75           HG2      LYS  75   0.965  -8.590  18.019
  619    HG3  LYS  75           HG1      LYS  75   0.939 -10.047  17.030
  620    HD2  LYS  75           HD2      LYS  75   1.479 -10.883  19.156
  621    HD3  LYS  75           HD1      LYS  75   3.059 -10.736  18.390
  622    HE2  LYS  75           HE2      LYS  75   3.068  -9.816  20.690
  623    HE3  LYS  75           HE1      LYS  75   3.405  -8.564  19.497
  624    HZ1  LYS  75           HZ1      LYS  75   1.634  -8.192  21.356
  625    HZ2  LYS  75           HZ2      LYS  75   0.625  -9.045  20.289
  626    HZ3  LYS  75           HZ3      LYS  75   1.372  -7.603  19.787
  627    H    GLN  76           HN       GLN  76   0.700  -6.571  13.986
  628    HA   GLN  76           HA       GLN  76  -0.519  -4.947  16.007
  629    HB2  GLN  76           HB2      GLN  76   1.989  -4.229  16.013
  630    HB3  GLN  76           HB1      GLN  76   1.608  -3.441  14.484
  631    HG2  GLN  76           HG2      GLN  76   0.008  -2.973  17.015
  632    HG3  GLN  76           HG1      GLN  76   1.381  -1.973  16.547
  633   HE21  GLN  76          HE21      GLN  76   1.196  -1.090  14.166
  634   HE22  GLN  76          HE22      GLN  76  -0.349  -0.574  13.685
  635    H    LEU  77           HN       LEU  77  -2.237  -3.947  15.118
  636    HA   LEU  77           HA       LEU  77  -2.912  -4.350  12.364
  637    HB2  LEU  77           HB2      LEU  77  -4.654  -4.142  14.048
  638    HB3  LEU  77           HB1      LEU  77  -4.109  -2.519  14.464
  639    HG   LEU  77           HG       LEU  77  -4.733  -1.702  12.235
  640   HD11  LEU  77          HD11      LEU  77  -4.352  -3.492  10.756
  641   HD12  LEU  77          HD12      LEU  77  -6.111  -3.409  10.812
  642   HD13  LEU  77          HD13      LEU  77  -5.256  -4.634  11.748
  643   HD21  LEU  77          HD21      LEU  77  -7.135  -1.890  12.443
  644   HD22  LEU  77          HD22      LEU  77  -6.453  -1.853  14.069
  645   HD23  LEU  77          HD23      LEU  77  -6.984  -3.382  13.369
  646    H    ILE  78           HN       ILE  78  -2.574  -3.088  10.611
  647    HA   ILE  78           HA       ILE  78  -1.128  -0.496  10.989
  648    HB   ILE  78           HB       ILE  78  -1.442  -2.259   8.547
  649   HG12  ILE  78          HG12      ILE  78  -0.039  -3.311  10.252
  650   HG13  ILE  78          HG11      ILE  78   0.969  -2.753   8.920
  651   HG21  ILE  78          HG21      ILE  78  -1.148  -0.001   7.824
  652   HG22  ILE  78          HG22      ILE  78   0.433  -0.772   7.691
  653   HG23  ILE  78          HG23      ILE  78   0.085   0.300   9.047
  654   HD11  ILE  78          HD11      ILE  78   2.193  -1.954  10.726
  655   HD12  ILE  78          HD12      ILE  78   0.759  -1.696  11.716
  656   HD13  ILE  78          HD13      ILE  78   1.158  -0.558  10.433
  657    H    ALA  79           HN       ALA  79  -3.691  -1.938   8.938
  658    HA   ALA  79           HA       ALA  79  -5.376   0.398   9.279
  659    HB1  ALA  79           HB1      ALA  79  -4.274   0.038   6.493
  660    HB2  ALA  79           HB2      ALA  79  -3.560   1.164   7.646
  661    HB3  ALA  79           HB3      ALA  79  -5.233   1.373   7.123
  662    H    ILE  80           HN       ILE  80  -7.363   0.237   7.922
  663    HA   ILE  80           HA       ILE  80  -7.899  -2.569   6.988
  664    HB   ILE  80           HB       ILE  80  -9.791  -0.751   8.513
  665   HG12  ILE  80          HG12      ILE  80  -8.463  -3.349   9.353
  666   HG13  ILE  80          HG11      ILE  80  -7.927  -1.748   9.862
  667   HG21  ILE  80          HG21      ILE  80 -10.981  -2.151   6.926
  668   HG22  ILE  80          HG22      ILE  80 -11.193  -2.850   8.531
  669   HG23  ILE  80          HG23      ILE  80 -10.040  -3.562   7.402
  670   HD11  ILE  80          HD11      ILE  80 -10.268  -1.353  10.745
  671   HD12  ILE  80          HD12      ILE  80  -9.349  -2.587  11.608
  672   HD13  ILE  80          HD13      ILE  80 -10.590  -3.061  10.448
  673    H    GLY  81           HN       GLY  81  -8.661  -2.643   4.957
  674    HA2  GLY  81           HA2      GLY  81 -10.160  -0.306   3.859
  675    HA3  GLY  81           HA1      GLY  81  -8.730  -0.867   2.993
  676    H    PHE  82           HN       PHE  82 -11.702  -0.891   2.370
  677    HA   PHE  82           HA       PHE  82 -11.767  -3.715   1.405
  678    HB2  PHE  82           HB2      PHE  82 -14.146  -3.916   1.977
  679    HB3  PHE  82           HB1      PHE  82 -13.208  -3.597   3.433
  680    HD1  PHE  82           HD1      PHE  82 -15.406  -2.052   0.864
  681    HD2  PHE  82           HD2      PHE  82 -13.545  -1.594   4.710
  682    HE1  PHE  82           HE1      PHE  82 -16.812  -0.056   1.307
  683    HE2  PHE  82           HE2      PHE  82 -14.951   0.406   5.145
  684    HZ   PHE  82           HZ       PHE  82 -16.581   1.174   3.446
  685    H    ILE  83           HN       ILE  83 -12.875  -3.953  -0.579
  686    HA   ILE  83           HA       ILE  83 -13.258  -1.383  -2.052
  687    HB   ILE  83           HB       ILE  83 -12.982  -4.210  -3.111
  688   HG12  ILE  83          HG12      ILE  83 -10.983  -1.924  -3.097
  689   HG13  ILE  83          HG11      ILE  83 -10.946  -3.269  -1.958
  690   HG21  ILE  83          HG21      ILE  83 -14.203  -2.845  -4.673
  691   HG22  ILE  83          HG22      ILE  83 -12.542  -2.915  -5.259
  692   HG23  ILE  83          HG23      ILE  83 -13.120  -1.479  -4.413
  693   HD11  ILE  83          HD11      ILE  83 -10.760  -4.850  -3.873
  694   HD12  ILE  83          HD12      ILE  83  -9.410  -3.716  -3.811
  695   HD13  ILE  83          HD13      ILE  83 -10.712  -3.474  -4.976
  696    H    ASP  84           HN       ASP  84 -15.233  -0.736  -2.561
  697    HA   ASP  84           HA       ASP  84 -17.550  -2.446  -1.937
  698    HB2  ASP  84           HB2      ASP  84 -18.861  -0.401  -2.387
  699    HB3  ASP  84           HB1      ASP  84 -17.564  -0.092  -1.233
  700    H    GLU  85           HN       GLU  85 -19.445  -1.984  -3.636
  701    HA   GLU  85           HA       GLU  85 -18.778  -3.454  -5.996
  702    HB2  GLU  85           HB2      GLU  85 -21.063  -3.346  -5.005
  703    HB3  GLU  85           HB1      GLU  85 -21.172  -1.657  -5.501
  704    HG2  GLU  85           HG2      GLU  85 -20.912  -2.306  -7.853
  705    HG3  GLU  85           HG1      GLU  85 -20.740  -3.994  -7.381
  706    H    ASN  86           HN       ASN  86 -19.088   0.007  -5.357
  707    HA   ASN  86           HA       ASN  86 -18.759   0.746  -8.168
  708    HB2  ASN  86           HB2      ASN  86 -18.738   3.044  -7.339
  709    HB3  ASN  86           HB1      ASN  86 -20.023   2.149  -6.530
  710   HD21  ASN  86          HD21      ASN  86 -20.078   2.967  -4.418
  711   HD22  ASN  86          HD22      ASN  86 -18.718   3.143  -3.419
  712    H    HIS  87           HN       HIS  87 -16.679  -0.899  -6.711
  713    HA   HIS  87           HA       HIS  87 -14.347  -0.963  -6.407
  714    HB2  HIS  87           HB2      HIS  87 -13.107  -0.236  -8.422
  715    HB3  HIS  87           HB1      HIS  87 -14.547  -1.164  -8.834
  716    HD1  HIS  87           HD1      HIS  87 -16.663   0.251  -9.639
  717    HD2  HIS  87           HD2      HIS  87 -13.078   2.368  -9.429
  718    HE1  HIS  87           HE1      HIS  87 -17.013   2.384 -10.958
  719    H    ASP  88           HN       ASP  88 -14.324   0.390  -4.513
  720    HA   ASP  88           HA       ASP  88 -12.730   2.836  -4.931
  721    HB2  ASP  88           HB2      ASP  88 -15.070   3.637  -4.992
  722    HB3  ASP  88           HB1      ASP  88 -15.354   2.910  -3.410
  723    H    MET  89           HN       MET  89 -11.025   2.224  -3.708
  724    HA   MET  89           HA       MET  89 -11.104   0.501  -1.437
  725    HB2  MET  89           HB2      MET  89  -9.080   2.587  -2.299
  726    HB3  MET  89           HB1      MET  89  -8.808   1.461  -0.969
  727    HG2  MET  89           HG2      MET  89  -9.151  -0.440  -2.514
  728    HG3  MET  89           HG1      MET  89  -9.403   0.689  -3.844
  729    HE1  MET  89           HE1      MET  89  -5.980  -0.793  -4.731
  730    HE2  MET  89           HE2      MET  89  -7.414  -0.054  -5.441
  731    HE3  MET  89           HE3      MET  89  -7.588  -1.411  -4.329
  732    H    ASP  90           HN       ASP  90 -12.582   1.125   0.107
  733    HA   ASP  90           HA       ASP  90 -12.447   3.882   1.221
  734    HB2  ASP  90           HB2      ASP  90 -14.403   1.600   1.540
  735    HB3  ASP  90           HB1      ASP  90 -14.478   3.057   2.531
  736    H    PHE  91           HN       PHE  91 -11.132   4.207   2.892
  737    HA   PHE  91           HA       PHE  91 -10.443   1.925   4.702
  738    HB2  PHE  91           HB2      PHE  91  -9.092   4.618   4.344
  739    HB3  PHE  91           HB1      PHE  91  -8.522   3.306   5.376
  740    HD1  PHE  91           HD2      PHE  91  -7.838   1.121   4.347
  741    HD2  PHE  91           HD1      PHE  91  -8.706   4.595   1.981
  742    HE1  PHE  91           HE2      PHE  91  -6.673   0.094   2.421
  743    HE2  PHE  91           HE1      PHE  91  -7.538   3.566   0.047
  744    HZ   PHE  91           HZ       PHE  91  -6.522   1.314   0.267
  745    H    LEU  92           HN       LEU  92 -11.673   1.881   6.461
  746    HA   LEU  92           HA       LEU  92 -12.878   4.367   7.554
  747    HB2  LEU  92           HB2      LEU  92 -13.869   2.416   9.155
  748    HB3  LEU  92           HB1      LEU  92 -14.579   2.784   7.586
  749    HG   LEU  92           HG       LEU  92 -13.201   1.009   6.550
  750   HD11  LEU  92          HD11      LEU  92 -12.109  -0.601   8.262
  751   HD12  LEU  92          HD12      LEU  92 -12.181   0.761   9.381
  752   HD13  LEU  92          HD13      LEU  92 -11.260   0.893   7.884
  753   HD21  LEU  92          HD21      LEU  92 -14.388  -0.884   7.526
  754   HD22  LEU  92          HD22      LEU  92 -15.461   0.513   7.457
  755   HD23  LEU  92          HD23      LEU  92 -14.720   0.047   8.986
  756    H    TYR  93           HN       TYR  93 -10.134   2.461   7.960
  757    HA   TYR  93           HA       TYR  93  -9.541   3.805  10.523
  758    HB2  TYR  93           HB2      TYR  93 -10.577   1.638  11.177
  759    HB3  TYR  93           HB1      TYR  93  -9.362   0.790  10.219
  760    HD1  TYR  93           HD1      TYR  93  -9.874   3.017  13.143
  761    HD2  TYR  93           HD2      TYR  93  -7.123   0.485  11.030
  762    HE1  TYR  93           HE1      TYR  93  -8.298   3.136  15.053
  763    HE2  TYR  93           HE2      TYR  93  -5.547   0.602  12.942
  764    HH   TYR  93           HH       TYR  93  -5.478   1.104  15.237
  765    H    LEU  94           HN       LEU  94  -7.599   4.690  10.174
  766    HA   LEU  94           HA       LEU  94  -5.566   3.126   8.632
  767    HB2  LEU  94           HB2      LEU  94  -6.374   4.925   7.188
  768    HB3  LEU  94           HB1      LEU  94  -6.121   6.102   8.473
  769    HG   LEU  94           HG       LEU  94  -3.713   5.728   8.412
  770   HD11  LEU  94          HD11      LEU  94  -2.910   4.230   6.403
  771   HD12  LEU  94          HD12      LEU  94  -4.504   3.492   6.552
  772   HD13  LEU  94          HD13      LEU  94  -3.387   3.464   7.917
  773   HD21  LEU  94          HD21      LEU  94  -3.244   6.648   6.226
  774   HD22  LEU  94          HD22      LEU  94  -4.788   7.302   6.771
  775   HD23  LEU  94          HD23      LEU  94  -4.752   6.001   5.581
  776    H    HIS  95           HN       HIS  95  -3.879   2.697   9.889
  777    HA   HIS  95           HA       HIS  95  -3.077   4.685  11.979
  778    HB2  HIS  95           HB2      HIS  95  -4.155   2.813  13.091
  779    HB3  HIS  95           HB1      HIS  95  -3.131   1.671  12.218
  780    HD1  HIS  95           HD1      HIS  95  -1.031   4.448  12.924
  781    HD2  HIS  95           HD2      HIS  95  -2.469   1.281  15.221
  782    HE1  HIS  95           HE1      HIS  95   0.514   4.263  14.923
  783    H    ASN  96           HN       ASN  96  -1.148   5.455  11.505
  784    HA   ASN  96           HA       ASN  96   0.753   3.857   9.863
  785    HB2  ASN  96           HB2      ASN  96   0.619   6.784  10.632
  786    HB3  ASN  96           HB1      ASN  96   1.999   6.080   9.791
  787   HD21  ASN  96          HD21      ASN  96   0.361   8.100   8.562
  788   HD22  ASN  96          HD22      ASN  96  -0.457   7.394   7.254
  789    H    THR  97           HN       THR  97   2.647   3.117  10.714
  790    HA   THR  97           HA       THR  97   3.028   2.589  13.413
  791    HB   THR  97           HB       THR  97   5.485   2.405  12.860
  792    HG1  THR  97           HG1      THR  97   6.145   2.979  10.849
  793   HG21  THR  97          HG21      THR  97   3.534   1.234  10.858
  794   HG22  THR  97          HG22      THR  97   3.949   0.543  12.427
  795   HG23  THR  97          HG23      THR  97   5.167   0.636  11.154
  796    H    VAL  98           HN       VAL  98   3.298   5.622  11.869
  797    HA   VAL  98           HA       VAL  98   4.910   6.778  14.094
  798    HB   VAL  98           HB       VAL  98   3.936   7.993  11.500
  799   HG11  VAL  98          HG11      VAL  98   5.665   9.042  13.747
  800   HG12  VAL  98          HG12      VAL  98   4.208   9.769  13.070
  801   HG13  VAL  98          HG13      VAL  98   5.699   9.739  12.128
  802   HG21  VAL  98          HG21      VAL  98   6.454   7.913  11.018
  803   HG22  VAL  98          HG22      VAL  98   5.603   6.369  10.982
  804   HG23  VAL  98          HG23      VAL  98   6.570   6.809  12.388
  805    H    MET  99           HN       MET  99   2.249   8.249  12.248
  806    HA   MET  99           HA       MET  99   0.743   8.564  14.810
  807    HB2  MET  99           HB2      MET  99   0.251  10.902  14.227
  808    HB3  MET  99           HB1      MET  99   1.963  10.617  14.519
  809    HG2  MET  99           HG2      MET  99   2.064  10.237  11.917
  810    HG3  MET  99           HG1      MET  99   0.555  11.152  11.923
  811    HE1  MET  99           HE1      MET  99   3.669  11.726  10.761
  812    HE2  MET  99           HE2      MET  99   3.573  13.484  10.800
  813    HE3  MET  99           HE3      MET  99   2.184  12.545  10.257
  814    HA   PRO 100           HA       PRO 100  -2.398   6.898  11.951
  815    HB2  PRO 100           HB2      PRO 100  -4.226   7.798  14.140
  816    HB3  PRO 100           HB1      PRO 100  -4.107   6.211  13.363
  817    HG2  PRO 100           HG2      PRO 100  -3.157   6.701  15.845
  818    HG3  PRO 100           HG1      PRO 100  -2.433   5.506  14.756
  819    HD2  PRO 100           HD2      PRO 100  -1.401   8.169  15.568
  820    HD3  PRO 100           HD1      PRO 100  -0.522   6.737  14.988
  821    H    LEU 101           HN       LEU 101  -3.641   7.929  10.415
  822    HA   LEU 101           HA       LEU 101  -3.925  10.885  10.646
  823    HB2  LEU 101           HB2      LEU 101  -4.478   9.080   8.275
  824    HB3  LEU 101           HB1      LEU 101  -4.343  10.838   8.253
  825    HG   LEU 101           HG       LEU 101  -2.120   8.899   8.962
  826   HD11  LEU 101          HD11      LEU 101  -1.107   9.843   6.850
  827   HD12  LEU 101          HD12      LEU 101  -2.658  10.616   6.523
  828   HD13  LEU 101          HD13      LEU 101  -2.545   8.857   6.584
  829   HD21  LEU 101          HD21      LEU 101  -1.638  10.833  10.208
  830   HD22  LEU 101          HD22      LEU 101  -2.350  11.908   9.005
  831   HD23  LEU 101          HD23      LEU 101  -0.789  11.146   8.697
  832    H    LEU 102           HN       LEU 102  -5.939   8.217   9.373
  833    HA   LEU 102           HA       LEU 102  -8.355   9.783   9.984
  834    HB2  LEU 102           HB2      LEU 102  -8.044   8.351   7.901
  835    HB3  LEU 102           HB1      LEU 102  -8.206   6.952   8.951
  836    HG   LEU 102           HG       LEU 102 -10.363   8.976   9.314
  837   HD11  LEU 102          HD11      LEU 102 -10.120   9.176   6.915
  838   HD12  LEU 102          HD12      LEU 102 -11.575   8.247   7.276
  839   HD13  LEU 102          HD13      LEU 102 -10.112   7.423   6.728
  840   HD21  LEU 102          HD21      LEU 102 -10.355   6.752  10.404
  841   HD22  LEU 102          HD22      LEU 102 -10.380   5.977   8.821
  842   HD23  LEU 102          HD23      LEU 102 -11.757   6.947   9.351
  843    H    ASP 103           HN       ASP 103  -7.741   6.333  10.559
  844    HA   ASP 103           HA       ASP 103  -8.620   4.989  12.296
  845    HB2  ASP 103           HB2      ASP 103  -7.418   5.394  14.375
  846    HB3  ASP 103           HB1      ASP 103  -6.347   5.670  13.004
  847    H    GLN 104           HN       GLN 104 -10.858   5.800  11.898
  848    HA   GLN 104           HA       GLN 104 -11.848   7.597  14.083
  849    HB2  GLN 104           HB2      GLN 104 -12.993   6.867  11.378
  850    HB3  GLN 104           HB1      GLN 104 -13.915   7.732  12.609
  851    HG2  GLN 104           HG2      GLN 104 -12.220   9.513  12.659
  852    HG3  GLN 104           HG1      GLN 104 -11.255   8.646  11.465
  853   HE21  GLN 104          HE21      GLN 104 -13.566  11.082  11.772
  854   HE22  GLN 104          HE22      GLN 104 -14.162  11.074  10.183
  855    H    ARG 105           HN       ARG 105 -12.593   6.499  15.757
  856    HA   ARG 105           HA       ARG 105 -13.402   3.720  15.659
  857    HB2  ARG 105           HB2      ARG 105 -12.453   4.790  17.701
  858    HB3  ARG 105           HB1      ARG 105 -13.894   5.800  17.816
  859    HG2  ARG 105           HG2      ARG 105 -15.306   3.836  18.099
  860    HG3  ARG 105           HG1      ARG 105 -13.927   2.769  17.844
  861    HD2  ARG 105           HD2      ARG 105 -14.085   4.791  20.098
  862    HD3  ARG 105           HD1      ARG 105 -14.535   3.094  20.271
  863    HE   ARG 105           HE       ARG 105 -11.937   3.119  19.183
  864   HH11  ARG 105          HH21      ARG 105 -13.595   4.170  22.027
  865   HH12  ARG 105          HH22      ARG 105 -12.207   3.998  23.048
  866   HH21  ARG 105          HH11      ARG 105 -10.134   2.893  20.504
  867   HH22  ARG 105          HH12      ARG 105 -10.252   3.276  22.188
  868    H    TYR 106           HN       TYR 106 -15.128   6.816  15.707
  869    HA   TYR 106           HA       TYR 106 -17.761   5.856  16.108
  870    HB2  TYR 106           HB2      TYR 106 -16.955   8.101  14.229
  871    HB3  TYR 106           HB1      TYR 106 -18.516   7.903  15.022
  872    HD1  TYR 106           HD1      TYR 106 -18.707   8.163  17.500
  873    HD2  TYR 106           HD2      TYR 106 -15.067   9.035  15.390
  874    HE1  TYR 106           HE1      TYR 106 -17.868   9.422  19.466
  875    HE2  TYR 106           HE2      TYR 106 -14.229  10.293  17.357
  876    HH   TYR 106           HH       TYR 106 -16.211  10.627  20.306
  877    H    LEU 107           HN       LEU 107 -15.912   6.242  13.102
  878    HA   LEU 107           HA       LEU 107 -17.964   5.324  11.344
  879    HB2  LEU 107           HB2      LEU 107 -15.543   6.418  10.932
  880    HB3  LEU 107           HB1      LEU 107 -15.081   4.733  10.736
  881    HG   LEU 107           HG       LEU 107 -15.662   5.609   8.560
  882   HD11  LEU 107          HD11      LEU 107 -16.499   3.283   9.345
  883   HD12  LEU 107          HD12      LEU 107 -17.203   3.958   7.874
  884   HD13  LEU 107          HD13      LEU 107 -18.096   4.033   9.393
  885   HD21  LEU 107          HD21      LEU 107 -17.350   7.340   9.847
  886   HD22  LEU 107          HD22      LEU 107 -18.518   6.172   9.232
  887   HD23  LEU 107          HD23      LEU 107 -17.436   7.006   8.119
  888    H    LEU 108           HN       LEU 108 -15.369   3.623  13.048
  889    HA   LEU 108           HA       LEU 108 -15.848   1.064  11.890
  890    HB2  LEU 108           HB2      LEU 108 -13.917   2.018  13.497
  891    HB3  LEU 108           HB1      LEU 108 -14.911   1.252  14.733
  892    HG   LEU 108           HG       LEU 108 -13.250  -0.345  13.960
  893   HD11  LEU 108          HD11      LEU 108 -15.739  -0.999  14.367
  894   HD12  LEU 108          HD12      LEU 108 -14.687  -2.169  13.567
  895   HD13  LEU 108          HD13      LEU 108 -15.809  -1.197  12.614
  896   HD21  LEU 108          HD21      LEU 108 -13.433   0.927  11.507
  897   HD22  LEU 108          HD22      LEU 108 -14.300  -0.574  11.190
  898   HD23  LEU 108          HD23      LEU 108 -12.635  -0.623  11.768
  899    H    THR 109           HN       THR 109 -17.151   2.561  14.828
  900    HA   THR 109           HA       THR 109 -18.936   0.212  15.228
  901    HB   THR 109           HB       THR 109 -19.458   1.239  17.391
  902    HG1  THR 109           HG1      THR 109 -19.271   3.417  16.563
  903   HG21  THR 109          HG21      THR 109 -17.355  -0.113  17.093
  904   HG22  THR 109          HG22      THR 109 -17.276   1.052  18.413
  905   HG23  THR 109          HG23      THR 109 -16.476   1.402  16.881
  906    H    GLY 110           HN       GLY 110 -18.948   2.848  13.372
  907    HA2  GLY 110           HA2      GLY 110 -20.796   3.587  12.059
  908    HA3  GLY 110           HA1      GLY 110 -21.903   2.925  13.258
  909    H    GLY 111           HN       GLY 111 -22.101   5.502  12.092
  910    HA2  GLY 111           HA2      GLY 111 -21.106   7.501  13.977
  911    HA3  GLY 111           HA1      GLY 111 -22.209   7.797  12.632
  912    H    GLN 112           HN       GLN 112 -21.976   7.443  15.984
  913    HA   GLN 112           HA       GLN 112 -24.881   6.896  16.337
  914    HB2  GLN 112           HB2      GLN 112 -24.310   6.763  18.748
  915    HB3  GLN 112           HB1      GLN 112 -23.314   5.669  17.790
  916    HG2  GLN 112           HG2      GLN 112 -21.489   7.340  17.782
  917    HG3  GLN 112           HG1      GLN 112 -22.484   8.420  18.758
  918   HE21  GLN 112          HE21      GLN 112 -20.432   8.053  20.239
  919   HE22  GLN 112          HE22      GLN 112 -20.536   6.762  21.334
  920    H    LEU 113           HN       LEU 113 -23.151   9.468  15.526
  921    HA   LEU 113           HA       LEU 113 -23.444  11.783  15.720
  922    HB2  LEU 113           HB2      LEU 113 -26.109  11.017  16.968
  923    HB3  LEU 113           HB1      LEU 113 -25.694  12.564  16.234
  924    HG   LEU 113           HG       LEU 113 -25.714   9.901  14.778
  925   HD11  LEU 113          HD11      LEU 113 -27.685  12.191  14.887
  926   HD12  LEU 113          HD12      LEU 113 -27.984  10.483  15.207
  927   HD13  LEU 113          HD13      LEU 113 -27.663  11.028  13.561
  928   HD21  LEU 113          HD21      LEU 113 -24.167  11.213  13.599
  929   HD22  LEU 113          HD22      LEU 113 -24.992  12.722  13.988
  930   HD23  LEU 113          HD23      LEU 113 -25.672  11.629  12.781
  931    H    GLU 114           HN       GLU 114 -21.840  10.775  17.622
  932    HA   GLU 114           HA       GLU 114 -22.678  11.383  20.327
  933    HB2  GLU 114           HB2      GLU 114 -20.845   9.767  19.710
  934    HB3  GLU 114           HB1      GLU 114 -19.848  11.152  19.269
  935    HG2  GLU 114           HG2      GLU 114 -19.284  10.548  21.535
  936    HG3  GLU 114           HG1      GLU 114 -20.217  12.043  21.610
  937    H    HIS 115           HN       HIS 115 -22.412  13.226  21.495
  938    HA   HIS 115           HA       HIS 115 -21.393  15.638  20.042
  939    HB2  HIS 115           HB2      HIS 115 -23.746  15.727  20.807
  940    HB3  HIS 115           HB1      HIS 115 -23.206  15.453  22.465
  941    HD1  HIS 115           HD1      HIS 115 -22.629  17.508  23.774
  942    HD2  HIS 115           HD2      HIS 115 -22.510  18.207  19.666
  943    HE1  HIS 115           HE1      HIS 115 -22.152  19.978  23.481
  944    H    HIS 116           HN       HIS 116 -19.272  15.798  20.540
  945    HA   HIS 116           HA       HIS 116 -18.530  15.941  23.438
  946    HB2  HIS 116           HB2      HIS 116 -17.758  13.784  22.443
  947    HB3  HIS 116           HB1      HIS 116 -16.833  14.703  21.253
  948    HD1  HIS 116           HD1      HIS 116 -14.892  16.255  22.222
  949    HD2  HIS 116           HD2      HIS 116 -16.556  13.592  24.964
  950    HE1  HIS 116           HE1      HIS 116 -13.294  16.158  24.185
  951    H    HIS 117           HN       HIS 117 -17.904  17.977  23.802
  952    HA   HIS 117           HA       HIS 117 -15.921  19.239  22.044
  953    HB2  HIS 117           HB2      HIS 117 -18.229  19.791  21.080
  954    HB3  HIS 117           HB1      HIS 117 -18.503  20.727  22.550
  955    HD1  HIS 117           HD1      HIS 117 -15.499  20.422  20.205
  956    HD2  HIS 117           HD2      HIS 117 -17.885  23.352  21.965
  957    HE1  HIS 117           HE1      HIS 117 -14.554  22.653  19.469
  958    H    HIS 118           HN       HIS 118 -14.666  20.663  23.163
  959    HA   HIS 118           HA       HIS 118 -13.659  21.508  25.112
  960    HB2  HIS 118           HB2      HIS 118 -14.913  23.286  26.121
  961    HB3  HIS 118           HB1      HIS 118 -15.407  23.231  24.432
  962    HD1  HIS 118           HD1      HIS 118 -16.574  21.429  27.596
  963    HD2  HIS 118           HD2      HIS 118 -18.147  23.424  24.293
  964    HE1  HIS 118           HE1      HIS 118 -19.091  21.380  27.863
  965    H    HIS 119           HN       HIS 119 -15.238  18.871  25.254
  966    HA   HIS 119           HA       HIS 119 -15.973  18.780  28.116
  967    HB2  HIS 119           HB2      HIS 119 -17.314  17.627  26.317
  968    HB3  HIS 119           HB1      HIS 119 -15.953  16.527  26.094
  969    HD1  HIS 119           HD1      HIS 119 -15.433  14.856  28.019
  970    HD2  HIS 119           HD2      HIS 119 -18.772  17.250  28.726
  971    HE1  HIS 119           HE1      HIS 119 -16.631  13.844  30.008
  972    H    HIS 120           HN       HIS 120 -14.582  18.168  29.646
  973    HA   HIS 120           HA       HIS 120 -12.668  16.045  29.352
  974    HB2  HIS 120           HB2      HIS 120 -11.414  17.703  28.050
  975    HB3  HIS 120           HB1      HIS 120 -11.563  18.869  29.365
  976    HD1  HIS 120           HD1      HIS 120 -10.125  15.397  28.744
  977    HD2  HIS 120           HD2      HIS 120  -9.550  18.667  31.264
  978    HE1  HIS 120           HE1      HIS 120  -8.079  14.872  30.141
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1 -11.544  -4.748  22.902
    2    H2   MET   1           HT2      MET   1 -13.045  -4.974  22.140
    3    H3   MET   1           HT3      MET   1 -11.698  -4.472  21.235
    4    HA   MET   1           HA       MET   1 -10.942  -6.825  22.490
    5    HB2  MET   1           HB2      MET   1 -13.688  -6.934  21.216
    6    HB3  MET   1           HB1      MET   1 -12.698  -8.356  21.547
    7    HG2  MET   1           HG2      MET   1 -12.644  -7.734  23.950
    8    HG3  MET   1           HG1      MET   1 -13.696  -6.363  23.604
    9    HE1  MET   1           HE1      MET   1 -17.065  -7.680  22.824
   10    HE2  MET   1           HE2      MET   1 -15.931  -7.500  21.490
   11    HE3  MET   1           HE3      MET   1 -15.893  -6.356  22.829
   12    H    THR   2           HN       THR   2 -12.721  -7.503  19.670
   13    HA   THR   2           HA       THR   2 -10.237  -7.254  18.028
   14    HB   THR   2           HB       THR   2 -11.557  -8.776  16.462
   15    HG1  THR   2           HG1      THR   2 -13.134  -9.812  18.289
   16   HG21  THR   2          HG21      THR   2 -10.803  -9.591  19.273
   17   HG22  THR   2          HG22      THR   2  -9.839  -9.745  17.804
   18   HG23  THR   2          HG23      THR   2 -11.258 -10.767  18.039
   19    H    LEU   3           HN       LEU   3 -10.160  -5.397  16.922
   20    HA   LEU   3           HA       LEU   3 -12.396  -3.718  16.338
   21    HB2  LEU   3           HB2      LEU   3  -9.999  -2.980  16.425
   22    HB3  LEU   3           HB1      LEU   3  -9.723  -3.833  14.908
   23    HG   LEU   3           HG       LEU   3 -11.466  -2.427  13.824
   24   HD11  LEU   3          HD11      LEU   3 -11.920  -0.233  15.286
   25   HD12  LEU   3          HD12      LEU   3 -11.704  -1.364  16.621
   26   HD13  LEU   3          HD13      LEU   3 -12.958  -1.650  15.414
   27   HD21  LEU   3          HD21      LEU   3  -9.363  -0.740  15.213
   28   HD22  LEU   3          HD22      LEU   3 -10.090  -0.454  13.631
   29   HD23  LEU   3          HD23      LEU   3  -9.010  -1.826  13.870
   30    H    GLU   4           HN       GLU   4 -10.669  -6.139  14.405
   31    HA   GLU   4           HA       GLU   4 -11.964  -5.659  11.928
   32    HB2  GLU   4           HB2      GLU   4 -11.250  -7.930  11.337
   33    HB3  GLU   4           HB1      GLU   4  -9.967  -7.107  12.225
   34    HG2  GLU   4           HG2      GLU   4 -10.797  -8.198  14.325
   35    HG3  GLU   4           HG1      GLU   4 -11.934  -9.124  13.344
   36    H    LEU   5           HN       LEU   5 -12.935  -7.655  14.698
   37    HA   LEU   5           HA       LEU   5 -15.169  -8.897  13.431
   38    HB2  LEU   5           HB2      LEU   5 -14.280  -9.698  15.573
   39    HB3  LEU   5           HB1      LEU   5 -14.731  -8.182  16.349
   40    HG   LEU   5           HG       LEU   5 -17.102  -8.634  15.929
   41   HD11  LEU   5          HD11      LEU   5 -15.984 -10.958  14.371
   42   HD12  LEU   5          HD12      LEU   5 -17.247  -9.815  13.912
   43   HD13  LEU   5          HD13      LEU   5 -17.591 -11.077  15.090
   44   HD21  LEU   5          HD21      LEU   5 -15.830  -9.642  17.923
   45   HD22  LEU   5          HD22      LEU   5 -15.894 -11.170  17.043
   46   HD23  LEU   5          HD23      LEU   5 -17.388 -10.369  17.529
   47    H    GLN   6           HN       GLN   6 -14.849  -5.867  15.256
   48    HA   GLN   6           HA       GLN   6 -17.600  -5.148  15.310
   49    HB2  GLN   6           HB2      GLN   6 -14.975  -3.781  15.580
   50    HB3  GLN   6           HB1      GLN   6 -16.285  -2.717  15.078
   51    HG2  GLN   6           HG2      GLN   6 -15.999  -2.841  17.556
   52    HG3  GLN   6           HG1      GLN   6 -17.601  -3.345  17.020
   53   HE21  GLN   6          HE21      GLN   6 -17.930  -4.755  18.868
   54   HE22  GLN   6          HE22      GLN   6 -17.065  -6.204  19.049
   55    H    LEU   7           HN       LEU   7 -15.093  -4.519  12.875
   56    HA   LEU   7           HA       LEU   7 -16.712  -2.981  11.112
   57    HB2  LEU   7           HB2      LEU   7 -14.294  -3.052  10.861
   58    HB3  LEU   7           HB1      LEU   7 -14.341  -4.787  10.553
   59    HG   LEU   7           HG       LEU   7 -15.552  -4.436   8.469
   60   HD11  LEU   7          HD11      LEU   7 -16.991  -2.612   8.826
   61   HD12  LEU   7          HD12      LEU   7 -15.779  -1.927   7.746
   62   HD13  LEU   7          HD13      LEU   7 -15.704  -1.600   9.479
   63   HD21  LEU   7          HD21      LEU   7 -13.259  -2.473   8.716
   64   HD22  LEU   7          HD22      LEU   7 -13.845  -3.204   7.224
   65   HD23  LEU   7          HD23      LEU   7 -13.081  -4.210   8.455
   66    H    LYS   8           HN       LYS   8 -16.134  -6.475  11.322
   67    HA   LYS   8           HA       LYS   8 -17.584  -7.229   8.993
   68    HB2  LYS   8           HB2      LYS   8 -17.063  -8.663  11.609
   69    HB3  LYS   8           HB1      LYS   8 -17.845  -9.437  10.229
   70    HG2  LYS   8           HG2      LYS   8 -15.878  -8.962   8.830
   71    HG3  LYS   8           HG1      LYS   8 -15.098  -8.144  10.184
   72    HD2  LYS   8           HD2      LYS   8 -15.194 -10.257  11.489
   73    HD3  LYS   8           HD1      LYS   8 -15.900 -11.067  10.090
   74    HE2  LYS   8           HE2      LYS   8 -13.216  -9.660  10.061
   75    HE3  LYS   8           HE1      LYS   8 -13.421 -11.398  10.279
   76    HZ1  LYS   8           HZ1      LYS   8 -14.179  -9.773   7.917
   77    HZ2  LYS   8           HZ2      LYS   8 -14.673 -11.383   8.138
   78    HZ3  LYS   8           HZ3      LYS   8 -13.022 -11.011   7.991
   79    H    HIS   9           HN       HIS   9 -18.645  -6.697  12.345
   80    HA   HIS   9           HA       HIS   9 -21.386  -7.466  11.814
   81    HB2  HIS   9           HB2      HIS   9 -20.434  -7.535  14.083
   82    HB3  HIS   9           HB1      HIS   9 -20.234  -5.782  14.054
   83    HD1  HIS   9           HD1      HIS   9 -23.119  -8.211  13.371
   84    HD2  HIS   9           HD2      HIS   9 -22.387  -4.554  15.235
   85    HE1  HIS   9           HE1      HIS   9 -25.328  -7.448  14.348
   86    H    TYR  10           HN       TYR  10 -19.617  -4.396  11.900
   87    HA   TYR  10           HA       TYR  10 -21.857  -2.653  11.628
   88    HB2  TYR  10           HB2      TYR  10 -19.665  -1.811  12.265
   89    HB3  TYR  10           HB1      TYR  10 -18.978  -2.325  10.725
   90    HD1  TYR  10           HD1      TYR  10 -21.557  -0.085  12.240
   91    HD2  TYR  10           HD2      TYR  10 -19.100  -0.929   8.817
   92    HE1  TYR  10           HE1      TYR  10 -22.241   2.067  11.216
   93    HE2  TYR  10           HE2      TYR  10 -19.785   1.223   7.795
   94    HH   TYR  10           HH       TYR  10 -20.826   3.179   8.158
   95    H    ILE  11           HN       ILE  11 -19.693  -4.003   9.102
   96    HA   ILE  11           HA       ILE  11 -21.137  -2.795   6.935
   97    HB   ILE  11           HB       ILE  11 -18.788  -3.655   6.798
   98   HG12  ILE  11          HG12      ILE  11 -20.603  -4.999   4.785
   99   HG13  ILE  11          HG11      ILE  11 -20.313  -3.259   4.796
  100   HG21  ILE  11          HG21      ILE  11 -19.302  -5.792   8.042
  101   HG22  ILE  11          HG22      ILE  11 -18.375  -6.016   6.559
  102   HG23  ILE  11          HG23      ILE  11 -20.099  -6.376   6.582
  103   HD11  ILE  11          HD11      ILE  11 -18.804  -4.746   3.287
  104   HD12  ILE  11          HD12      ILE  11 -17.999  -5.192   4.790
  105   HD13  ILE  11          HD13      ILE  11 -18.039  -3.504   4.276
  106    H    THR  12           HN       THR  12 -21.363  -5.983   8.496
  107    HA   THR  12           HA       THR  12 -23.197  -7.149   6.658
  108    HB   THR  12           HB       THR  12 -23.894  -8.542   8.668
  109    HG1  THR  12           HG1      THR  12 -22.191  -6.643   9.831
  110   HG21  THR  12          HG21      THR  12 -21.051  -8.218   7.734
  111   HG22  THR  12          HG22      THR  12 -22.164  -9.564   7.482
  112   HG23  THR  12          HG23      THR  12 -21.402  -9.333   9.055
  113    H    ASN  13           HN       ASN  13 -23.751  -5.175   9.576
  114    HA   ASN  13           HA       ASN  13 -26.621  -5.300   9.427
  115    HB2  ASN  13           HB2      ASN  13 -24.680  -3.392  10.742
  116    HB3  ASN  13           HB1      ASN  13 -26.423  -3.152  10.838
  117   HD21  ASN  13          HD21      ASN  13 -24.965  -3.689  13.198
  118   HD22  ASN  13          HD22      ASN  13 -25.369  -5.237  13.764
  119    H    LEU  14           HN       LEU  14 -24.203  -3.062   8.107
  120    HA   LEU  14           HA       LEU  14 -26.024  -1.117   7.106
  121    HB2  LEU  14           HB2      LEU  14 -23.602  -0.715   7.230
  122    HB3  LEU  14           HB1      LEU  14 -23.314  -1.978   6.035
  123    HG   LEU  14           HG       LEU  14 -24.548  -0.697   4.343
  124   HD11  LEU  14          HD11      LEU  14 -25.122   1.098   6.695
  125   HD12  LEU  14          HD12      LEU  14 -26.226   0.499   5.455
  126   HD13  LEU  14          HD13      LEU  14 -25.075   1.774   5.066
  127   HD21  LEU  14          HD21      LEU  14 -22.626   1.195   5.706
  128   HD22  LEU  14          HD22      LEU  14 -22.915   0.992   3.978
  129   HD23  LEU  14          HD23      LEU  14 -22.078  -0.267   4.884
  130    H    PHE  15           HN       PHE  15 -24.658  -4.035   5.608
  131    HA   PHE  15           HA       PHE  15 -26.460  -3.683   3.260
  132    HB2  PHE  15           HB2      PHE  15 -24.115  -5.513   3.862
  133    HB3  PHE  15           HB1      PHE  15 -25.116  -5.683   2.419
  134    HD1  PHE  15           HD2      PHE  15 -25.241  -3.823   0.754
  135    HD2  PHE  15           HD1      PHE  15 -22.492  -3.743   4.056
  136    HE1  PHE  15           HE2      PHE  15 -23.939  -2.039  -0.373
  137    HE2  PHE  15           HE1      PHE  15 -21.190  -1.958   2.927
  138    HZ   PHE  15           HZ       PHE  15 -21.914  -1.106   0.713
  139    H    ASN  16           HN       ASN  16 -26.564  -4.981   6.281
  140    HA   ASN  16           HA       ASN  16 -27.840  -6.632   7.318
  141    HB2  ASN  16           HB2      ASN  16 -29.463  -6.152   4.807
  142    HB3  ASN  16           HB1      ASN  16 -30.001  -7.205   6.115
  143   HD21  ASN  16          HD21      ASN  16 -28.885  -5.604   8.299
  144   HD22  ASN  16          HD22      ASN  16 -29.794  -4.176   8.392
  145    H    LEU  17           HN       LEU  17 -25.578  -7.495   5.718
  146    HA   LEU  17           HA       LEU  17 -26.468  -9.861   4.280
  147    HB2  LEU  17           HB2      LEU  17 -23.769  -8.722   4.979
  148    HB3  LEU  17           HB1      LEU  17 -23.918 -10.314   4.236
  149    HG   LEU  17           HG       LEU  17 -25.300  -7.911   3.030
  150   HD11  LEU  17          HD11      LEU  17 -22.856  -7.414   3.283
  151   HD12  LEU  17          HD12      LEU  17 -23.381  -7.525   1.604
  152   HD13  LEU  17          HD13      LEU  17 -22.509  -8.867   2.345
  153   HD21  LEU  17          HD21      LEU  17 -24.897  -9.303   0.936
  154   HD22  LEU  17          HD22      LEU  17 -26.021 -10.005   2.089
  155   HD23  LEU  17          HD23      LEU  17 -24.368 -10.605   1.994
  156    HA   PRO  18           HA       PRO  18 -26.641 -12.859   7.546
  157    HB2  PRO  18           HB2      PRO  18 -24.592 -14.433   6.010
  158    HB3  PRO  18           HB1      PRO  18 -26.146 -14.967   6.683
  159    HG2  PRO  18           HG2      PRO  18 -25.865 -14.501   4.081
  160    HG3  PRO  18           HG1      PRO  18 -27.356 -14.065   4.937
  161    HD2  PRO  18           HD2      PRO  18 -25.178 -12.279   3.926
  162    HD3  PRO  18           HD1      PRO  18 -26.919 -11.969   4.113
  163    H    ARG  19           HN       ARG  19 -25.649 -12.962   9.502
  164    HA   ARG  19           HA       ARG  19 -22.825 -12.083   9.757
  165    HB2  ARG  19           HB2      ARG  19 -25.019 -12.559  11.799
  166    HB3  ARG  19           HB1      ARG  19 -23.394 -12.005  12.198
  167    HG2  ARG  19           HG2      ARG  19 -23.712 -10.012  10.780
  168    HG3  ARG  19           HG1      ARG  19 -25.331 -10.570  10.355
  169    HD2  ARG  19           HD2      ARG  19 -24.446 -10.051  13.206
  170    HD3  ARG  19           HD1      ARG  19 -25.276  -8.854  12.212
  171    HE   ARG  19           HE       ARG  19 -26.921 -11.079  12.067
  172   HH11  ARG  19          HH21      ARG  19 -25.465  -9.223  14.589
  173   HH12  ARG  19          HH22      ARG  19 -26.755  -9.494  15.711
  174   HH21  ARG  19          HH11      ARG  19 -28.605 -11.447  13.526
  175   HH22  ARG  19          HH12      ARG  19 -28.529 -10.755  15.113
  176    H    ASP  20           HN       ASP  20 -24.720 -14.967   9.833
  177    HA   ASP  20           HA       ASP  20 -22.767 -16.460  11.474
  178    HB2  ASP  20           HB2      ASP  20 -25.300 -17.281  10.027
  179    HB3  ASP  20           HB1      ASP  20 -24.304 -18.388  10.973
  180    H    GLU  21           HN       GLU  21 -22.845 -15.441   8.312
  181    HA   GLU  21           HA       GLU  21 -21.768 -17.945   7.155
  182    HB2  GLU  21           HB2      GLU  21 -22.306 -15.194   5.996
  183    HB3  GLU  21           HB1      GLU  21 -21.583 -16.511   5.073
  184    HG2  GLU  21           HG2      GLU  21 -24.261 -16.691   6.486
  185    HG3  GLU  21           HG1      GLU  21 -24.067 -16.346   4.766
  186    H    LYS  22           HN       LYS  22 -19.720 -18.389   7.706
  187    HA   LYS  22           HA       LYS  22 -17.797 -16.298   8.366
  188    HB2  LYS  22           HB2      LYS  22 -17.804 -18.499   9.510
  189    HB3  LYS  22           HB1      LYS  22 -17.384 -19.277   7.983
  190    HG2  LYS  22           HG2      LYS  22 -15.293 -18.005   7.877
  191    HG3  LYS  22           HG1      LYS  22 -15.718 -17.149   9.360
  192    HD2  LYS  22           HD2      LYS  22 -15.735 -19.291  10.588
  193    HD3  LYS  22           HD1      LYS  22 -15.291 -20.141   9.107
  194    HE2  LYS  22           HE2      LYS  22 -13.204 -18.838   8.977
  195    HE3  LYS  22           HE1      LYS  22 -13.647 -17.973  10.448
  196    HZ1  LYS  22           HZ1      LYS  22 -12.937 -20.821  10.130
  197    HZ2  LYS  22           HZ2      LYS  22 -13.815 -20.280  11.480
  198    HZ3  LYS  22           HZ3      LYS  22 -12.259 -19.670  11.175
  199    H    TRP  23           HN       TRP  23 -15.963 -15.721   7.155
  200    HA   TRP  23           HA       TRP  23 -16.116 -16.387   4.244
  201    HB2  TRP  23           HB2      TRP  23 -14.451 -14.207   5.521
  202    HB3  TRP  23           HB1      TRP  23 -14.977 -14.337   3.843
  203    HD1  TRP  23           HD1      TRP  23 -18.041 -15.201   4.805
  204    HE1  TRP  23           HE1      TRP  23 -19.604 -13.285   5.522
  205    HE3  TRP  23           HE3      TRP  23 -14.586 -11.574   5.802
  206    HZ2  TRP  23           HZ2      TRP  23 -19.416 -10.568   6.400
  207    HZ3  TRP  23           HZ3      TRP  23 -15.306  -9.332   6.575
  208    HH2  TRP  23           HH2      TRP  23 -17.714  -8.826   6.875
  209    H    GLU  24           HN       GLU  24 -13.845 -16.346   3.185
  210    HA   GLU  24           HA       GLU  24 -12.029 -18.096   4.809
  211    HB2  GLU  24           HB2      GLU  24 -12.509 -17.850   1.831
  212    HB3  GLU  24           HB1      GLU  24 -11.186 -18.794   2.525
  213    HG2  GLU  24           HG2      GLU  24 -12.783 -20.158   3.781
  214    HG3  GLU  24           HG1      GLU  24 -14.123 -19.181   3.179
  215    H    CYS  25           HN       CYS  25 -10.234 -17.098   5.501
  216    HA   CYS  25           HA       CYS  25  -9.404 -14.530   4.380
  217    HB2  CYS  25           HB2      CYS  25  -7.899 -14.410   6.207
  218    HB3  CYS  25           HB1      CYS  25  -9.323 -15.224   6.849
  219    HG   CYS  25           HG       CYS  25  -6.814 -16.441   7.233
  220    H    GLU  26           HN       GLU  26  -7.572 -14.136   3.158
  221    HA   GLU  26           HA       GLU  26  -6.031 -16.539   2.210
  222    HB2  GLU  26           HB2      GLU  26  -7.493 -15.582   0.454
  223    HB3  GLU  26           HB1      GLU  26  -6.721 -14.012   0.677
  224    HG2  GLU  26           HG2      GLU  26  -4.561 -14.934   0.016
  225    HG3  GLU  26           HG1      GLU  26  -5.258 -16.550  -0.103
  226    H    SER  27           HN       SER  27  -4.017 -16.448   3.024
  227    HA   SER  27           HA       SER  27  -2.868 -13.870   3.887
  228    HB2  SER  27           HB2      SER  27  -2.625 -15.818   5.349
  229    HB3  SER  27           HB1      SER  27  -1.845 -16.722   4.055
  230    HG   SER  27           HG       SER  27  -0.790 -14.958   5.794
  231    H    ILE  28           HN       ILE  28  -1.868 -12.675   2.337
  232    HA   ILE  28           HA       ILE  28   0.149 -14.003   0.615
  233    HB   ILE  28           HB       ILE  28  -1.920 -13.979  -0.735
  234   HG12  ILE  28          HG12      ILE  28  -0.001 -11.838  -1.689
  235   HG13  ILE  28          HG11      ILE  28   0.387 -13.558  -1.712
  236   HG21  ILE  28          HG21      ILE  28  -1.808 -10.963  -0.584
  237   HG22  ILE  28          HG22      ILE  28  -2.827 -11.915   0.496
  238   HG23  ILE  28          HG23      ILE  28  -3.092 -11.976  -1.246
  239   HD11  ILE  28          HD11      ILE  28  -0.471 -12.989  -3.891
  240   HD12  ILE  28          HD12      ILE  28  -1.863 -12.169  -3.187
  241   HD13  ILE  28          HD13      ILE  28  -1.719 -13.923  -3.064
  242    H    GLU  29           HN       GLU  29   1.948 -12.749   0.461
  243    HA   GLU  29           HA       GLU  29   1.972 -10.177   1.860
  244    HB2  GLU  29           HB2      GLU  29   4.106 -11.785   0.431
  245    HB3  GLU  29           HB1      GLU  29   4.426 -10.251   1.245
  246    HG2  GLU  29           HG2      GLU  29   3.623 -11.169   3.363
  247    HG3  GLU  29           HG1      GLU  29   3.192 -12.683   2.570
  248    H    GLU  30           HN       GLU  30   1.947  -8.165   0.905
  249    HA   GLU  30           HA       GLU  30   2.668  -7.872  -1.937
  250    HB2  GLU  30           HB2      GLU  30   0.295  -8.562  -2.061
  251    HB3  GLU  30           HB1      GLU  30  -0.145  -7.230  -0.993
  252    HG2  GLU  30           HG2      GLU  30   0.668  -5.603  -2.627
  253    HG3  GLU  30           HG1      GLU  30   1.232  -6.903  -3.677
  254    H    VAL  31           HN       VAL  31   2.920  -5.641  -2.542
  255    HA   VAL  31           HA       VAL  31   3.851  -3.955  -0.404
  256    HB   VAL  31           HB       VAL  31   3.326  -3.369  -3.323
  257   HG11  VAL  31          HG11      VAL  31   4.614  -1.741  -1.123
  258   HG12  VAL  31          HG12      VAL  31   3.311  -1.258  -2.209
  259   HG13  VAL  31          HG13      VAL  31   4.951  -1.449  -2.828
  260   HG21  VAL  31          HG21      VAL  31   5.810  -3.553  -3.452
  261   HG22  VAL  31          HG22      VAL  31   5.050  -5.062  -2.944
  262   HG23  VAL  31          HG23      VAL  31   5.836  -4.026  -1.753
  263    H    ALA  32           HN       ALA  32   2.847  -2.280   0.638
  264    HA   ALA  32           HA       ALA  32  -0.003  -2.120   0.700
  265    HB1  ALA  32           HB1      ALA  32   0.468   0.066   1.927
  266    HB2  ALA  32           HB2      ALA  32   2.177  -0.235   1.620
  267    HB3  ALA  32           HB3      ALA  32   1.246  -1.368   2.599
  268    H    ASP  33           HN       ASP  33   2.423  -0.187  -1.035
  269    HA   ASP  33           HA       ASP  33   0.591   1.795  -2.017
  270    HB2  ASP  33           HB2      ASP  33   3.138   1.909  -1.949
  271    HB3  ASP  33           HB1      ASP  33   3.130   0.884  -3.383
  272    H    ASP  34           HN       ASP  34   0.934  -1.499  -2.819
  273    HA   ASP  34           HA       ASP  34  -0.027  -1.139  -5.608
  274    HB2  ASP  34           HB2      ASP  34   0.769  -3.575  -3.998
  275    HB3  ASP  34           HB1      ASP  34   0.112  -3.665  -5.633
  276    H    ILE  35           HN       ILE  35  -1.381  -1.304  -2.559
  277    HA   ILE  35           HA       ILE  35  -3.993  -2.262  -3.685
  278    HB   ILE  35           HB       ILE  35  -4.436  -3.125  -1.314
  279   HG12  ILE  35          HG12      ILE  35  -1.410  -3.069  -1.153
  280   HG13  ILE  35          HG11      ILE  35  -2.433  -1.872  -0.364
  281   HG21  ILE  35          HG21      ILE  35  -3.276  -5.250  -1.753
  282   HG22  ILE  35          HG22      ILE  35  -2.238  -4.450  -2.932
  283   HG23  ILE  35          HG23      ILE  35  -3.967  -4.605  -3.242
  284   HD11  ILE  35          HD11      ILE  35  -3.605  -3.707   0.841
  285   HD12  ILE  35          HD12      ILE  35  -1.885  -3.638   1.227
  286   HD13  ILE  35          HD13      ILE  35  -2.489  -4.863   0.112
  287    H    LEU  36           HN       LEU  36  -2.265  -0.196  -1.402
  288    HA   LEU  36           HA       LEU  36  -4.784   1.219  -0.760
  289    HB2  LEU  36           HB2      LEU  36  -2.120   0.939   0.501
  290    HB3  LEU  36           HB1      LEU  36  -2.820   2.551   0.641
  291    HG   LEU  36           HG       LEU  36  -4.935   1.439   1.495
  292   HD11  LEU  36          HD11      LEU  36  -3.065  -0.937   1.684
  293   HD12  LEU  36          HD12      LEU  36  -4.446  -0.815   0.594
  294   HD13  LEU  36          HD13      LEU  36  -4.700  -0.862   2.339
  295   HD21  LEU  36          HD21      LEU  36  -3.360   2.519   2.992
  296   HD22  LEU  36          HD22      LEU  36  -2.352   1.073   3.016
  297   HD23  LEU  36          HD23      LEU  36  -3.958   1.040   3.743
  298    HA   PRO  37           HA       PRO  37  -4.107   4.678  -3.450
  299    HB2  PRO  37           HB2      PRO  37  -4.140   6.542  -1.109
  300    HB3  PRO  37           HB1      PRO  37  -5.168   6.532  -2.556
  301    HG2  PRO  37           HG2      PRO  37  -6.077   5.732  -0.166
  302    HG3  PRO  37           HG1      PRO  37  -6.615   4.977  -1.678
  303    HD2  PRO  37           HD2      PRO  37  -4.716   3.920   0.386
  304    HD3  PRO  37           HD1      PRO  37  -5.867   3.060  -0.658
  305    H    ASP  38           HN       ASP  38  -2.376   5.873  -4.267
  306    HA   ASP  38           HA       ASP  38   0.238   5.471  -3.136
  307    HB2  ASP  38           HB2      ASP  38   0.976   7.026  -4.940
  308    HB3  ASP  38           HB1      ASP  38  -0.083   5.752  -5.546
  309    H    GLN  39           HN       GLN  39  -2.116   8.077  -2.963
  310    HA   GLN  39           HA       GLN  39  -0.390  10.106  -1.930
  311    HB2  GLN  39           HB2      GLN  39  -2.663  10.558  -2.787
  312    HB3  GLN  39           HB1      GLN  39  -3.349   9.675  -1.420
  313    HG2  GLN  39           HG2      GLN  39  -2.442  11.265   0.153
  314    HG3  GLN  39           HG1      GLN  39  -1.525  12.075  -1.118
  315   HE21  GLN  39          HE21      GLN  39  -3.416  13.511   0.476
  316   HE22  GLN  39          HE22      GLN  39  -4.716  13.972  -0.513
  317    H    TYR  40           HN       TYR  40  -2.217   7.508  -0.341
  318    HA   TYR  40           HA       TYR  40  -1.256   8.432   2.316
  319    HB2  TYR  40           HB2      TYR  40  -3.224   6.339   1.373
  320    HB3  TYR  40           HB1      TYR  40  -2.635   6.343   3.035
  321    HD1  TYR  40           HD2      TYR  40  -2.903   8.454   4.426
  322    HD2  TYR  40           HD1      TYR  40  -4.900   7.878   0.666
  323    HE1  TYR  40           HE2      TYR  40  -4.498  10.265   4.997
  324    HE2  TYR  40           HE1      TYR  40  -6.495   9.692   1.237
  325    HH   TYR  40           HH       TYR  40  -6.043  11.944   3.321
  326    H    VAL  41           HN       VAL  41   0.001   6.681  -0.169
  327    HA   VAL  41           HA       VAL  41   1.864   5.285   1.665
  328    HB   VAL  41           HB       VAL  41   0.539   3.820  -0.638
  329   HG11  VAL  41          HG11      VAL  41   2.869   3.151   0.071
  330   HG12  VAL  41          HG12      VAL  41   1.664   1.880   0.284
  331   HG13  VAL  41          HG13      VAL  41   2.221   2.810   1.675
  332   HG21  VAL  41          HG21      VAL  41  -0.554   2.510   1.231
  333   HG22  VAL  41          HG22      VAL  41  -1.148   4.161   1.061
  334   HG23  VAL  41          HG23      VAL  41  -0.007   3.760   2.345
  335    H    ARG  42           HN       ARG  42   3.480   6.716   0.963
  336    HA   ARG  42           HA       ARG  42   4.587   6.114  -1.712
  337    HB2  ARG  42           HB2      ARG  42   3.118   8.110  -2.031
  338    HB3  ARG  42           HB1      ARG  42   4.048   8.959  -0.795
  339    HG2  ARG  42           HG2      ARG  42   6.094   8.707  -2.140
  340    HG3  ARG  42           HG1      ARG  42   5.187   7.830  -3.372
  341    HD2  ARG  42           HD2      ARG  42   3.762   9.811  -3.735
  342    HD3  ARG  42           HD1      ARG  42   4.657  10.681  -2.492
  343    HE   ARG  42           HE       ARG  42   6.494  10.904  -4.002
  344   HH11  ARG  42          HH21      ARG  42   3.992   8.842  -5.203
  345   HH12  ARG  42          HH22      ARG  42   4.615   8.815  -6.818
  346   HH21  ARG  42          HH11      ARG  42   7.313  10.870  -6.106
  347   HH22  ARG  42          HH12      ARG  42   6.490   9.961  -7.329
  348    H    LEU  43           HN       LEU  43   5.084   8.514   0.903
  349    HA   LEU  43           HA       LEU  43   7.956   7.697   1.004
  350    HB2  LEU  43           HB2      LEU  43   7.242  10.149   0.697
  351    HB3  LEU  43           HB1      LEU  43   6.680  10.083   2.364
  352    HG   LEU  43           HG       LEU  43   9.054   9.192   2.926
  353   HD11  LEU  43          HD11      LEU  43   9.976   8.732   0.771
  354   HD12  LEU  43          HD12      LEU  43  10.778  10.198   1.316
  355   HD13  LEU  43          HD13      LEU  43   9.473  10.298   0.138
  356   HD21  LEU  43          HD21      LEU  43   8.326  11.387   3.643
  357   HD22  LEU  43          HD22      LEU  43   8.560  12.043   2.023
  358   HD23  LEU  43          HD23      LEU  43   9.953  11.543   2.980
  359    H    GLY  44           HN       GLY  44   5.012   7.818   2.895
  360    HA2  GLY  44           HA2      GLY  44   6.033   7.631   5.482
  361    HA3  GLY  44           HA1      GLY  44   4.518   6.879   4.988
  362    HA   PRO  45           HA       PRO  45   7.830   3.650   6.256
  363    HB2  PRO  45           HB2      PRO  45   5.522   2.760   7.946
  364    HB3  PRO  45           HB1      PRO  45   7.239   2.898   8.371
  365    HG2  PRO  45           HG2      PRO  45   5.425   4.646   9.262
  366    HG3  PRO  45           HG1      PRO  45   7.077   5.144   8.855
  367    HD2  PRO  45           HD2      PRO  45   4.541   5.576   7.314
  368    HD3  PRO  45           HD1      PRO  45   5.973   6.618   7.460
  369    H    LEU  46           HN       LEU  46   4.384   3.549   5.520
  370    HA   LEU  46           HA       LEU  46   4.409   0.773   4.621
  371    HB2  LEU  46           HB2      LEU  46   2.328   2.891   4.024
  372    HB3  LEU  46           HB1      LEU  46   2.103   1.144   4.056
  373    HG   LEU  46           HG       LEU  46   2.739   2.921   6.430
  374   HD11  LEU  46          HD11      LEU  46   0.406   3.049   5.647
  375   HD12  LEU  46          HD12      LEU  46   0.498   2.208   7.194
  376   HD13  LEU  46          HD13      LEU  46   0.286   1.290   5.703
  377   HD21  LEU  46          HD21      LEU  46   3.836   0.873   6.892
  378   HD22  LEU  46          HD22      LEU  46   2.579  -0.081   6.104
  379   HD23  LEU  46          HD23      LEU  46   2.262   0.685   7.662
  380    H    SER  47           HN       SER  47   5.671   3.534   3.333
  381    HA   SER  47           HA       SER  47   5.007   4.010   0.767
  382    HB2  SER  47           HB2      SER  47   7.533   3.972   0.230
  383    HB3  SER  47           HB1      SER  47   6.996   5.009   1.549
  384    HG   SER  47           HG       SER  47   7.719   2.338   2.045
  385    H    ASN  48           HN       ASN  48   7.736   1.866   0.616
  386    HA   ASN  48           HA       ASN  48   6.240   0.118  -1.304
  387    HB2  ASN  48           HB2      ASN  48   8.247   1.282  -2.170
  388    HB3  ASN  48           HB1      ASN  48   9.222   0.542  -0.902
  389   HD21  ASN  48          HD21      ASN  48   7.006  -0.416  -3.586
  390   HD22  ASN  48          HD22      ASN  48   7.852  -1.835  -3.972
  391    H    LYS  49           HN       LYS  49   6.450   0.036   1.768
  392    HA   LYS  49           HA       LYS  49   7.993  -2.315   2.400
  393    HB2  LYS  49           HB2      LYS  49   7.128  -0.411   3.966
  394    HB3  LYS  49           HB1      LYS  49   5.651  -1.365   4.048
  395    HG2  LYS  49           HG2      LYS  49   6.890  -3.293   4.884
  396    HG3  LYS  49           HG1      LYS  49   8.419  -2.440   4.679
  397    HD2  LYS  49           HD2      LYS  49   7.642  -0.723   6.314
  398    HD3  LYS  49           HD1      LYS  49   6.182  -1.678   6.576
  399    HE2  LYS  49           HE2      LYS  49   8.987  -2.752   6.966
  400    HE3  LYS  49           HE1      LYS  49   7.993  -2.108   8.273
  401    HZ1  LYS  49           HZ1      LYS  49   7.884  -4.569   7.968
  402    HZ2  LYS  49           HZ2      LYS  49   7.107  -4.298   6.483
  403    HZ3  LYS  49           HZ3      LYS  49   6.381  -3.785   7.930
  404    H    ILE  50           HN       ILE  50   7.349  -4.446   2.594
  405    HA   ILE  50           HA       ILE  50   4.797  -5.177   1.272
  406    HB   ILE  50           HB       ILE  50   7.144  -6.861   2.184
  407   HG12  ILE  50          HG12      ILE  50   6.252  -6.095  -0.612
  408   HG13  ILE  50          HG11      ILE  50   7.517  -5.243   0.273
  409   HG21  ILE  50          HG21      ILE  50   4.611  -7.530   0.660
  410   HG22  ILE  50          HG22      ILE  50   5.148  -8.215   2.195
  411   HG23  ILE  50          HG23      ILE  50   6.023  -8.586   0.710
  412   HD11  ILE  50          HD11      ILE  50   8.942  -7.133   0.288
  413   HD12  ILE  50          HD12      ILE  50   8.266  -7.110  -1.339
  414   HD13  ILE  50          HD13      ILE  50   7.632  -8.233  -0.138
  415    H    LEU  51           HN       LEU  51   3.068  -5.345   2.590
  416    HA   LEU  51           HA       LEU  51   3.475  -6.312   5.397
  417    HB2  LEU  51           HB2      LEU  51   1.564  -4.378   4.117
  418    HB3  LEU  51           HB1      LEU  51   1.040  -5.253   5.557
  419    HG   LEU  51           HG       LEU  51   3.042  -4.463   6.762
  420   HD11  LEU  51          HD11      LEU  51   3.679  -3.281   4.073
  421   HD12  LEU  51          HD12      LEU  51   4.732  -4.124   5.207
  422   HD13  LEU  51          HD13      LEU  51   4.242  -2.466   5.535
  423   HD21  LEU  51          HD21      LEU  51   2.306  -2.202   7.087
  424   HD22  LEU  51          HD22      LEU  51   0.873  -3.145   6.681
  425   HD23  LEU  51          HD23      LEU  51   1.630  -2.124   5.460
  426    H    GLN  52           HN       GLN  52   1.990  -7.818   6.254
  427    HA   GLN  52           HA       GLN  52   1.228  -9.885   4.391
  428    HB2  GLN  52           HB2      GLN  52   1.894 -10.291   6.770
  429    HB3  GLN  52           HB1      GLN  52   0.392  -9.522   7.285
  430    HG2  GLN  52           HG2      GLN  52  -0.903 -11.202   6.027
  431    HG3  GLN  52           HG1      GLN  52   0.599 -11.974   5.518
  432   HE21  GLN  52          HE21      GLN  52   1.104 -13.751   6.785
  433   HE22  GLN  52          HE22      GLN  52   0.733 -13.919   8.433
  434    H    THR  53           HN       THR  53  -0.478  -9.612   3.047
  435    HA   THR  53           HA       THR  53  -2.775  -7.939   3.923
  436    HB   THR  53           HB       THR  53  -2.057  -9.135   1.230
  437    HG1  THR  53           HG1      THR  53  -2.081  -6.421   1.989
  438   HG21  THR  53          HG21      THR  53  -4.297  -7.307   2.117
  439   HG22  THR  53          HG22      THR  53  -4.441  -8.880   1.333
  440   HG23  THR  53          HG23      THR  53  -3.817  -7.499   0.431
  441    H    ASN  54           HN       ASN  54  -4.458  -8.963   4.834
  442    HA   ASN  54           HA       ASN  54  -4.965 -11.836   4.147
  443    HB2  ASN  54           HB2      ASN  54  -5.641 -10.147   6.565
  444    HB3  ASN  54           HB1      ASN  54  -6.377 -11.725   6.277
  445   HD21  ASN  54          HD21      ASN  54  -4.683 -11.330   8.542
  446   HD22  ASN  54          HD22      ASN  54  -3.252 -12.215   8.313
  447    H    THR  55           HN       THR  55  -6.234 -11.600   2.311
  448    HA   THR  55           HA       THR  55  -8.538  -9.728   2.403
  449    HB   THR  55           HB       THR  55  -7.468 -11.463   0.163
  450    HG1  THR  55           HG1      THR  55  -6.856  -9.314  -0.598
  451   HG21  THR  55          HG21      THR  55  -8.897  -9.773  -1.185
  452   HG22  THR  55          HG22      THR  55  -9.718  -9.459   0.342
  453   HG23  THR  55          HG23      THR  55  -9.738 -11.079  -0.354
  454    H    TYR  56           HN       TYR  56 -10.519 -10.442   2.947
  455    HA   TYR  56           HA       TYR  56 -10.983 -13.356   3.204
  456    HB2  TYR  56           HB2      TYR  56 -12.619 -10.939   4.008
  457    HB3  TYR  56           HB1      TYR  56 -13.119 -12.608   4.285
  458    HD1  TYR  56           HD1      TYR  56 -10.512 -10.080   5.060
  459    HD2  TYR  56           HD2      TYR  56 -12.186 -13.906   6.063
  460    HE1  TYR  56           HE1      TYR  56  -9.137 -10.139   7.121
  461    HE2  TYR  56           HE2      TYR  56 -10.813 -13.964   8.127
  462    HH   TYR  56           HH       TYR  56  -9.696 -12.316   9.637
  463    H    TYR  57           HN       TYR  57 -12.322 -14.489   1.853
  464    HA   TYR  57           HA       TYR  57 -13.980 -12.962  -0.116
  465    HB2  TYR  57           HB2      TYR  57 -13.216 -14.427  -1.915
  466    HB3  TYR  57           HB1      TYR  57 -11.828 -13.618  -1.189
  467    HD1  TYR  57           HD2      TYR  57 -10.400 -14.856   0.484
  468    HD2  TYR  57           HD1      TYR  57 -13.454 -16.799  -1.830
  469    HE1  TYR  57           HE2      TYR  57  -9.381 -17.062   0.988
  470    HE2  TYR  57           HE1      TYR  57 -12.436 -19.001  -1.327
  471    HH   TYR  57           HH       TYR  57  -9.476 -19.250   0.653
  472    H    SER  58           HN       SER  58 -15.997 -13.771  -0.220
  473    HA   SER  58           HA       SER  58 -16.468 -16.627   0.533
  474    HB2  SER  58           HB2      SER  58 -16.960 -15.135   2.490
  475    HB3  SER  58           HB1      SER  58 -18.139 -14.287   1.498
  476    HG   SER  58           HG       SER  58 -18.249 -16.786   2.670
  477    H    ASP  59           HN       ASP  59 -18.596 -17.384  -0.261
  478    HA   ASP  59           HA       ASP  59 -19.049 -16.694  -2.986
  479    HB2  ASP  59           HB2      ASP  59 -19.696 -18.859  -1.972
  480    HB3  ASP  59           HB1      ASP  59 -20.929 -18.035  -1.017
  481    H    THR  60           HN       THR  60 -20.832 -15.790  -0.023
  482    HA   THR  60           HA       THR  60 -22.836 -14.229  -1.341
  483    HB   THR  60           HB       THR  60 -21.735 -13.730   1.434
  484    HG1  THR  60           HG1      THR  60 -22.329 -15.703   1.792
  485   HG21  THR  60          HG21      THR  60 -23.989 -12.962   1.896
  486   HG22  THR  60          HG22      THR  60 -24.526 -13.456   0.290
  487   HG23  THR  60          HG23      THR  60 -23.390 -12.119   0.468
  488    H    LEU  61           HN       LEU  61 -19.712 -13.326   0.129
  489    HA   LEU  61           HA       LEU  61 -19.893 -10.526  -0.429
  490    HB2  LEU  61           HB2      LEU  61 -17.489 -12.356  -0.149
  491    HB3  LEU  61           HB1      LEU  61 -17.376 -10.601  -0.245
  492    HG   LEU  61           HG       LEU  61 -18.978 -12.094   1.854
  493   HD11  LEU  61          HD11      LEU  61 -16.706 -12.614   2.301
  494   HD12  LEU  61          HD12      LEU  61 -17.066 -11.245   3.351
  495   HD13  LEU  61          HD13      LEU  61 -16.162 -10.997   1.858
  496   HD21  LEU  61          HD21      LEU  61 -19.907  -9.948   1.806
  497   HD22  LEU  61          HD22      LEU  61 -18.402  -9.187   1.296
  498   HD23  LEU  61          HD23      LEU  61 -18.604  -9.712   2.967
  499    H    HIS  62           HN       HIS  62 -18.622 -13.259  -2.283
  500    HA   HIS  62           HA       HIS  62 -17.475 -11.820  -4.434
  501    HB2  HIS  62           HB2      HIS  62 -17.190 -14.248  -4.083
  502    HB3  HIS  62           HB1      HIS  62 -18.889 -14.502  -4.492
  503    HD1  HIS  62           HD1      HIS  62 -15.765 -12.986  -6.065
  504    HD2  HIS  62           HD2      HIS  62 -19.318 -14.847  -7.198
  505    HE1  HIS  62           HE1      HIS  62 -15.661 -13.256  -8.581
  506    H    LYS  63           HN       LYS  63 -20.811 -13.019  -4.011
  507    HA   LYS  63           HA       LYS  63 -21.769 -12.131  -6.556
  508    HB2  LYS  63           HB2      LYS  63 -23.192 -12.584  -3.919
  509    HB3  LYS  63           HB1      LYS  63 -24.023 -12.228  -5.433
  510    HG2  LYS  63           HG2      LYS  63 -23.075 -14.231  -6.468
  511    HG3  LYS  63           HG1      LYS  63 -22.125 -14.557  -5.020
  512    HD2  LYS  63           HD2      LYS  63 -24.016 -15.977  -4.820
  513    HD3  LYS  63           HD1      LYS  63 -24.363 -14.616  -3.756
  514    HE2  LYS  63           HE2      LYS  63 -25.850 -13.627  -5.367
  515    HE3  LYS  63           HE1      LYS  63 -25.336 -14.751  -6.624
  516    HZ1  LYS  63           HZ1      LYS  63 -27.247 -15.745  -5.923
  517    HZ2  LYS  63           HZ2      LYS  63 -27.093 -15.198  -4.321
  518    HZ3  LYS  63           HZ3      LYS  63 -26.147 -16.497  -4.873
  519    H    SER  64           HN       SER  64 -21.623 -10.538  -3.385
  520    HA   SER  64           HA       SER  64 -22.971  -8.137  -4.325
  521    HB2  SER  64           HB2      SER  64 -21.309  -8.671  -1.845
  522    HB3  SER  64           HB1      SER  64 -22.251  -7.210  -2.125
  523    HG   SER  64           HG       SER  64 -23.414  -8.766  -0.911
  524    H    ASN  65           HN       ASN  65 -19.958  -9.405  -4.925
  525    HA   ASN  65           HA       ASN  65 -17.995  -8.519  -5.831
  526    HB2  ASN  65           HB2      ASN  65 -19.718  -7.378  -7.316
  527    HB3  ASN  65           HB1      ASN  65 -19.578  -5.973  -6.258
  528   HD21  ASN  65          HD21      ASN  65 -17.950  -7.817  -8.769
  529   HD22  ASN  65          HD22      ASN  65 -16.618  -6.779  -8.930
  530    H    ILE  66           HN       ILE  66 -18.267  -8.362  -3.024
  531    HA   ILE  66           HA       ILE  66 -16.953  -5.731  -2.384
  532    HB   ILE  66           HB       ILE  66 -18.367  -7.663  -0.510
  533   HG12  ILE  66          HG12      ILE  66 -19.245  -4.938  -1.511
  534   HG13  ILE  66          HG11      ILE  66 -19.853  -6.464  -2.154
  535   HG21  ILE  66          HG21      ILE  66 -17.308  -4.845  -0.092
  536   HG22  ILE  66          HG22      ILE  66 -16.550  -6.310   0.531
  537   HG23  ILE  66          HG23      ILE  66 -18.141  -5.823   1.116
  538   HD11  ILE  66          HD11      ILE  66 -21.396  -5.611  -0.457
  539   HD12  ILE  66          HD12      ILE  66 -20.083  -5.517   0.717
  540   HD13  ILE  66          HD13      ILE  66 -20.626  -7.088   0.125
  541    H    TYR  67           HN       TYR  67 -14.844  -5.852  -1.810
  542    HA   TYR  67           HA       TYR  67 -13.684  -8.542  -1.138
  543    HB2  TYR  67           HB2      TYR  67 -12.575  -6.206  -2.699
  544    HB3  TYR  67           HB1      TYR  67 -11.537  -7.466  -2.036
  545    HD1  TYR  67           HD1      TYR  67 -12.106  -9.908  -2.609
  546    HD2  TYR  67           HD2      TYR  67 -13.708  -6.546  -4.747
  547    HE1  TYR  67           HE1      TYR  67 -12.676 -11.391  -4.510
  548    HE2  TYR  67           HE2      TYR  67 -14.277  -8.030  -6.653
  549    HH   TYR  67           HH       TYR  67 -13.995 -10.080  -7.529
  550    HA   PRO  68           HA       PRO  68 -12.981  -5.783   2.496
  551    HB2  PRO  68           HB2      PRO  68 -13.755  -7.525   4.433
  552    HB3  PRO  68           HB1      PRO  68 -14.917  -6.569   3.496
  553    HG2  PRO  68           HG2      PRO  68 -14.223  -9.441   3.250
  554    HG3  PRO  68           HG1      PRO  68 -15.769  -8.626   2.977
  555    HD2  PRO  68           HD2      PRO  68 -13.950  -9.416   0.970
  556    HD3  PRO  68           HD1      PRO  68 -15.303  -8.286   0.750
  557    H    PHE  69           HN       PHE  69 -10.792  -5.650   3.017
  558    HA   PHE  69           HA       PHE  69  -9.421  -8.182   3.858
  559    HB2  PHE  69           HB2      PHE  69  -7.470  -7.652   2.540
  560    HB3  PHE  69           HB1      PHE  69  -8.861  -7.606   1.463
  561    HD1  PHE  69           HD1      PHE  69  -6.544  -5.499   3.459
  562    HD2  PHE  69           HD2      PHE  69  -9.490  -5.592   0.333
  563    HE1  PHE  69           HE1      PHE  69  -5.981  -3.160   2.862
  564    HE2  PHE  69           HE2      PHE  69  -8.925  -3.250  -0.262
  565    HZ   PHE  69           HZ       PHE  69  -7.173  -2.036   1.002
  566    H    ILE  70           HN       ILE  70  -7.567  -7.840   5.197
  567    HA   ILE  70           HA       ILE  70  -7.347  -5.119   6.424
  568    HB   ILE  70           HB       ILE  70  -7.518  -7.770   7.894
  569   HG12  ILE  70          HG12      ILE  70  -9.296  -5.323   8.068
  570   HG13  ILE  70          HG11      ILE  70  -9.674  -6.729   7.073
  571   HG21  ILE  70          HG21      ILE  70  -7.423  -6.164   9.905
  572   HG22  ILE  70          HG22      ILE  70  -6.821  -4.961   8.767
  573   HG23  ILE  70          HG23      ILE  70  -5.911  -6.445   9.043
  574   HD11  ILE  70          HD11      ILE  70  -9.786  -8.162   8.994
  575   HD12  ILE  70          HD12      ILE  70 -10.734  -6.727   9.382
  576   HD13  ILE  70          HD13      ILE  70  -9.108  -6.916  10.040
  577    H    LEU  71           HN       LEU  71  -5.229  -4.647   7.193
  578    HA   LEU  71           HA       LEU  71  -3.111  -6.482   6.126
  579    HB2  LEU  71           HB2      LEU  71  -2.915  -3.552   6.875
  580    HB3  LEU  71           HB1      LEU  71  -1.686  -4.514   6.052
  581    HG   LEU  71           HG       LEU  71  -4.454  -3.878   4.991
  582   HD11  LEU  71          HD11      LEU  71  -3.362  -2.432   3.440
  583   HD12  LEU  71          HD12      LEU  71  -1.766  -3.012   3.911
  584   HD13  LEU  71          HD13      LEU  71  -2.712  -2.025   5.026
  585   HD21  LEU  71          HD21      LEU  71  -3.975  -5.962   4.046
  586   HD22  LEU  71          HD22      LEU  71  -2.235  -5.668   4.015
  587   HD23  LEU  71          HD23      LEU  71  -3.287  -4.870   2.848
  588    H    TYR  72           HN       TYR  72  -1.571  -7.289   7.442
  589    HA   TYR  72           HA       TYR  72  -1.531  -6.430  10.315
  590    HB2  TYR  72           HB2      TYR  72  -1.455  -9.254   9.202
  591    HB3  TYR  72           HB1      TYR  72  -1.167  -8.833  10.890
  592    HD1  TYR  72           HD1      TYR  72  -2.990  -7.652  12.191
  593    HD2  TYR  72           HD2      TYR  72  -3.668  -9.434   8.344
  594    HE1  TYR  72           HE1      TYR  72  -5.432  -7.646  12.621
  595    HE2  TYR  72           HE2      TYR  72  -6.111  -9.429   8.772
  596    HH   TYR  72           HH       TYR  72  -7.479  -9.231  11.596
  597    H    TYR  73           HN       TYR  73   0.532  -6.640  11.324
  598    HA   TYR  73           HA       TYR  73   2.814  -7.489   9.633
  599    HB2  TYR  73           HB2      TYR  73   2.614  -5.121   9.101
  600    HB3  TYR  73           HB1      TYR  73   2.537  -4.704  10.812
  601    HD1  TYR  73           HD2      TYR  73   4.722  -6.367   8.266
  602    HD2  TYR  73           HD1      TYR  73   4.513  -4.298  12.025
  603    HE1  TYR  73           HE2      TYR  73   7.200  -6.272   8.353
  604    HE2  TYR  73           HE1      TYR  73   6.989  -4.203  12.111
  605    HH   TYR  73           HH       TYR  73   8.883  -4.665  11.057
  606    H    GLN  74           HN       GLN  74   3.035  -9.167  11.153
  607    HA   GLN  74           HA       GLN  74   3.975 -10.197  13.012
  608    HB2  GLN  74           HB2      GLN  74   5.776  -8.464  12.546
  609    HB3  GLN  74           HB1      GLN  74   5.031  -7.479  13.803
  610    HG2  GLN  74           HG2      GLN  74   6.806  -8.748  14.831
  611    HG3  GLN  74           HG1      GLN  74   5.275  -9.433  15.374
  612   HE21  GLN  74          HE21      GLN  74   5.882 -11.634  15.623
  613   HE22  GLN  74          HE22      GLN  74   6.479 -12.591  14.353
  614    H    LYS  75           HN       LYS  75   1.525 -10.141  13.541
  615    HA   LYS  75           HA       LYS  75  -0.164  -9.924  15.150
  616    HB2  LYS  75           HB2      LYS  75   2.327  -9.751  16.870
  617    HB3  LYS  75           HB1      LYS  75   0.698  -9.863  17.537
  618    HG2  LYS  75           HG2      LYS  75   0.343 -11.981  16.303
  619    HG3  LYS  75           HG1      LYS  75   1.982 -11.876  15.662
  620    HD2  LYS  75           HD2      LYS  75   2.896 -11.974  17.950
  621    HD3  LYS  75           HD1      LYS  75   1.260 -12.051  18.607
  622    HE2  LYS  75           HE2      LYS  75   0.869 -14.163  17.375
  623    HE3  LYS  75           HE1      LYS  75   2.514 -14.092  16.742
  624    HZ1  LYS  75           HZ1      LYS  75   1.924 -15.417  18.923
  625    HZ2  LYS  75           HZ2      LYS  75   2.164 -13.894  19.637
  626    HZ3  LYS  75           HZ3      LYS  75   3.411 -14.621  18.742
  627    H    GLN  76           HN       GLN  76   0.431  -7.516  13.765
  628    HA   GLN  76           HA       GLN  76  -0.463  -5.573  15.816
  629    HB2  GLN  76           HB2      GLN  76   2.114  -5.506  15.485
  630    HB3  GLN  76           HB1      GLN  76   1.752  -4.784  13.918
  631    HG2  GLN  76           HG2      GLN  76   0.728  -3.724  16.571
  632    HG3  GLN  76           HG1      GLN  76   2.128  -3.083  15.713
  633   HE21  GLN  76          HE21      GLN  76  -0.660  -1.883  16.288
  634   HE22  GLN  76          HE22      GLN  76  -1.198  -1.363  14.764
  635    H    LEU  77           HN       LEU  77  -2.268  -4.691  14.989
  636    HA   LEU  77           HA       LEU  77  -2.996  -4.908  12.206
  637    HB2  LEU  77           HB2      LEU  77  -4.683  -4.819  13.987
  638    HB3  LEU  77           HB1      LEU  77  -4.155  -3.198  14.429
  639    HG   LEU  77           HG       LEU  77  -4.829  -2.353  12.218
  640   HD11  LEU  77          HD11      LEU  77  -4.558  -4.081  10.673
  641   HD12  LEU  77          HD12      LEU  77  -6.309  -4.069  10.868
  642   HD13  LEU  77          HD13      LEU  77  -5.338  -5.277  11.709
  643   HD21  LEU  77          HD21      LEU  77  -7.073  -4.011  13.395
  644   HD22  LEU  77          HD22      LEU  77  -7.202  -2.470  12.548
  645   HD23  LEU  77          HD23      LEU  77  -6.462  -2.536  14.147
  646    H    ILE  78           HN       ILE  78  -2.581  -3.517  10.543
  647    HA   ILE  78           HA       ILE  78  -1.182  -0.946  11.173
  648    HB   ILE  78           HB       ILE  78  -1.352  -2.559   8.615
  649   HG12  ILE  78          HG12      ILE  78   0.069  -3.372  10.670
  650   HG13  ILE  78          HG11      ILE  78   0.799  -3.365   9.069
  651   HG21  ILE  78          HG21      ILE  78   0.547  -0.933   7.968
  652   HG22  ILE  78          HG22      ILE  78  -0.052   0.079   9.282
  653   HG23  ILE  78          HG23      ILE  78  -1.106  -0.321   7.925
  654   HD11  ILE  78          HD11      ILE  78   2.164  -2.356  11.029
  655   HD12  ILE  78          HD12      ILE  78   1.078  -0.976  10.897
  656   HD13  ILE  78          HD13      ILE  78   2.082  -1.439   9.527
  657    H    ALA  79           HN       ALA  79  -3.531  -2.199   8.763
  658    HA   ALA  79           HA       ALA  79  -5.218   0.173   9.183
  659    HB1  ALA  79           HB1      ALA  79  -3.410   0.907   7.578
  660    HB2  ALA  79           HB2      ALA  79  -5.043   1.012   6.922
  661    HB3  ALA  79           HB3      ALA  79  -3.991  -0.321   6.455
  662    H    ILE  80           HN       ILE  80  -7.219   0.025   7.895
  663    HA   ILE  80           HA       ILE  80  -7.835  -2.779   6.999
  664    HB   ILE  80           HB       ILE  80  -9.631  -0.812   8.458
  665   HG12  ILE  80          HG12      ILE  80  -8.558  -3.507   9.339
  666   HG13  ILE  80          HG11      ILE  80  -7.849  -1.967   9.813
  667   HG21  ILE  80          HG21      ILE  80 -11.036  -3.082   8.504
  668   HG22  ILE  80          HG22      ILE  80 -10.127  -3.410   7.033
  669   HG23  ILE  80          HG23      ILE  80 -11.148  -1.978   7.137
  670   HD11  ILE  80          HD11      ILE  80 -10.633  -2.974  10.442
  671   HD12  ILE  80          HD12      ILE  80 -10.114  -1.313  10.728
  672   HD13  ILE  80          HD13      ILE  80  -9.332  -2.642  11.584
  673    H    GLY  81           HN       GLY  81  -8.579  -2.864   4.925
  674    HA2  GLY  81           HA2      GLY  81  -9.716  -0.362   3.707
  675    HA3  GLY  81           HA1      GLY  81  -8.504  -1.320   2.856
  676    H    PHE  82           HN       PHE  82 -11.817  -0.936   3.489
  677    HA   PHE  82           HA       PHE  82 -12.463  -3.641   2.407
  678    HB2  PHE  82           HB2      PHE  82 -13.925  -1.666   4.114
  679    HB3  PHE  82           HB1      PHE  82 -14.882  -2.720   3.084
  680    HD1  PHE  82           HD2      PHE  82 -11.665  -3.428   4.885
  681    HD2  PHE  82           HD1      PHE  82 -15.856  -4.268   4.554
  682    HE1  PHE  82           HE2      PHE  82 -11.416  -5.281   6.496
  683    HE2  PHE  82           HE1      PHE  82 -15.610  -6.124   6.176
  684    HZ   PHE  82           HZ       PHE  82 -13.387  -6.635   7.145
  685    H    ILE  83           HN       ILE  83 -13.074  -3.776   0.321
  686    HA   ILE  83           HA       ILE  83 -13.628  -1.225  -1.139
  687    HB   ILE  83           HB       ILE  83 -12.985  -3.986  -2.200
  688   HG12  ILE  83          HG12      ILE  83 -11.222  -1.530  -1.978
  689   HG13  ILE  83          HG11      ILE  83 -11.152  -2.900  -0.872
  690   HG21  ILE  83          HG21      ILE  83 -14.233  -2.643  -3.794
  691   HG22  ILE  83          HG22      ILE  83 -12.544  -2.697  -4.300
  692   HG23  ILE  83          HG23      ILE  83 -13.182  -1.258  -3.502
  693   HD11  ILE  83          HD11      ILE  83 -10.710  -3.048  -3.869
  694   HD12  ILE  83          HD12      ILE  83 -10.612  -4.403  -2.744
  695   HD13  ILE  83          HD13      ILE  83  -9.439  -3.089  -2.647
  696    H    ASP  84           HN       ASP  84 -15.696  -0.771  -1.580
  697    HA   ASP  84           HA       ASP  84 -17.754  -2.894  -1.372
  698    HB2  ASP  84           HB2      ASP  84 -17.846   0.123  -1.546
  699    HB3  ASP  84           HB1      ASP  84 -19.300  -0.869  -1.653
  700    H    GLU  85           HN       GLU  85 -19.620  -2.541  -3.048
  701    HA   GLU  85           HA       GLU  85 -18.939  -3.464  -5.532
  702    HB2  GLU  85           HB2      GLU  85 -21.263  -3.210  -4.656
  703    HB3  GLU  85           HB1      GLU  85 -21.169  -1.482  -5.000
  704    HG2  GLU  85           HG2      GLU  85 -20.917  -1.887  -7.361
  705    HG3  GLU  85           HG1      GLU  85 -20.732  -3.622  -7.101
  706    H    ASN  86           HN       ASN  86 -18.931  -2.407  -7.625
  707    HA   ASN  86           HA       ASN  86 -18.038  -0.917  -9.175
  708    HB2  ASN  86           HB2      ASN  86 -18.607   1.204  -7.083
  709    HB3  ASN  86           HB1      ASN  86 -18.407   1.444  -8.816
  710   HD21  ASN  86          HD21      ASN  86 -19.958  -0.807  -9.733
  711   HD22  ASN  86          HD22      ASN  86 -21.583  -0.522  -9.334
  712    H    HIS  87           HN       HIS  87 -16.500  -2.008  -6.677
  713    HA   HIS  87           HA       HIS  87 -14.261  -1.989  -6.016
  714    HB2  HIS  87           HB2      HIS  87 -13.950  -1.746  -8.557
  715    HB3  HIS  87           HB1      HIS  87 -13.721  -0.027  -8.255
  716    HD1  HIS  87           HD1      HIS  87 -12.298  -3.334  -6.989
  717    HD2  HIS  87           HD2      HIS  87 -11.122   0.614  -7.625
  718    HE1  HIS  87           HE1      HIS  87  -9.827  -3.225  -6.444
  719    H    ASP  88           HN       ASP  88 -16.336   0.269  -5.427
  720    HA   ASP  88           HA       ASP  88 -14.917   2.683  -4.922
  721    HB2  ASP  88           HB2      ASP  88 -17.384   2.478  -4.825
  722    HB3  ASP  88           HB1      ASP  88 -17.238   1.488  -3.371
  723    H    MET  89           HN       MET  89 -13.130   2.862  -3.670
  724    HA   MET  89           HA       MET  89 -12.516   0.891  -1.605
  725    HB2  MET  89           HB2      MET  89 -11.145   3.455  -2.455
  726    HB3  MET  89           HB1      MET  89 -10.505   2.348  -1.241
  727    HG2  MET  89           HG2      MET  89 -10.521   0.521  -2.914
  728    HG3  MET  89           HG1      MET  89 -11.120   1.652  -4.126
  729    HE1  MET  89           HE1      MET  89  -7.095   1.540  -2.012
  730    HE2  MET  89           HE2      MET  89  -7.775   0.092  -2.749
  731    HE3  MET  89           HE3      MET  89  -8.667   0.927  -1.483
  732    H    ASP  90           HN       ASP  90 -12.728   1.145   0.583
  733    HA   ASP  90           HA       ASP  90 -13.550   3.804   1.663
  734    HB2  ASP  90           HB2      ASP  90 -15.575   2.336   1.199
  735    HB3  ASP  90           HB1      ASP  90 -14.941   1.216   2.406
  736    H    PHE  91           HN       PHE  91 -11.821   4.175   2.985
  737    HA   PHE  91           HA       PHE  91 -10.713   1.915   4.593
  738    HB2  PHE  91           HB2      PHE  91  -9.720   4.696   3.919
  739    HB3  PHE  91           HB1      PHE  91  -8.931   3.671   5.120
  740    HD1  PHE  91           HD2      PHE  91  -7.868   1.551   4.466
  741    HD2  PHE  91           HD1      PHE  91  -9.627   4.167   1.550
  742    HE1  PHE  91           HE2      PHE  91  -6.705   0.317   2.659
  743    HE2  PHE  91           HE1      PHE  91  -8.461   2.933  -0.260
  744    HZ   PHE  91           HZ       PHE  91  -7.001   1.008   0.295
  745    H    LEU  92           HN       LEU  92 -11.640   1.685   6.563
  746    HA   LEU  92           HA       LEU  92 -12.833   4.061   7.910
  747    HB2  LEU  92           HB2      LEU  92 -13.039   1.088   8.480
  748    HB3  LEU  92           HB1      LEU  92 -13.836   2.347   9.419
  749    HG   LEU  92           HG       LEU  92 -14.914   3.141   7.261
  750   HD11  LEU  92          HD11      LEU  92 -13.499   0.678   6.262
  751   HD12  LEU  92          HD12      LEU  92 -13.751   2.230   5.465
  752   HD13  LEU  92          HD13      LEU  92 -15.079   1.084   5.586
  753   HD21  LEU  92          HD21      LEU  92 -15.506   0.342   8.252
  754   HD22  LEU  92          HD22      LEU  92 -16.615   1.317   7.293
  755   HD23  LEU  92          HD23      LEU  92 -16.155   1.840   8.911
  756    H    TYR  93           HN       TYR  93 -10.005   2.139   7.964
  757    HA   TYR  93           HA       TYR  93  -9.170   3.501  10.461
  758    HB2  TYR  93           HB2      TYR  93 -10.147   1.196  11.035
  759    HB3  TYR  93           HB1      TYR  93  -8.773   0.517  10.166
  760    HD1  TYR  93           HD2      TYR  93  -9.653   2.885  12.913
  761    HD2  TYR  93           HD1      TYR  93  -6.665   0.300  11.225
  762    HE1  TYR  93           HE2      TYR  93  -8.226   3.230  14.911
  763    HE2  TYR  93           HE1      TYR  93  -5.238   0.647  13.224
  764    HH   TYR  93           HH       TYR  93  -4.938   1.976  15.059
  765    H    LEU  94           HN       LEU  94  -7.189   4.306  10.115
  766    HA   LEU  94           HA       LEU  94  -5.285   2.805   8.374
  767    HB2  LEU  94           HB2      LEU  94  -6.233   4.534   6.940
  768    HB3  LEU  94           HB1      LEU  94  -5.960   5.754   8.178
  769    HG   LEU  94           HG       LEU  94  -3.544   5.489   7.980
  770   HD11  LEU  94          HD11      LEU  94  -4.329   3.166   6.225
  771   HD12  LEU  94          HD12      LEU  94  -3.140   3.227   7.525
  772   HD13  LEU  94          HD13      LEU  94  -2.783   3.978   5.972
  773   HD21  LEU  94          HD21      LEU  94  -4.879   5.695   5.262
  774   HD22  LEU  94          HD22      LEU  94  -3.258   6.269   5.652
  775   HD23  LEU  94          HD23      LEU  94  -4.664   7.021   6.405
  776    H    HIS  95           HN       HIS  95  -3.874   2.234   9.982
  777    HA   HIS  95           HA       HIS  95  -2.785   4.446  11.694
  778    HB2  HIS  95           HB2      HIS  95  -4.098   2.680  12.925
  779    HB3  HIS  95           HB1      HIS  95  -2.877   1.511  12.415
  780    HD1  HIS  95           HD1      HIS  95  -0.296   2.322  13.049
  781    HD2  HIS  95           HD2      HIS  95  -3.416   3.959  15.275
  782    HE1  HIS  95           HE1      HIS  95   0.743   3.242  15.168
  783    H    ASN  96           HN       ASN  96  -0.806   4.963  10.977
  784    HA   ASN  96           HA       ASN  96   0.785   3.097   9.399
  785    HB2  ASN  96           HB2      ASN  96   1.267   5.886  10.465
  786    HB3  ASN  96           HB1      ASN  96   2.488   4.997   9.554
  787   HD21  ASN  96          HD21      ASN  96   1.314   7.427   8.549
  788   HD22  ASN  96          HD22      ASN  96   0.394   7.041   7.175
  789    H    THR  97           HN       THR  97   3.209   2.914  10.076
  790    HA   THR  97           HA       THR  97   3.364   1.404  12.486
  791    HB   THR  97           HB       THR  97   5.699   2.751  11.113
  792    HG1  THR  97           HG1      THR  97   5.513   0.472  10.058
  793   HG21  THR  97          HG21      THR  97   5.946   1.415  13.289
  794   HG22  THR  97          HG22      THR  97   6.962   0.917  11.936
  795   HG23  THR  97          HG23      THR  97   5.511  -0.004  12.335
  796    H    VAL  98           HN       VAL  98   4.339   4.764  11.754
  797    HA   VAL  98           HA       VAL  98   5.295   5.222  14.469
  798    HB   VAL  98           HB       VAL  98   5.056   7.730  13.556
  799   HG11  VAL  98          HG11      VAL  98   7.207   6.746  13.969
  800   HG12  VAL  98          HG12      VAL  98   7.242   7.382  12.325
  801   HG13  VAL  98          HG13      VAL  98   7.040   5.651  12.596
  802   HG21  VAL  98          HG21      VAL  98   3.693   6.686  11.562
  803   HG22  VAL  98          HG22      VAL  98   5.282   6.256  10.934
  804   HG23  VAL  98          HG23      VAL  98   4.880   7.946  11.226
  805    H    MET  99           HN       MET  99   3.037   7.490  13.031
  806    HA   MET  99           HA       MET  99   1.136   6.970  15.289
  807    HB2  MET  99           HB2      MET  99   0.634   9.517  14.948
  808    HB3  MET  99           HB1      MET  99   2.081   9.046  15.837
  809    HG2  MET  99           HG2      MET  99   3.486   9.435  13.939
  810    HG3  MET  99           HG1      MET  99   2.098   9.582  12.859
  811    HE1  MET  99           HE1      MET  99   3.011  12.096  11.960
  812    HE2  MET  99           HE2      MET  99   4.365  11.427  12.869
  813    HE3  MET  99           HE3      MET  99   3.866  13.094  13.143
  814    HA   PRO 100           HA       PRO 100  -1.940   6.522  12.138
  815    HB2  PRO 100           HB2      PRO 100  -4.203   7.320  13.477
  816    HB3  PRO 100           HB1      PRO 100  -3.390   5.772  13.784
  817    HG2  PRO 100           HG2      PRO 100  -3.218   8.334  15.314
  818    HG3  PRO 100           HG1      PRO 100  -3.325   6.668  15.914
  819    HD2  PRO 100           HD2      PRO 100  -0.960   8.032  15.812
  820    HD3  PRO 100           HD1      PRO 100  -1.056   6.267  15.618
  821    H    LEU 101           HN       LEU 101  -3.210   7.717  10.639
  822    HA   LEU 101           HA       LEU 101  -2.770  10.678  10.735
  823    HB2  LEU 101           HB2      LEU 101  -3.557   8.959   8.365
  824    HB3  LEU 101           HB1      LEU 101  -2.984  10.626   8.334
  825    HG   LEU 101           HG       LEU 101  -1.371   8.233   9.264
  826   HD11  LEU 101          HD11      LEU 101  -0.003   8.916   7.184
  827   HD12  LEU 101          HD12      LEU 101  -1.435   9.822   6.694
  828   HD13  LEU 101          HD13      LEU 101  -1.525   8.072   6.907
  829   HD21  LEU 101          HD21      LEU 101  -0.538  10.090  10.468
  830   HD22  LEU 101          HD22      LEU 101  -0.817  11.201   9.128
  831   HD23  LEU 101          HD23      LEU 101   0.500  10.031   9.046
  832    H    LEU 102           HN       LEU 102  -5.187   8.154  10.667
  833    HA   LEU 102           HA       LEU 102  -7.274  10.007  11.382
  834    HB2  LEU 102           HB2      LEU 102  -8.655   9.739   9.327
  835    HB3  LEU 102           HB1      LEU 102  -7.165  10.633   9.040
  836    HG   LEU 102           HG       LEU 102  -6.350   8.009   8.572
  837   HD11  LEU 102          HD11      LEU 102  -8.790   7.329   8.737
  838   HD12  LEU 102          HD12      LEU 102  -7.994   6.899   7.224
  839   HD13  LEU 102          HD13      LEU 102  -9.076   8.290   7.285
  840   HD21  LEU 102          HD21      LEU 102  -6.501   8.629   6.150
  841   HD22  LEU 102          HD22      LEU 102  -5.765   9.883   7.149
  842   HD23  LEU 102          HD23      LEU 102  -7.436  10.052   6.614
  843    H    ASP 103           HN       ASP 103  -9.021   8.891  12.238
  844    HA   ASP 103           HA       ASP 103  -9.706   6.197  11.474
  845    HB2  ASP 103           HB2      ASP 103  -9.132   5.118  13.661
  846    HB3  ASP 103           HB1      ASP 103  -7.708   5.592  12.736
  847    H    GLN 104           HN       GLN 104 -11.888   6.189  11.786
  848    HA   GLN 104           HA       GLN 104 -13.017   7.993  13.895
  849    HB2  GLN 104           HB2      GLN 104 -14.308   6.695  11.476
  850    HB3  GLN 104           HB1      GLN 104 -15.120   7.772  12.610
  851    HG2  GLN 104           HG2      GLN 104 -12.690   8.515  10.955
  852    HG3  GLN 104           HG1      GLN 104 -14.348   8.976  10.572
  853   HE21  GLN 104          HE21      GLN 104 -11.714  10.425  11.697
  854   HE22  GLN 104          HE22      GLN 104 -12.363  11.435  12.896
  855    H    ARG 105           HN       ARG 105 -13.431   6.981  15.731
  856    HA   ARG 105           HA       ARG 105 -13.839   4.124  15.960
  857    HB2  ARG 105           HB2      ARG 105 -14.273   6.378  17.943
  858    HB3  ARG 105           HB1      ARG 105 -14.229   4.664  18.350
  859    HG2  ARG 105           HG2      ARG 105 -11.919   5.996  16.927
  860    HG3  ARG 105           HG1      ARG 105 -12.054   6.035  18.683
  861    HD2  ARG 105           HD2      ARG 105 -12.205   3.526  18.665
  862    HD3  ARG 105           HD1      ARG 105 -11.882   3.569  16.933
  863    HE   ARG 105           HE       ARG 105  -9.904   4.938  18.645
  864   HH11  ARG 105          HH21      ARG 105 -10.876   2.148  16.847
  865   HH12  ARG 105          HH22      ARG 105  -9.274   1.506  16.735
  866   HH21  ARG 105          HH11      ARG 105  -7.816   4.098  18.515
  867   HH22  ARG 105          HH12      ARG 105  -7.544   2.604  17.681
  868    H    TYR 106           HN       TYR 106 -15.947   6.967  16.030
  869    HA   TYR 106           HA       TYR 106 -18.331   5.671  16.855
  870    HB2  TYR 106           HB2      TYR 106 -19.423   7.642  16.243
  871    HB3  TYR 106           HB1      TYR 106 -17.767   8.219  16.411
  872    HD1  TYR 106           HD2      TYR 106 -20.375   7.185  13.998
  873    HD2  TYR 106           HD1      TYR 106 -16.484   8.939  14.479
  874    HE1  TYR 106           HE2      TYR 106 -20.398   7.880  11.619
  875    HE2  TYR 106           HE1      TYR 106 -16.507   9.632  12.095
  876    HH   TYR 106           HH       TYR 106 -19.340   9.522  10.175
  877    H    LEU 107           HN       LEU 107 -16.982   6.193  13.621
  878    HA   LEU 107           HA       LEU 107 -19.107   4.996  12.170
  879    HB2  LEU 107           HB2      LEU 107 -17.380   6.371  11.097
  880    HB3  LEU 107           HB1      LEU 107 -16.151   5.174  11.500
  881    HG   LEU 107           HG       LEU 107 -17.270   3.511  10.087
  882   HD11  LEU 107          HD11      LEU 107 -19.142   4.529   8.543
  883   HD12  LEU 107          HD12      LEU 107 -19.352   5.675   9.867
  884   HD13  LEU 107          HD13      LEU 107 -19.565   3.948  10.151
  885   HD21  LEU 107          HD21      LEU 107 -15.608   5.018   9.064
  886   HD22  LEU 107          HD22      LEU 107 -16.888   6.168   8.675
  887   HD23  LEU 107          HD23      LEU 107 -16.863   4.582   7.904
  888    H    LEU 108           HN       LEU 108 -16.119   3.608  13.529
  889    HA   LEU 108           HA       LEU 108 -16.797   0.937  12.541
  890    HB2  LEU 108           HB2      LEU 108 -14.676   1.982  14.422
  891    HB3  LEU 108           HB1      LEU 108 -14.820   0.278  13.995
  892    HG   LEU 108           HG       LEU 108 -14.537   2.499  11.944
  893   HD11  LEU 108          HD11      LEU 108 -12.192   2.000  11.816
  894   HD12  LEU 108          HD12      LEU 108 -12.357   0.634  12.919
  895   HD13  LEU 108          HD13      LEU 108 -12.559   2.280  13.517
  896   HD21  LEU 108          HD21      LEU 108 -13.645   0.347  10.656
  897   HD22  LEU 108          HD22      LEU 108 -15.370   0.659  10.764
  898   HD23  LEU 108          HD23      LEU 108 -14.625  -0.516  11.841
  899    H    THR 109           HN       THR 109 -17.845   2.820  15.116
  900    HA   THR 109           HA       THR 109 -18.718   0.384  16.652
  901    HB   THR 109           HB       THR 109 -18.714   1.805  18.664
  902    HG1  THR 109           HG1      THR 109 -18.548   3.722  16.812
  903   HG21  THR 109          HG21      THR 109 -16.177   1.664  17.037
  904   HG22  THR 109          HG22      THR 109 -16.663   0.660  18.403
  905   HG23  THR 109          HG23      THR 109 -16.183   2.336  18.667
  906    H    GLY 110           HN       GLY 110 -19.760   2.449  14.451
  907    HA2  GLY 110           HA2      GLY 110 -22.083   3.670  15.595
  908    HA3  GLY 110           HA1      GLY 110 -21.829   3.381  13.876
  909    H    GLY 111           HN       GLY 111 -24.354   3.077  14.773
  910    HA2  GLY 111           HA2      GLY 111 -26.035   1.440  14.311
  911    HA3  GLY 111           HA1      GLY 111 -24.812   0.173  14.428
  912    H    GLN 112           HN       GLN 112 -24.351   2.229  16.988
  913    HA   GLN 112           HA       GLN 112 -26.172   0.669  18.799
  914    HB2  GLN 112           HB2      GLN 112 -23.811  -0.089  19.010
  915    HB3  GLN 112           HB1      GLN 112 -23.329   1.569  19.376
  916    HG2  GLN 112           HG2      GLN 112 -24.701   1.587  21.376
  917    HG3  GLN 112           HG1      GLN 112 -25.368   0.003  20.981
  918   HE21  GLN 112          HE21      GLN 112 -23.989   0.454  23.446
  919   HE22  GLN 112          HE22      GLN 112 -22.541  -0.432  23.422
  920    H    LEU 113           HN       LEU 113 -24.321   3.653  18.295
  921    HA   LEU 113           HA       LEU 113 -25.665   5.006  20.503
  922    HB2  LEU 113           HB2      LEU 113 -23.715   5.839  18.363
  923    HB3  LEU 113           HB1      LEU 113 -24.500   7.054  19.371
  924    HG   LEU 113           HG       LEU 113 -22.264   6.275  20.243
  925   HD11  LEU 113          HD11      LEU 113 -24.243   5.364  22.303
  926   HD12  LEU 113          HD12      LEU 113 -24.427   7.004  21.684
  927   HD13  LEU 113          HD13      LEU 113 -22.915   6.513  22.439
  928   HD21  LEU 113          HD21      LEU 113 -21.984   4.051  21.059
  929   HD22  LEU 113          HD22      LEU 113 -22.715   3.875  19.464
  930   HD23  LEU 113          HD23      LEU 113 -23.707   3.701  20.911
  931    H    GLU 114           HN       GLU 114 -27.390   6.333  20.412
  932    HA   GLU 114           HA       GLU 114 -28.427   7.344  17.856
  933    HB2  GLU 114           HB2      GLU 114 -29.401   5.055  18.002
  934    HB3  GLU 114           HB1      GLU 114 -30.093   5.470  19.570
  935    HG2  GLU 114           HG2      GLU 114 -31.405   7.271  18.545
  936    HG3  GLU 114           HG1      GLU 114 -30.679   6.928  16.975
  937    H    HIS 115           HN       HIS 115 -28.809   6.928  21.355
  938    HA   HIS 115           HA       HIS 115 -30.040   9.668  21.488
  939    HB2  HIS 115           HB2      HIS 115 -31.542   7.756  22.164
  940    HB3  HIS 115           HB1      HIS 115 -30.413   7.412  23.475
  941    HD1  HIS 115           HD1      HIS 115 -30.277   9.123  25.424
  942    HD2  HIS 115           HD2      HIS 115 -33.072  10.139  22.503
  943    HE1  HIS 115           HE1      HIS 115 -31.684  10.992  26.397
  944    H    HIS 116           HN       HIS 116 -28.750  11.118  22.425
  945    HA   HIS 116           HA       HIS 116 -27.335  10.640  24.885
  946    HB2  HIS 116           HB2      HIS 116 -25.788   9.447  23.338
  947    HB3  HIS 116           HB1      HIS 116 -25.623  10.925  22.389
  948    HD1  HIS 116           HD1      HIS 116 -25.181   9.851  26.030
  949    HD2  HIS 116           HD2      HIS 116 -23.534  12.504  23.268
  950    HE1  HIS 116           HE1      HIS 116 -23.242  10.988  27.197
  951    H    HIS 117           HN       HIS 117 -29.116  12.530  24.470
  952    HA   HIS 117           HA       HIS 117 -27.950  14.979  23.362
  953    HB2  HIS 117           HB2      HIS 117 -30.399  14.451  23.243
  954    HB3  HIS 117           HB1      HIS 117 -30.483  14.634  24.996
  955    HD1  HIS 117           HD1      HIS 117 -30.130  17.034  25.970
  956    HD2  HIS 117           HD2      HIS 117 -30.159  16.881  21.804
  957    HE1  HIS 117           HE1      HIS 117 -30.325  19.428  25.166
  958    H    HIS 118           HN       HIS 118 -26.789  16.454  24.504
  959    HA   HIS 118           HA       HIS 118 -26.431  15.998  27.415
  960    HB2  HIS 118           HB2      HIS 118 -24.524  17.525  27.191
  961    HB3  HIS 118           HB1      HIS 118 -24.435  16.254  25.973
  962    HD1  HIS 118           HD1      HIS 118 -25.385  16.964  23.521
  963    HD2  HIS 118           HD2      HIS 118 -24.500  20.090  26.135
  964    HE1  HIS 118           HE1      HIS 118 -25.201  19.054  22.102
  965    H    HIS 119           HN       HIS 119 -27.680  17.126  28.791
  966    HA   HIS 119           HA       HIS 119 -29.347  19.336  28.011
  967    HB2  HIS 119           HB2      HIS 119 -28.495  18.222  30.691
  968    HB3  HIS 119           HB1      HIS 119 -29.599  19.590  30.547
  969    HD1  HIS 119           HD1      HIS 119 -29.312  15.933  29.563
  970    HD2  HIS 119           HD2      HIS 119 -32.227  18.892  29.915
  971    HE1  HIS 119           HE1      HIS 119 -31.546  14.782  29.237
  972    H    HIS 120           HN       HIS 120 -26.211  19.102  29.637
  973    HA   HIS 120           HA       HIS 120 -25.905  21.802  30.423
  974    HB2  HIS 120           HB2      HIS 120 -24.378  19.959  31.080
  975    HB3  HIS 120           HB1      HIS 120 -23.770  19.890  29.427
  976    HD1  HIS 120           HD1      HIS 120 -24.148  22.500  32.190
  977    HD2  HIS 120           HD2      HIS 120 -21.595  21.537  29.039
  978    HE1  HIS 120           HE1      HIS 120 -22.232  24.153  32.290
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1  -6.789  -8.090  18.985
    2    H2   MET   1           HT2      MET   1  -8.276  -7.276  18.873
    3    H3   MET   1           HT3      MET   1  -7.684  -8.156  17.546
    4    HA   MET   1           HA       MET   1  -7.971 -10.222  18.686
    5    HB2  MET   1           HB2      MET   1  -8.781  -8.420  20.991
    6    HB3  MET   1           HB1      MET   1  -9.046 -10.164  20.969
    7    HG2  MET   1           HG2      MET   1  -6.622 -10.536  20.705
    8    HG3  MET   1           HG1      MET   1  -6.351  -8.793  20.719
    9    HE1  MET   1           HE1      MET   1  -4.879  -9.972  24.061
   10    HE2  MET   1           HE2      MET   1  -4.783  -8.572  22.995
   11    HE3  MET   1           HE3      MET   1  -4.689 -10.195  22.316
   12    H    THR   2           HN       THR   2 -10.210  -7.597  19.593
   13    HA   THR   2           HA       THR   2 -12.447  -9.094  18.300
   14    HB   THR   2           HB       THR   2 -13.837  -7.295  19.476
   15    HG1  THR   2           HG1      THR   2 -12.718  -6.251  21.186
   16   HG21  THR   2          HG21      THR   2 -13.477  -8.363  21.734
   17   HG22  THR   2          HG22      THR   2 -12.090  -9.205  21.042
   18   HG23  THR   2          HG23      THR   2 -13.709  -9.505  20.410
   19    H    LEU   3           HN       LEU   3 -10.199  -6.879  17.413
   20    HA   LEU   3           HA       LEU   3 -11.692  -4.780  16.157
   21    HB2  LEU   3           HB2      LEU   3  -9.051  -5.952  15.200
   22    HB3  LEU   3           HB1      LEU   3  -9.661  -4.323  14.912
   23    HG   LEU   3           HG       LEU   3  -8.973  -5.474  17.633
   24   HD11  LEU   3          HD11      LEU   3  -7.564  -3.233  16.174
   25   HD12  LEU   3          HD12      LEU   3  -7.060  -4.914  15.998
   26   HD13  LEU   3          HD13      LEU   3  -7.010  -4.138  17.582
   27   HD21  LEU   3          HD21      LEU   3 -10.125  -2.844  16.695
   28   HD22  LEU   3          HD22      LEU   3  -9.180  -2.924  18.182
   29   HD23  LEU   3          HD23      LEU   3 -10.655  -3.872  18.027
   30    H    GLU   4           HN       GLU   4 -10.618  -7.959  15.034
   31    HA   GLU   4           HA       GLU   4 -11.475  -7.713  12.315
   32    HB2  GLU   4           HB2      GLU   4 -11.135 -10.139  14.118
   33    HB3  GLU   4           HB1      GLU   4 -11.453 -10.245  12.385
   34    HG2  GLU   4           HG2      GLU   4  -9.400  -9.009  11.898
   35    HG3  GLU   4           HG1      GLU   4  -9.094  -8.786  13.619
   36    H    LEU   5           HN       LEU   5 -13.115  -8.751  15.272
   37    HA   LEU   5           HA       LEU   5 -15.513  -9.726  14.071
   38    HB2  LEU   5           HB2      LEU   5 -14.973 -10.178  16.430
   39    HB3  LEU   5           HB1      LEU   5 -15.057  -8.457  16.803
   40    HG   LEU   5           HG       LEU   5 -17.444  -8.416  16.250
   41   HD11  LEU   5          HD11      LEU   5 -18.512 -10.775  15.885
   42   HD12  LEU   5          HD12      LEU   5 -16.891 -11.249  15.375
   43   HD13  LEU   5          HD13      LEU   5 -17.751  -9.970  14.516
   44   HD21  LEU   5          HD21      LEU   5 -18.275  -9.731  18.098
   45   HD22  LEU   5          HD22      LEU   5 -16.678  -9.137  18.549
   46   HD23  LEU   5          HD23      LEU   5 -16.882 -10.810  18.027
   47    H    GLN   6           HN       GLN   6 -14.528  -6.525  15.199
   48    HA   GLN   6           HA       GLN   6 -16.993  -5.160  14.844
   49    HB2  GLN   6           HB2      GLN   6 -14.112  -4.224  14.669
   50    HB3  GLN   6           HB1      GLN   6 -15.480  -3.117  14.552
   51    HG2  GLN   6           HG2      GLN   6 -15.056  -5.020  16.871
   52    HG3  GLN   6           HG1      GLN   6 -14.529  -3.336  16.881
   53   HE21  GLN   6          HE21      GLN   6 -16.296  -1.660  16.598
   54   HE22  GLN   6          HE22      GLN   6 -17.866  -2.029  17.132
   55    H    LEU   7           HN       LEU   7 -14.316  -5.767  12.589
   56    HA   LEU   7           HA       LEU   7 -15.352  -4.231  10.423
   57    HB2  LEU   7           HB2      LEU   7 -13.024  -5.033  10.463
   58    HB3  LEU   7           HB1      LEU   7 -13.578  -6.706  10.369
   59    HG   LEU   7           HG       LEU   7 -14.602  -6.247   8.166
   60   HD11  LEU   7          HD11      LEU   7 -13.756  -3.444   8.855
   61   HD12  LEU   7          HD12      LEU   7 -15.251  -4.015   8.113
   62   HD13  LEU   7          HD13      LEU   7 -13.775  -3.932   7.159
   63   HD21  LEU   7          HD21      LEU   7 -11.699  -5.540   8.551
   64   HD22  LEU   7          HD22      LEU   7 -12.421  -5.641   6.947
   65   HD23  LEU   7          HD23      LEU   7 -12.391  -7.061   7.993
   66    H    LYS   8           HN       LYS   8 -15.699  -7.667  11.250
   67    HA   LYS   8           HA       LYS   8 -17.269  -8.393   8.969
   68    HB2  LYS   8           HB2      LYS   8 -17.072  -9.613  11.743
   69    HB3  LYS   8           HB1      LYS   8 -17.928 -10.366  10.397
   70    HG2  LYS   8           HG2      LYS   8 -15.848 -10.372   9.069
   71    HG3  LYS   8           HG1      LYS   8 -14.987  -9.620  10.411
   72    HD2  LYS   8           HD2      LYS   8 -15.495 -11.569  11.838
   73    HD3  LYS   8           HD1      LYS   8 -16.358 -12.324  10.498
   74    HE2  LYS   8           HE2      LYS   8 -14.296 -12.353   9.162
   75    HE3  LYS   8           HE1      LYS   8 -13.422 -11.559  10.471
   76    HZ1  LYS   8           HZ1      LYS   8 -13.975 -14.298  10.134
   77    HZ2  LYS   8           HZ2      LYS   8 -14.724 -13.760  11.561
   78    HZ3  LYS   8           HZ3      LYS   8 -13.053 -13.544  11.342
   79    H    HIS   9           HN       HIS   9 -18.136  -7.324  12.234
   80    HA   HIS   9           HA       HIS   9 -20.983  -7.585  11.868
   81    HB2  HIS   9           HB2      HIS   9 -19.941  -7.506  14.106
   82    HB3  HIS   9           HB1      HIS   9 -19.425  -5.845  13.811
   83    HD1  HIS   9           HD1      HIS   9 -22.627  -7.896  14.004
   84    HD2  HIS   9           HD2      HIS   9 -21.365  -3.943  14.410
   85    HE1  HIS   9           HE1      HIS   9 -24.645  -6.576  14.781
   86    H    TYR  10           HN       TYR  10 -18.676  -4.939  11.487
   87    HA   TYR  10           HA       TYR  10 -20.534  -2.831  11.060
   88    HB2  TYR  10           HB2      TYR  10 -18.186  -2.365  11.486
   89    HB3  TYR  10           HB1      TYR  10 -17.705  -3.222  10.022
   90    HD1  TYR  10           HD1      TYR  10 -19.452  -0.221  11.327
   91    HD2  TYR  10           HD2      TYR  10 -17.877  -2.197   7.854
   92    HE1  TYR  10           HE1      TYR  10 -19.738   1.862  10.011
   93    HE2  TYR  10           HE2      TYR  10 -18.164  -0.115   6.538
   94    HH   TYR  10           HH       TYR  10 -19.116   2.907   8.069
   95    H    ILE  11           HN       ILE  11 -18.767  -4.794   8.648
   96    HA   ILE  11           HA       ILE  11 -20.105  -3.638   6.386
   97    HB   ILE  11           HB       ILE  11 -17.882  -4.883   6.367
   98   HG12  ILE  11          HG12      ILE  11 -19.920  -5.975   4.405
   99   HG13  ILE  11          HG11      ILE  11 -19.299  -4.327   4.322
  100   HG21  ILE  11          HG21      ILE  11 -19.608  -7.352   6.195
  101   HG22  ILE  11          HG22      ILE  11 -18.878  -6.827   7.710
  102   HG23  ILE  11          HG23      ILE  11 -17.855  -7.262   6.343
  103   HD11  ILE  11          HD11      ILE  11 -17.098  -5.051   3.864
  104   HD12  ILE  11          HD12      ILE  11 -18.111  -6.117   2.889
  105   HD13  ILE  11          HD13      ILE  11 -17.431  -6.696   4.410
  106    H    THR  12           HN       THR  12 -20.654  -6.611   8.247
  107    HA   THR  12           HA       THR  12 -22.733  -7.647   6.572
  108    HB   THR  12           HB       THR  12 -23.351  -8.978   8.648
  109    HG1  THR  12           HG1      THR  12 -21.693  -8.749  10.322
  110   HG21  THR  12          HG21      THR  12 -21.791  -9.958   7.126
  111   HG22  THR  12          HG22      THR  12 -21.091 -10.148   8.733
  112   HG23  THR  12          HG23      THR  12 -20.498  -8.888   7.659
  113    H    ASN  13           HN       ASN  13 -22.797  -5.581   9.459
  114    HA   ASN  13           HA       ASN  13 -25.660  -5.456   9.698
  115    HB2  ASN  13           HB2      ASN  13 -24.178  -4.839  11.554
  116    HB3  ASN  13           HB1      ASN  13 -23.508  -3.509  10.612
  117   HD21  ASN  13          HD21      ASN  13 -24.491  -2.538  12.857
  118   HD22  ASN  13          HD22      ASN  13 -26.054  -1.892  12.699
  119    H    LEU  14           HN       LEU  14 -23.271  -3.481   7.992
  120    HA   LEU  14           HA       LEU  14 -25.012  -1.393   7.182
  121    HB2  LEU  14           HB2      LEU  14 -22.576  -1.177   6.993
  122    HB3  LEU  14           HB1      LEU  14 -22.523  -2.492   5.819
  123    HG   LEU  14           HG       LEU  14 -23.839  -1.169   4.227
  124   HD11  LEU  14          HD11      LEU  14 -24.153   1.342   4.954
  125   HD12  LEU  14          HD12      LEU  14 -24.055   0.691   6.589
  126   HD13  LEU  14          HD13      LEU  14 -25.318   0.135   5.490
  127   HD21  LEU  14          HD21      LEU  14 -22.195   0.469   3.668
  128   HD22  LEU  14          HD22      LEU  14 -21.319  -0.852   4.442
  129   HD23  LEU  14          HD23      LEU  14 -21.674   0.621   5.345
  130    H    PHE  15           HN       PHE  15 -24.131  -4.445   5.581
  131    HA   PHE  15           HA       PHE  15 -26.208  -3.921   3.489
  132    HB2  PHE  15           HB2      PHE  15 -23.838  -5.797   3.638
  133    HB3  PHE  15           HB1      PHE  15 -25.100  -5.981   2.418
  134    HD1  PHE  15           HD1      PHE  15 -25.487  -4.236   0.725
  135    HD2  PHE  15           HD2      PHE  15 -22.286  -3.932   3.574
  136    HE1  PHE  15           HE1      PHE  15 -24.438  -2.455  -0.644
  137    HE2  PHE  15           HE2      PHE  15 -21.238  -2.150   2.203
  138    HZ   PHE  15           HZ       PHE  15 -22.313  -1.413   0.094
  139    H    ASN  16           HN       ASN  16 -26.007  -5.345   6.442
  140    HA   ASN  16           HA       ASN  16 -27.273  -6.947   7.574
  141    HB2  ASN  16           HB2      ASN  16 -29.090  -6.407   5.212
  142    HB3  ASN  16           HB1      ASN  16 -29.551  -7.408   6.584
  143   HD21  ASN  16          HD21      ASN  16 -28.414  -5.937   8.725
  144   HD22  ASN  16          HD22      ASN  16 -29.175  -4.423   8.822
  145    H    LEU  17           HN       LEU  17 -25.187  -7.914   5.957
  146    HA   LEU  17           HA       LEU  17 -26.168 -10.182   4.442
  147    HB2  LEU  17           HB2      LEU  17 -23.349  -9.458   5.250
  148    HB3  LEU  17           HB1      LEU  17 -23.776 -10.719   4.101
  149    HG   LEU  17           HG       LEU  17 -24.807  -7.919   3.674
  150   HD11  LEU  17          HD11      LEU  17 -22.787  -7.430   2.317
  151   HD12  LEU  17          HD12      LEU  17 -22.067  -8.942   2.868
  152   HD13  LEU  17          HD13      LEU  17 -22.389  -7.649   4.022
  153   HD21  LEU  17          HD21      LEU  17 -24.638  -8.654   1.291
  154   HD22  LEU  17          HD22      LEU  17 -25.674  -9.710   2.244
  155   HD23  LEU  17          HD23      LEU  17 -24.035 -10.215   1.841
  156    HA   PRO  18           HA       PRO  18 -26.408 -13.268   7.622
  157    HB2  PRO  18           HB2      PRO  18 -24.624 -14.926   5.864
  158    HB3  PRO  18           HB1      PRO  18 -26.184 -15.346   6.601
  159    HG2  PRO  18           HG2      PRO  18 -25.975 -14.737   4.001
  160    HG3  PRO  18           HG1      PRO  18 -27.398 -14.294   4.958
  161    HD2  PRO  18           HD2      PRO  18 -25.220 -12.549   3.927
  162    HD3  PRO  18           HD1      PRO  18 -26.914 -12.169   4.308
  163    H    ARG  19           HN       ARG  19 -25.291 -13.268   9.469
  164    HA   ARG  19           HA       ARG  19 -22.362 -12.763   9.435
  165    HB2  ARG  19           HB2      ARG  19 -24.422 -12.730  11.666
  166    HB3  ARG  19           HB1      ARG  19 -22.699 -12.449  11.912
  167    HG2  ARG  19           HG2      ARG  19 -22.783 -10.548  10.335
  168    HG3  ARG  19           HG1      ARG  19 -24.513 -10.814  10.109
  169    HD2  ARG  19           HD2      ARG  19 -23.234 -10.246  12.800
  170    HD3  ARG  19           HD1      ARG  19 -23.968  -9.005  11.784
  171    HE   ARG  19           HE       ARG  19 -25.884 -11.072  12.125
  172   HH11  ARG  19          HH21      ARG  19 -24.158  -8.693  13.983
  173   HH12  ARG  19          HH22      ARG  19 -25.423  -8.528  15.157
  174   HH21  ARG  19          HH11      ARG  19 -27.515 -10.842  13.652
  175   HH22  ARG  19          HH12      ARG  19 -27.312  -9.735  14.968
  176    H    ASP  20           HN       ASP  20 -24.628 -15.316   9.919
  177    HA   ASP  20           HA       ASP  20 -22.868 -16.975  11.581
  178    HB2  ASP  20           HB2      ASP  20 -25.411 -17.066  11.611
  179    HB3  ASP  20           HB1      ASP  20 -25.334 -17.830  10.024
  180    H    GLU  21           HN       GLU  21 -22.801 -16.078   8.396
  181    HA   GLU  21           HA       GLU  21 -21.865 -18.712   7.361
  182    HB2  GLU  21           HB2      GLU  21 -22.471 -16.067   6.008
  183    HB3  GLU  21           HB1      GLU  21 -21.806 -17.468   5.164
  184    HG2  GLU  21           HG2      GLU  21 -23.748 -18.816   5.814
  185    HG3  GLU  21           HG1      GLU  21 -24.405 -17.461   6.733
  186    H    LYS  22           HN       LYS  22 -19.798 -19.157   7.548
  187    HA   LYS  22           HA       LYS  22 -17.782 -17.150   8.154
  188    HB2  LYS  22           HB2      LYS  22 -17.619 -20.127   7.600
  189    HB3  LYS  22           HB1      LYS  22 -16.226 -19.129   8.028
  190    HG2  LYS  22           HG2      LYS  22 -17.272 -18.500  10.139
  191    HG3  LYS  22           HG1      LYS  22 -18.735 -19.380   9.710
  192    HD2  LYS  22           HD2      LYS  22 -17.417 -20.775  11.197
  193    HD3  LYS  22           HD1      LYS  22 -17.374 -21.484   9.582
  194    HE2  LYS  22           HE2      LYS  22 -15.214 -19.533  10.353
  195    HE3  LYS  22           HE1      LYS  22 -15.132 -21.184  10.961
  196    HZ1  LYS  22           HZ1      LYS  22 -14.693 -21.998   8.940
  197    HZ2  LYS  22           HZ2      LYS  22 -14.217 -20.410   8.574
  198    HZ3  LYS  22           HZ3      LYS  22 -15.771 -20.952   8.152
  199    H    TRP  23           HN       TRP  23 -16.070 -16.538   6.880
  200    HA   TRP  23           HA       TRP  23 -16.461 -16.861   3.933
  201    HB2  TRP  23           HB2      TRP  23 -14.724 -14.839   5.381
  202    HB3  TRP  23           HB1      TRP  23 -15.243 -14.799   3.699
  203    HD1  TRP  23           HD1      TRP  23 -18.328 -15.764   4.693
  204    HE1  TRP  23           HE1      TRP  23 -19.868 -13.890   5.546
  205    HE3  TRP  23           HE3      TRP  23 -14.852 -12.165   5.743
  206    HZ2  TRP  23           HZ2      TRP  23 -19.665 -11.220   6.545
  207    HZ3  TRP  23           HZ3      TRP  23 -15.558  -9.967   6.644
  208    HH2  TRP  23           HH2      TRP  23 -17.959  -9.493   7.044
  209    H    GLU  24           HN       GLU  24 -14.153 -16.484   2.837
  210    HA   GLU  24           HA       GLU  24 -12.363 -18.615   3.962
  211    HB2  GLU  24           HB2      GLU  24 -12.886 -17.652   1.132
  212    HB3  GLU  24           HB1      GLU  24 -11.523 -18.692   1.546
  213    HG2  GLU  24           HG2      GLU  24 -13.193 -20.222   0.922
  214    HG3  GLU  24           HG1      GLU  24 -13.300 -20.221   2.674
  215    H    CYS  25           HN       CYS  25 -10.621 -17.880   4.897
  216    HA   CYS  25           HA       CYS  25  -9.633 -15.159   4.402
  217    HB2  CYS  25           HB2      CYS  25  -8.398 -17.270   6.188
  218    HB3  CYS  25           HB1      CYS  25  -8.208 -15.520   6.289
  219    HG   CYS  25           HG       CYS  25 -10.412 -15.320   7.447
  220    H    GLU  26           HN       GLU  26  -7.818 -14.614   3.360
  221    HA   GLU  26           HA       GLU  26  -5.934 -16.725   2.423
  222    HB2  GLU  26           HB2      GLU  26  -7.677 -16.251   0.637
  223    HB3  GLU  26           HB1      GLU  26  -7.050 -14.604   0.570
  224    HG2  GLU  26           HG2      GLU  26  -5.901 -15.830  -1.141
  225    HG3  GLU  26           HG1      GLU  26  -4.754 -15.619   0.180
  226    H    SER  27           HN       SER  27  -4.119 -16.043   3.365
  227    HA   SER  27           HA       SER  27  -3.549 -13.144   3.623
  228    HB2  SER  27           HB2      SER  27  -2.094 -15.565   4.733
  229    HB3  SER  27           HB1      SER  27  -1.675 -13.886   5.061
  230    HG   SER  27           HG       SER  27  -4.123 -15.202   5.666
  231    H    ILE  28           HN       ILE  28  -2.404 -12.147   2.167
  232    HA   ILE  28           HA       ILE  28  -0.205 -13.570   0.729
  233    HB   ILE  28           HB       ILE  28  -2.213 -11.708  -0.595
  234   HG12  ILE  28          HG12      ILE  28  -1.819 -14.694  -0.993
  235   HG13  ILE  28          HG11      ILE  28  -3.098 -13.999   0.001
  236   HG21  ILE  28          HG21      ILE  28  -1.029 -12.334  -2.651
  237   HG22  ILE  28          HG22      ILE  28   0.041 -13.394  -1.736
  238   HG23  ILE  28          HG23      ILE  28   0.117 -11.652  -1.502
  239   HD11  ILE  28          HD11      ILE  28  -4.018 -12.813  -1.912
  240   HD12  ILE  28          HD12      ILE  28  -3.849 -14.518  -2.332
  241   HD13  ILE  28          HD13      ILE  28  -2.677 -13.342  -2.927
  242    H    GLU  29           HN       GLU  29   1.616 -12.411   0.712
  243    HA   GLU  29           HA       GLU  29   1.649  -9.744   1.966
  244    HB2  GLU  29           HB2      GLU  29   3.865 -11.579   0.990
  245    HB3  GLU  29           HB1      GLU  29   4.137 -10.023   1.774
  246    HG2  GLU  29           HG2      GLU  29   4.280 -11.526   3.572
  247    HG3  GLU  29           HG1      GLU  29   2.613 -10.973   3.675
  248    H    GLU  30           HN       GLU  30   1.597  -7.941   0.841
  249    HA   GLU  30           HA       GLU  30   2.809  -7.816  -1.878
  250    HB2  GLU  30           HB2      GLU  30  -0.021  -6.965  -1.181
  251    HB3  GLU  30           HB1      GLU  30   0.812  -6.510  -2.669
  252    HG2  GLU  30           HG2      GLU  30   1.093  -8.881  -3.257
  253    HG3  GLU  30           HG1      GLU  30   0.302  -9.354  -1.758
  254    H    VAL  31           HN       VAL  31   3.210  -5.610  -2.554
  255    HA   VAL  31           HA       VAL  31   4.260  -3.967  -0.429
  256    HB   VAL  31           HB       VAL  31   3.871  -3.356  -3.377
  257   HG11  VAL  31          HG11      VAL  31   4.130  -1.266  -2.299
  258   HG12  VAL  31          HG12      VAL  31   5.761  -1.686  -2.815
  259   HG13  VAL  31          HG13      VAL  31   5.282  -1.911  -1.131
  260   HG21  VAL  31          HG21      VAL  31   6.178  -4.455  -1.752
  261   HG22  VAL  31          HG22      VAL  31   6.379  -3.800  -3.376
  262   HG23  VAL  31          HG23      VAL  31   5.368  -5.222  -3.118
  263    H    ALA  32           HN       ALA  32   3.446  -2.167   0.487
  264    HA   ALA  32           HA       ALA  32   0.726  -1.727   0.819
  265    HB1  ALA  32           HB1      ALA  32   2.919   0.376   0.878
  266    HB2  ALA  32           HB2      ALA  32   2.472  -0.676   2.220
  267    HB3  ALA  32           HB3      ALA  32   1.331   0.529   1.629
  268    H    ASP  33           HN       ASP  33   2.864  -0.218  -1.588
  269    HA   ASP  33           HA       ASP  33   0.855   1.529  -2.697
  270    HB2  ASP  33           HB2      ASP  33   3.495   0.486  -3.772
  271    HB3  ASP  33           HB1      ASP  33   2.486   1.631  -4.658
  272    H    ASP  34           HN       ASP  34   1.465  -1.839  -3.029
  273    HA   ASP  34           HA       ASP  34   0.231  -2.111  -5.680
  274    HB2  ASP  34           HB2      ASP  34   2.011  -3.664  -4.746
  275    HB3  ASP  34           HB1      ASP  34   0.783  -4.294  -3.647
  276    H    ILE  35           HN       ILE  35  -0.970  -1.509  -2.623
  277    HA   ILE  35           HA       ILE  35  -3.646  -2.600  -3.413
  278    HB   ILE  35           HB       ILE  35  -3.970  -3.093  -0.905
  279   HG12  ILE  35          HG12      ILE  35  -0.947  -3.301  -0.916
  280   HG13  ILE  35          HG11      ILE  35  -1.771  -1.866  -0.317
  281   HG21  ILE  35          HG21      ILE  35  -3.739  -4.825  -2.658
  282   HG22  ILE  35          HG22      ILE  35  -2.985  -5.330  -1.146
  283   HG23  ILE  35          HG23      ILE  35  -1.984  -4.761  -2.483
  284   HD11  ILE  35          HD11      ILE  35  -2.811  -3.033   1.438
  285   HD12  ILE  35          HD12      ILE  35  -1.189  -3.720   1.395
  286   HD13  ILE  35          HD13      ILE  35  -2.538  -4.601   0.681
  287    H    LEU  36           HN       LEU  36  -1.835  -0.365  -1.297
  288    HA   LEU  36           HA       LEU  36  -4.284   1.219  -0.972
  289    HB2  LEU  36           HB2      LEU  36  -1.613   1.290   0.406
  290    HB3  LEU  36           HB1      LEU  36  -2.830   2.532   0.668
  291    HG   LEU  36           HG       LEU  36  -3.575  -0.386   0.934
  292   HD11  LEU  36          HD11      LEU  36  -2.099   1.332   2.931
  293   HD12  LEU  36          HD12      LEU  36  -1.740  -0.317   2.421
  294   HD13  LEU  36          HD13      LEU  36  -3.137   0.003   3.447
  295   HD21  LEU  36          HD21      LEU  36  -4.594   2.232   2.091
  296   HD22  LEU  36          HD22      LEU  36  -5.149   0.654   2.631
  297   HD23  LEU  36          HD23      LEU  36  -5.432   1.158   0.973
  298    HA   PRO  37           HA       PRO  37  -3.238   4.393  -3.865
  299    HB2  PRO  37           HB2      PRO  37  -3.788   6.381  -1.694
  300    HB3  PRO  37           HB1      PRO  37  -4.508   6.251  -3.309
  301    HG2  PRO  37           HG2      PRO  37  -5.856   5.516  -1.127
  302    HG3  PRO  37           HG1      PRO  37  -6.010   4.631  -2.657
  303    HD2  PRO  37           HD2      PRO  37  -4.530   3.862  -0.177
  304    HD3  PRO  37           HD1      PRO  37  -5.405   2.863  -1.355
  305    H    ASP  38           HN       ASP  38  -1.531   5.681  -4.459
  306    HA   ASP  38           HA       ASP  38   0.964   5.399  -3.112
  307    HB2  ASP  38           HB2      ASP  38   0.038   7.252  -5.326
  308    HB3  ASP  38           HB1      ASP  38   1.712   7.186  -4.773
  309    H    GLN  39           HN       GLN  39  -1.396   8.027  -3.152
  310    HA   GLN  39           HA       GLN  39   0.239   9.970  -1.799
  311    HB2  GLN  39           HB2      GLN  39  -1.832  10.508  -3.103
  312    HB3  GLN  39           HB1      GLN  39  -2.794   9.744  -1.838
  313    HG2  GLN  39           HG2      GLN  39  -0.828  11.924  -1.124
  314    HG3  GLN  39           HG1      GLN  39  -2.413  12.344  -1.767
  315   HE21  GLN  39          HE21      GLN  39  -4.313  11.148  -0.565
  316   HE22  GLN  39          HE22      GLN  39  -4.164  11.019   1.121
  317    H    TYR  40           HN       TYR  40  -1.939   7.435  -0.721
  318    HA   TYR  40           HA       TYR  40  -1.688   8.248   2.116
  319    HB2  TYR  40           HB2      TYR  40  -3.302   6.203   0.587
  320    HB3  TYR  40           HB1      TYR  40  -3.131   6.045   2.334
  321    HD1  TYR  40           HD2      TYR  40  -4.345   8.264  -0.390
  322    HD2  TYR  40           HD1      TYR  40  -4.243   7.532   3.841
  323    HE1  TYR  40           HE2      TYR  40  -6.101   9.982  -0.049
  324    HE2  TYR  40           HE1      TYR  40  -5.997   9.251   4.182
  325    HH   TYR  40           HH       TYR  40  -7.805  10.311   2.864
  326    H    VAL  41           HN       VAL  41   0.302   6.750   0.051
  327    HA   VAL  41           HA       VAL  41   1.338   4.842   2.139
  328    HB   VAL  41           HB       VAL  41   1.385   4.614  -0.890
  329   HG11  VAL  41          HG11      VAL  41   2.582   2.391  -0.265
  330   HG12  VAL  41          HG12      VAL  41   2.934   3.179   1.271
  331   HG13  VAL  41          HG13      VAL  41   3.532   3.875  -0.234
  332   HG21  VAL  41          HG21      VAL  41  -0.658   3.879   0.507
  333   HG22  VAL  41          HG22      VAL  41   0.394   2.630   1.169
  334   HG23  VAL  41          HG23      VAL  41   0.049   2.666  -0.560
  335    H    ARG  42           HN       ARG  42   2.176   7.055  -0.513
  336    HA   ARG  42           HA       ARG  42   4.997   7.015  -0.177
  337    HB2  ARG  42           HB2      ARG  42   3.832   8.007  -2.151
  338    HB3  ARG  42           HB1      ARG  42   3.240   9.315  -1.129
  339    HG2  ARG  42           HG2      ARG  42   5.239  10.051  -2.335
  340    HG3  ARG  42           HG1      ARG  42   5.598   9.947  -0.614
  341    HD2  ARG  42           HD2      ARG  42   6.114   7.497  -2.274
  342    HD3  ARG  42           HD1      ARG  42   7.230   8.851  -2.441
  343    HE   ARG  42           HE       ARG  42   6.785   8.313   0.346
  344   HH11  ARG  42          HH21      ARG  42   8.337   7.051  -2.499
  345   HH12  ARG  42          HH22      ARG  42   9.570   6.229  -1.597
  346   HH21  ARG  42          HH11      ARG  42   8.384   7.233   1.495
  347   HH22  ARG  42          HH12      ARG  42   9.596   6.332   0.646
  348    H    LEU  43           HN       LEU  43   2.527   9.191   1.178
  349    HA   LEU  43           HA       LEU  43   4.353  10.797   2.711
  350    HB2  LEU  43           HB2      LEU  43   1.372  10.305   2.783
  351    HB3  LEU  43           HB1      LEU  43   2.134  11.243   4.068
  352    HG   LEU  43           HG       LEU  43   3.078  12.787   2.404
  353   HD11  LEU  43          HD11      LEU  43   3.404  11.408   0.491
  354   HD12  LEU  43          HD12      LEU  43   2.152  12.559   0.023
  355   HD13  LEU  43          HD13      LEU  43   1.712  10.910   0.467
  356   HD21  LEU  43          HD21      LEU  43   0.963  13.491   3.233
  357   HD22  LEU  43          HD22      LEU  43   0.102  12.262   2.306
  358   HD23  LEU  43          HD23      LEU  43   0.826  13.642   1.481
  359    H    GLY  44           HN       GLY  44   2.431   7.924   3.477
  360    HA2  GLY  44           HA2      GLY  44   3.273   7.850   6.258
  361    HA3  GLY  44           HA1      GLY  44   2.378   6.588   5.410
  362    HA   PRO  45           HA       PRO  45   7.011   5.550   5.960
  363    HB2  PRO  45           HB2      PRO  45   6.752   3.694   7.988
  364    HB3  PRO  45           HB1      PRO  45   7.069   5.417   8.271
  365    HG2  PRO  45           HG2      PRO  45   4.488   3.920   8.430
  366    HG3  PRO  45           HG1      PRO  45   5.121   5.193   9.490
  367    HD2  PRO  45           HD2      PRO  45   3.243   5.691   7.575
  368    HD3  PRO  45           HD1      PRO  45   4.448   6.903   8.065
  369    H    LEU  46           HN       LEU  46   4.028   4.003   5.453
  370    HA   LEU  46           HA       LEU  46   4.963   1.318   4.860
  371    HB2  LEU  46           HB2      LEU  46   2.447   2.672   3.835
  372    HB3  LEU  46           HB1      LEU  46   2.729   0.944   4.030
  373    HG   LEU  46           HG       LEU  46   2.609   2.976   6.283
  374   HD11  LEU  46          HD11      LEU  46   0.564   1.607   6.904
  375   HD12  LEU  46          HD12      LEU  46   0.682   0.843   5.319
  376   HD13  LEU  46          HD13      LEU  46   0.384   2.576   5.442
  377   HD21  LEU  46          HD21      LEU  46   2.529   0.737   7.620
  378   HD22  LEU  46          HD22      LEU  46   4.088   1.290   7.016
  379   HD23  LEU  46          HD23      LEU  46   3.212   0.020   6.161
  380    H    SER  47           HN       SER  47   5.810   4.054   3.482
  381    HA   SER  47           HA       SER  47   5.470   4.498   0.913
  382    HB2  SER  47           HB2      SER  47   7.436   5.364   2.017
  383    HB3  SER  47           HB1      SER  47   8.162   3.761   2.089
  384    HG   SER  47           HG       SER  47   7.745   3.933  -0.357
  385    H    ASN  48           HN       ASN  48   7.716   1.790   1.569
  386    HA   ASN  48           HA       ASN  48   6.436   0.279  -0.680
  387    HB2  ASN  48           HB2      ASN  48   9.410   0.790  -0.334
  388    HB3  ASN  48           HB1      ASN  48   8.711  -0.350  -1.484
  389   HD21  ASN  48          HD21      ASN  48  10.051   2.601  -1.531
  390   HD22  ASN  48          HD22      ASN  48   9.105   3.369  -2.713
  391    H    LYS  49           HN       LYS  49   6.480   0.115   2.322
  392    HA   LYS  49           HA       LYS  49   8.048  -2.254   2.964
  393    HB2  LYS  49           HB2      LYS  49   5.843  -0.805   4.448
  394    HB3  LYS  49           HB1      LYS  49   6.689  -2.216   5.079
  395    HG2  LYS  49           HG2      LYS  49   8.835  -1.041   4.900
  396    HG3  LYS  49           HG1      LYS  49   8.025   0.361   4.208
  397    HD2  LYS  49           HD2      LYS  49   8.266   0.924   6.492
  398    HD3  LYS  49           HD1      LYS  49   6.596   0.372   6.367
  399    HE2  LYS  49           HE2      LYS  49   7.169  -1.794   7.266
  400    HE3  LYS  49           HE1      LYS  49   8.892  -1.439   7.173
  401    HZ1  LYS  49           HZ1      LYS  49   8.414   0.451   8.726
  402    HZ2  LYS  49           HZ2      LYS  49   8.256  -1.106   9.388
  403    HZ3  LYS  49           HZ3      LYS  49   6.872  -0.219   8.955
  404    H    ILE  50           HN       ILE  50   7.324  -4.307   3.256
  405    HA   ILE  50           HA       ILE  50   4.991  -5.103   1.661
  406    HB   ILE  50           HB       ILE  50   7.054  -6.719   3.198
  407   HG12  ILE  50          HG12      ILE  50   7.531  -7.232   0.570
  408   HG13  ILE  50          HG11      ILE  50   6.869  -5.611   0.401
  409   HG21  ILE  50          HG21      ILE  50   5.069  -8.042   3.000
  410   HG22  ILE  50          HG22      ILE  50   6.169  -8.587   1.734
  411   HG23  ILE  50          HG23      ILE  50   4.819  -7.527   1.331
  412   HD11  ILE  50          HD11      ILE  50   8.535  -4.730   1.959
  413   HD12  ILE  50          HD12      ILE  50   9.342  -5.614   0.671
  414   HD13  ILE  50          HD13      ILE  50   9.152  -6.353   2.258
  415    H    LEU  51           HN       LEU  51   3.062  -5.283   2.511
  416    HA   LEU  51           HA       LEU  51   2.779  -5.840   5.448
  417    HB2  LEU  51           HB2      LEU  51   0.808  -4.441   3.618
  418    HB3  LEU  51           HB1      LEU  51   0.693  -4.622   5.368
  419    HG   LEU  51           HG       LEU  51   2.874  -3.103   3.906
  420   HD11  LEU  51          HD11      LEU  51   0.512  -2.106   3.967
  421   HD12  LEU  51          HD12      LEU  51   1.798  -1.109   4.645
  422   HD13  LEU  51          HD13      LEU  51   0.717  -2.000   5.715
  423   HD21  LEU  51          HD21      LEU  51   3.220  -2.297   6.381
  424   HD22  LEU  51          HD22      LEU  51   3.878  -3.854   5.895
  425   HD23  LEU  51          HD23      LEU  51   2.368  -3.780   6.801
  426    H    GLN  52           HN       GLN  52   1.446  -7.441   6.094
  427    HA   GLN  52           HA       GLN  52   0.768  -9.530   4.194
  428    HB2  GLN  52           HB2      GLN  52   1.417 -10.022   6.543
  429    HB3  GLN  52           HB1      GLN  52  -0.049  -9.212   7.103
  430    HG2  GLN  52           HG2      GLN  52  -1.451 -10.824   5.965
  431    HG3  GLN  52           HG1      GLN  52  -0.049 -11.565   5.195
  432   HE21  GLN  52          HE21      GLN  52  -1.785 -13.133   6.813
  433   HE22  GLN  52          HE22      GLN  52  -0.959 -13.588   8.224
  434    H    THR  53           HN       THR  53  -0.956  -9.465   2.926
  435    HA   THR  53           HA       THR  53  -3.307  -7.803   3.702
  436    HB   THR  53           HB       THR  53  -3.883  -7.767   1.387
  437    HG1  THR  53           HG1      THR  53  -2.016  -9.195   0.215
  438   HG21  THR  53          HG21      THR  53  -1.905  -6.389   2.045
  439   HG22  THR  53          HG22      THR  53  -1.883  -6.863   0.346
  440   HG23  THR  53          HG23      THR  53  -0.856  -7.701   1.509
  441    H    ASN  54           HN       ASN  54  -4.837  -8.886   4.736
  442    HA   ASN  54           HA       ASN  54  -5.310 -11.769   4.092
  443    HB2  ASN  54           HB2      ASN  54  -4.897 -11.147   6.474
  444    HB3  ASN  54           HB1      ASN  54  -6.341 -10.132   6.427
  445   HD21  ASN  54          HD21      ASN  54  -6.179 -12.369   8.190
  446   HD22  ASN  54          HD22      ASN  54  -7.288 -13.549   7.677
  447    H    THR  55           HN       THR  55  -6.479 -11.477   2.208
  448    HA   THR  55           HA       THR  55  -8.928  -9.828   2.232
  449    HB   THR  55           HB       THR  55  -7.618 -11.515   0.078
  450    HG1  THR  55           HG1      THR  55  -6.845  -9.331   0.894
  451   HG21  THR  55          HG21      THR  55 -10.187  -9.928   0.120
  452   HG22  THR  55          HG22      THR  55  -9.929 -11.579  -0.441
  453   HG23  THR  55          HG23      THR  55  -9.311 -10.221  -1.382
  454    H    TYR  56           HN       TYR  56 -10.930 -10.609   2.417
  455    HA   TYR  56           HA       TYR  56 -11.270 -13.571   2.720
  456    HB2  TYR  56           HB2      TYR  56 -13.072 -11.416   3.845
  457    HB3  TYR  56           HB1      TYR  56 -13.048 -13.133   4.250
  458    HD1  TYR  56           HD1      TYR  56 -11.289 -14.087   5.650
  459    HD2  TYR  56           HD2      TYR  56 -11.327  -9.903   4.674
  460    HE1  TYR  56           HE1      TYR  56  -9.607 -13.655   7.422
  461    HE2  TYR  56           HE2      TYR  56  -9.646  -9.475   6.448
  462    HH   TYR  56           HH       TYR  56  -9.056 -11.014   8.824
  463    H    TYR  57           HN       TYR  57 -12.657 -14.576   1.397
  464    HA   TYR  57           HA       TYR  57 -14.540 -12.927  -0.257
  465    HB2  TYR  57           HB2      TYR  57 -13.959 -14.242  -2.226
  466    HB3  TYR  57           HB1      TYR  57 -12.506 -13.477  -1.585
  467    HD1  TYR  57           HD1      TYR  57 -10.804 -14.797  -0.390
  468    HD2  TYR  57           HD2      TYR  57 -14.286 -16.646  -2.094
  469    HE1  TYR  57           HE1      TYR  57  -9.738 -17.023  -0.155
  470    HE2  TYR  57           HE2      TYR  57 -13.219 -18.873  -1.858
  471    HH   TYR  57           HH       TYR  57 -10.144 -19.264  -0.172
  472    H    SER  58           HN       SER  58 -16.506 -13.670  -0.162
  473    HA   SER  58           HA       SER  58 -17.031 -16.567   0.307
  474    HB2  SER  58           HB2      SER  58 -18.506 -16.169   2.081
  475    HB3  SER  58           HB1      SER  58 -17.178 -15.069   2.430
  476    HG   SER  58           HG       SER  58 -19.601 -14.441   1.081
  477    H    ASP  59           HN       ASP  59 -19.401 -17.017  -0.075
  478    HA   ASP  59           HA       ASP  59 -20.134 -16.179  -2.699
  479    HB2  ASP  59           HB2      ASP  59 -22.278 -17.355  -2.244
  480    HB3  ASP  59           HB1      ASP  59 -20.887 -18.323  -1.762
  481    H    THR  60           HN       THR  60 -21.137 -15.090   0.513
  482    HA   THR  60           HA       THR  60 -23.229 -13.321  -0.442
  483    HB   THR  60           HB       THR  60 -23.006 -12.324   1.883
  484    HG1  THR  60           HG1      THR  60 -20.672 -13.489   1.752
  485   HG21  THR  60          HG21      THR  60 -23.210 -15.345   1.781
  486   HG22  THR  60          HG22      THR  60 -24.511 -14.238   1.341
  487   HG23  THR  60          HG23      THR  60 -23.913 -14.282   3.000
  488    H    LEU  61           HN       LEU  61 -19.823 -12.920   0.471
  489    HA   LEU  61           HA       LEU  61 -19.705 -10.073   0.203
  490    HB2  LEU  61           HB2      LEU  61 -17.572 -12.213  -0.091
  491    HB3  LEU  61           HB1      LEU  61 -17.221 -10.488  -0.095
  492    HG   LEU  61           HG       LEU  61 -18.693 -11.898   2.151
  493   HD11  LEU  61          HD11      LEU  61 -16.488 -12.817   2.157
  494   HD12  LEU  61          HD12      LEU  61 -16.473 -11.535   3.368
  495   HD13  LEU  61          HD13      LEU  61 -15.762 -11.255   1.780
  496   HD21  LEU  61          HD21      LEU  61 -17.735  -9.709   3.310
  497   HD22  LEU  61          HD22      LEU  61 -19.218  -9.631   2.377
  498   HD23  LEU  61          HD23      LEU  61 -17.702  -9.090   1.661
  499    H    HIS  62           HN       HIS  62 -19.128 -12.705  -2.070
  500    HA   HIS  62           HA       HIS  62 -18.277 -11.078  -4.272
  501    HB2  HIS  62           HB2      HIS  62 -17.927 -13.537  -4.151
  502    HB3  HIS  62           HB1      HIS  62 -19.668 -13.783  -4.302
  503    HD1  HIS  62           HD1      HIS  62 -16.788 -12.207  -6.229
  504    HD2  HIS  62           HD2      HIS  62 -20.571 -13.814  -6.929
  505    HE1  HIS  62           HE1      HIS  62 -17.094 -12.246  -8.743
  506    H    LYS  63           HN       LYS  63 -21.430 -12.269  -3.196
  507    HA   LYS  63           HA       LYS  63 -22.977 -11.364  -5.418
  508    HB2  LYS  63           HB2      LYS  63 -23.782 -12.945  -3.652
  509    HB3  LYS  63           HB1      LYS  63 -23.837 -11.595  -2.518
  510    HG2  LYS  63           HG2      LYS  63 -25.484 -10.445  -3.878
  511    HG3  LYS  63           HG1      LYS  63 -25.344 -11.658  -5.147
  512    HD2  LYS  63           HD2      LYS  63 -27.303 -12.272  -3.949
  513    HD3  LYS  63           HD1      LYS  63 -26.057 -13.374  -3.366
  514    HE2  LYS  63           HE2      LYS  63 -25.760 -12.120  -1.347
  515    HE3  LYS  63           HE1      LYS  63 -26.712 -10.770  -1.963
  516    HZ1  LYS  63           HZ1      LYS  63 -28.338 -12.976  -2.154
  517    HZ2  LYS  63           HZ2      LYS  63 -28.451 -11.716  -1.019
  518    HZ3  LYS  63           HZ3      LYS  63 -27.578 -13.124  -0.644
  519    H    SER  64           HN       SER  64 -22.018  -9.807  -2.388
  520    HA   SER  64           HA       SER  64 -23.475  -7.341  -2.970
  521    HB2  SER  64           HB2      SER  64 -22.445  -6.509  -0.930
  522    HB3  SER  64           HB1      SER  64 -23.004  -8.152  -0.646
  523    HG   SER  64           HG       SER  64 -20.411  -7.139  -0.895
  524    H    ASN  65           HN       ASN  65 -20.700  -8.705  -4.160
  525    HA   ASN  65           HA       ASN  65 -18.935  -7.915  -5.459
  526    HB2  ASN  65           HB2      ASN  65 -20.521  -5.336  -5.540
  527    HB3  ASN  65           HB1      ASN  65 -19.270  -5.843  -6.669
  528   HD21  ASN  65          HD21      ASN  65 -20.210  -8.689  -6.693
  529   HD22  ASN  65          HD22      ASN  65 -21.643  -8.690  -7.604
  530    H    ILE  66           HN       ILE  66 -18.768  -7.709  -2.608
  531    HA   ILE  66           HA       ILE  66 -16.952  -5.332  -2.345
  532    HB   ILE  66           HB       ILE  66 -18.730  -6.610  -0.253
  533   HG12  ILE  66          HG12      ILE  66 -18.604  -3.751  -1.252
  534   HG13  ILE  66          HG11      ILE  66 -19.725  -4.948  -1.899
  535   HG21  ILE  66          HG21      ILE  66 -16.770  -6.101   0.940
  536   HG22  ILE  66          HG22      ILE  66 -17.721  -4.630   1.126
  537   HG23  ILE  66          HG23      ILE  66 -16.414  -4.691  -0.055
  538   HD11  ILE  66          HD11      ILE  66 -19.580  -4.414   1.069
  539   HD12  ILE  66          HD12      ILE  66 -20.902  -5.120   0.139
  540   HD13  ILE  66          HD13      ILE  66 -20.554  -3.398   0.008
  541    H    TYR  67           HN       TYR  67 -14.930  -5.749  -1.822
  542    HA   TYR  67           HA       TYR  67 -14.190  -8.524  -0.960
  543    HB2  TYR  67           HB2      TYR  67 -12.644  -6.547  -2.628
  544    HB3  TYR  67           HB1      TYR  67 -11.987  -8.060  -2.006
  545    HD1  TYR  67           HD2      TYR  67 -12.756 -10.222  -2.842
  546    HD2  TYR  67           HD1      TYR  67 -14.381  -6.545  -4.360
  547    HE1  TYR  67           HE2      TYR  67 -13.768 -11.454  -4.742
  548    HE2  TYR  67           HE1      TYR  67 -15.392  -7.778  -6.260
  549    HH   TYR  67           HH       TYR  67 -15.001  -9.905  -7.488
  550    HA   PRO  68           HA       PRO  68 -12.909  -5.772   2.484
  551    HB2  PRO  68           HB2      PRO  68 -13.559  -7.440   4.517
  552    HB3  PRO  68           HB1      PRO  68 -14.774  -6.459   3.673
  553    HG2  PRO  68           HG2      PRO  68 -14.148  -9.359   3.385
  554    HG3  PRO  68           HG1      PRO  68 -15.712  -8.528   3.312
  555    HD2  PRO  68           HD2      PRO  68 -14.229  -9.349   1.098
  556    HD3  PRO  68           HD1      PRO  68 -15.516  -8.120   1.055
  557    H    PHE  69           HN       PHE  69 -10.988  -5.748   3.615
  558    HA   PHE  69           HA       PHE  69  -9.483  -8.228   4.058
  559    HB2  PHE  69           HB2      PHE  69  -7.546  -7.594   2.752
  560    HB3  PHE  69           HB1      PHE  69  -8.953  -7.587   1.695
  561    HD1  PHE  69           HD1      PHE  69  -9.916  -5.482   0.873
  562    HD2  PHE  69           HD2      PHE  69  -6.441  -5.520   3.400
  563    HE1  PHE  69           HE1      PHE  69  -9.451  -3.121   0.271
  564    HE2  PHE  69           HE2      PHE  69  -5.979  -3.158   2.799
  565    HZ   PHE  69           HZ       PHE  69  -7.483  -1.960   1.234
  566    H    ILE  70           HN       ILE  70  -7.577  -7.879   5.337
  567    HA   ILE  70           HA       ILE  70  -7.446  -5.244   6.755
  568    HB   ILE  70           HB       ILE  70  -7.417  -7.990   8.052
  569   HG12  ILE  70          HG12      ILE  70  -9.363  -5.695   8.421
  570   HG13  ILE  70          HG11      ILE  70  -9.661  -7.041   7.322
  571   HG21  ILE  70          HG21      ILE  70  -6.967  -5.189   9.103
  572   HG22  ILE  70          HG22      ILE  70  -5.878  -6.568   9.221
  573   HG23  ILE  70          HG23      ILE  70  -7.374  -6.542  10.155
  574   HD11  ILE  70          HD11      ILE  70  -9.071  -7.370  10.275
  575   HD12  ILE  70          HD12      ILE  70  -9.575  -8.631   9.151
  576   HD13  ILE  70          HD13      ILE  70 -10.697  -7.348   9.597
  577    H    LEU  71           HN       LEU  71  -5.420  -4.586   7.266
  578    HA   LEU  71           HA       LEU  71  -3.159  -6.216   6.202
  579    HB2  LEU  71           HB2      LEU  71  -3.193  -3.284   6.985
  580    HB3  LEU  71           HB1      LEU  71  -1.927  -4.131   6.096
  581    HG   LEU  71           HG       LEU  71  -4.772  -3.677   5.148
  582   HD11  LEU  71          HD11      LEU  71  -2.129  -2.602   4.120
  583   HD12  LEU  71          HD12      LEU  71  -3.298  -1.680   5.065
  584   HD13  LEU  71          HD13      LEU  71  -3.724  -2.255   3.453
  585   HD21  LEU  71          HD21      LEU  71  -3.644  -4.594   2.960
  586   HD22  LEU  71          HD22      LEU  71  -4.190  -5.730   4.185
  587   HD23  LEU  71          HD23      LEU  71  -2.479  -5.314   4.071
  588    H    TYR  72           HN       TYR  72  -1.665  -7.021   7.496
  589    HA   TYR  72           HA       TYR  72  -1.557  -6.151  10.367
  590    HB2  TYR  72           HB2      TYR  72  -1.371  -8.959   9.233
  591    HB3  TYR  72           HB1      TYR  72  -1.020  -8.533  10.908
  592    HD1  TYR  72           HD2      TYR  72  -2.851  -7.314  12.241
  593    HD2  TYR  72           HD1      TYR  72  -3.593  -9.394   8.558
  594    HE1  TYR  72           HE2      TYR  72  -5.263  -7.443  12.801
  595    HE2  TYR  72           HE1      TYR  72  -6.004  -9.525   9.117
  596    HH   TYR  72           HH       TYR  72  -7.332  -9.483  11.523
  597    H    TYR  73           HN       TYR  73   0.483  -6.066  11.272
  598    HA   TYR  73           HA       TYR  73   2.824  -6.907   9.665
  599    HB2  TYR  73           HB2      TYR  73   2.331  -4.578   8.973
  600    HB3  TYR  73           HB1      TYR  73   2.484  -4.057  10.649
  601    HD1  TYR  73           HD1      TYR  73   4.312  -5.666   7.825
  602    HD2  TYR  73           HD2      TYR  73   4.622  -3.687  11.626
  603    HE1  TYR  73           HE1      TYR  73   6.773  -5.521   7.550
  604    HE2  TYR  73           HE2      TYR  73   7.083  -3.544  11.347
  605    HH   TYR  73           HH       TYR  73   8.645  -3.738   8.663
  606    H    GLN  74           HN       GLN  74   3.839  -8.144  11.033
  607    HA   GLN  74           HA       GLN  74   4.776  -9.052  12.952
  608    HB2  GLN  74           HB2      GLN  74   6.235  -7.056  12.442
  609    HB3  GLN  74           HB1      GLN  74   5.329  -6.174  13.672
  610    HG2  GLN  74           HG2      GLN  74   7.302  -7.085  14.732
  611    HG3  GLN  74           HG1      GLN  74   5.913  -8.005  15.304
  612   HE21  GLN  74          HE21      GLN  74   6.333 -10.203  15.337
  613   HE22  GLN  74          HE22      GLN  74   7.324 -11.033  14.235
  614    H    LYS  75           HN       LYS  75   2.364  -9.403  13.475
  615    HA   LYS  75           HA       LYS  75   0.631  -9.450  15.058
  616    HB2  LYS  75           HB2      LYS  75   2.957  -8.925  16.929
  617    HB3  LYS  75           HB1      LYS  75   1.398  -9.610  17.379
  618    HG2  LYS  75           HG2      LYS  75   3.288 -10.870  15.369
  619    HG3  LYS  75           HG1      LYS  75   3.195 -11.337  17.067
  620    HD2  LYS  75           HD2      LYS  75   0.661 -11.694  16.616
  621    HD3  LYS  75           HD1      LYS  75   1.106 -11.665  14.909
  622    HE2  LYS  75           HE2      LYS  75   2.708 -13.492  15.280
  623    HE3  LYS  75           HE1      LYS  75   2.275 -13.528  16.989
  624    HZ1  LYS  75           HZ1      LYS  75   0.278 -14.471  16.565
  625    HZ2  LYS  75           HZ2      LYS  75   1.115 -15.080  15.218
  626    HZ3  LYS  75           HZ3      LYS  75   0.102 -13.725  15.051
  627    H    GLN  76           HN       GLN  76   0.165  -7.268  13.929
  628    HA   GLN  76           HA       GLN  76  -0.721  -5.423  15.940
  629    HB2  GLN  76           HB2      GLN  76   1.724  -4.853  15.879
  630    HB3  GLN  76           HB1      GLN  76   1.530  -4.414  14.183
  631    HG2  GLN  76           HG2      GLN  76   1.358  -2.397  15.524
  632    HG3  GLN  76           HG1      GLN  76  -0.234  -2.766  14.867
  633   HE21  GLN  76          HE21      GLN  76   1.679  -3.715  17.788
  634   HE22  GLN  76          HE22      GLN  76   0.382  -3.540  18.870
  635    H    LEU  77           HN       LEU  77  -2.250  -4.073  15.137
  636    HA   LEU  77           HA       LEU  77  -3.165  -4.551  12.408
  637    HB2  LEU  77           HB2      LEU  77  -4.770  -4.440  14.296
  638    HB3  LEU  77           HB1      LEU  77  -4.303  -2.765  14.591
  639    HG   LEU  77           HG       LEU  77  -5.060  -2.167  12.299
  640   HD11  LEU  77          HD11      LEU  77  -6.592  -4.073  11.271
  641   HD12  LEU  77          HD12      LEU  77  -5.528  -5.137  12.186
  642   HD13  LEU  77          HD13      LEU  77  -4.862  -4.058  10.958
  643   HD21  LEU  77          HD21      LEU  77  -7.240  -3.687  13.737
  644   HD22  LEU  77          HD22      LEU  77  -7.396  -2.227  12.759
  645   HD23  LEU  77          HD23      LEU  77  -6.601  -2.152  14.330
  646    H    ILE  78           HN       ILE  78  -2.799  -3.269  10.724
  647    HA   ILE  78           HA       ILE  78  -1.468  -0.633  11.169
  648    HB   ILE  78           HB       ILE  78  -1.630  -2.416   8.708
  649   HG12  ILE  78          HG12      ILE  78  -0.143  -3.026  10.793
  650   HG13  ILE  78          HG11      ILE  78   0.567  -3.087   9.184
  651   HG21  ILE  78          HG21      ILE  78   0.207  -0.767   7.930
  652   HG22  ILE  78          HG22      ILE  78  -0.402   0.301   9.194
  653   HG23  ILE  78          HG23      ILE  78  -1.464  -0.201   7.878
  654   HD11  ILE  78          HD11      ILE  78   0.727  -0.530  10.768
  655   HD12  ILE  78          HD12      ILE  78   1.785  -1.115   9.496
  656   HD13  ILE  78          HD13      ILE  78   1.856  -1.838  11.099
  657    H    ALA  79           HN       ALA  79  -3.939  -2.146   9.058
  658    HA   ALA  79           HA       ALA  79  -5.633   0.224   9.318
  659    HB1  ALA  79           HB1      ALA  79  -3.921   0.800   7.527
  660    HB2  ALA  79           HB2      ALA  79  -5.611   0.921   7.041
  661    HB3  ALA  79           HB3      ALA  79  -4.652  -0.473   6.549
  662    H    ILE  80           HN       ILE  80  -7.688  -0.041   8.345
  663    HA   ILE  80           HA       ILE  80  -8.395  -2.813   7.466
  664    HB   ILE  80           HB       ILE  80  -9.897  -1.077   9.457
  665   HG12  ILE  80          HG12      ILE  80  -8.753  -3.863   9.780
  666   HG13  ILE  80          HG11      ILE  80  -7.883  -2.406  10.261
  667   HG21  ILE  80          HG21      ILE  80 -10.627  -3.583   7.943
  668   HG22  ILE  80          HG22      ILE  80 -11.580  -2.118   8.174
  669   HG23  ILE  80          HG23      ILE  80 -11.351  -3.240   9.514
  670   HD11  ILE  80          HD11      ILE  80  -9.564  -1.833  11.874
  671   HD12  ILE  80          HD12      ILE  80  -9.211  -3.546  12.110
  672   HD13  ILE  80          HD13      ILE  80 -10.669  -3.058  11.249
  673    H    GLY  81           HN       GLY  81  -9.776  -2.880   5.755
  674    HA2  GLY  81           HA2      GLY  81 -11.575  -0.740   5.061
  675    HA3  GLY  81           HA1      GLY  81 -10.120  -0.643   4.077
  676    H    PHE  82           HN       PHE  82 -12.429  -1.034   2.808
  677    HA   PHE  82           HA       PHE  82 -12.114  -3.767   1.706
  678    HB2  PHE  82           HB2      PHE  82 -14.513  -4.211   1.752
  679    HB3  PHE  82           HB1      PHE  82 -13.951  -3.908   3.393
  680    HD1  PHE  82           HD2      PHE  82 -15.848  -2.522   0.544
  681    HD2  PHE  82           HD1      PHE  82 -14.608  -1.911   4.608
  682    HE1  PHE  82           HE2      PHE  82 -17.507  -0.699   0.775
  683    HE2  PHE  82           HE1      PHE  82 -16.270  -0.078   4.834
  684    HZ   PHE  82           HZ       PHE  82 -17.713   0.529   2.916
  685    H    ILE  83           HN       ILE  83 -13.212  -3.972  -0.392
  686    HA   ILE  83           HA       ILE  83 -13.075  -1.393  -1.884
  687    HB   ILE  83           HB       ILE  83 -13.031  -4.258  -2.887
  688   HG12  ILE  83          HG12      ILE  83 -10.797  -2.215  -2.771
  689   HG13  ILE  83          HG11      ILE  83 -11.030  -3.455  -1.539
  690   HG21  ILE  83          HG21      ILE  83 -12.804  -1.565  -4.240
  691   HG22  ILE  83          HG22      ILE  83 -13.905  -2.887  -4.627
  692   HG23  ILE  83          HG23      ILE  83 -12.186  -3.038  -4.985
  693   HD11  ILE  83          HD11      ILE  83 -10.661  -5.217  -3.121
  694   HD12  ILE  83          HD12      ILE  83  -9.376  -4.040  -3.389
  695   HD13  ILE  83          HD13      ILE  83 -10.757  -4.102  -4.484
  696    H    ASP  84           HN       ASP  84 -14.844  -0.466  -2.570
  697    HA   ASP  84           HA       ASP  84 -17.467  -1.755  -2.281
  698    HB2  ASP  84           HB2      ASP  84 -16.851   1.009  -3.366
  699    HB3  ASP  84           HB1      ASP  84 -18.375   0.434  -2.694
  700    H    GLU  85           HN       GLU  85 -19.052  -1.115  -4.157
  701    HA   GLU  85           HA       GLU  85 -18.331  -2.651  -6.463
  702    HB2  GLU  85           HB2      GLU  85 -20.683  -2.317  -5.665
  703    HB3  GLU  85           HB1      GLU  85 -20.595  -0.635  -6.190
  704    HG2  GLU  85           HG2      GLU  85 -20.201  -1.337  -8.499
  705    HG3  GLU  85           HG1      GLU  85 -20.174  -3.029  -8.006
  706    H    ASN  86           HN       ASN  86 -18.263   0.792  -5.756
  707    HA   ASN  86           HA       ASN  86 -17.626   1.543  -8.528
  708    HB2  ASN  86           HB2      ASN  86 -18.951   3.049  -7.064
  709    HB3  ASN  86           HB1      ASN  86 -17.576   3.186  -5.969
  710   HD21  ASN  86          HD21      ASN  86 -18.509   3.789  -9.390
  711   HD22  ASN  86          HD22      ASN  86 -17.430   5.081  -9.618
  712    H    HIS  87           HN       HIS  87 -15.897  -0.258  -6.755
  713    HA   HIS  87           HA       HIS  87 -13.627  -0.659  -6.412
  714    HB2  HIS  87           HB2      HIS  87 -13.533  -0.239  -8.841
  715    HB3  HIS  87           HB1      HIS  87 -13.339   1.487  -8.544
  716    HD1  HIS  87           HD1      HIS  87 -11.566  -1.787  -7.677
  717    HD2  HIS  87           HD2      HIS  87 -10.708   2.257  -8.229
  718    HE1  HIS  87           HE1      HIS  87  -9.049  -1.553  -7.488
  719    H    ASP  88           HN       ASP  88 -15.158   1.667  -5.094
  720    HA   ASP  88           HA       ASP  88 -12.986   3.522  -4.357
  721    HB2  ASP  88           HB2      ASP  88 -15.390   4.242  -4.696
  722    HB3  ASP  88           HB1      ASP  88 -15.788   3.377  -3.209
  723    H    MET  89           HN       MET  89 -11.593   3.007  -2.827
  724    HA   MET  89           HA       MET  89 -12.085   0.855  -0.915
  725    HB2  MET  89           HB2      MET  89  -9.764   2.775  -1.294
  726    HB3  MET  89           HB1      MET  89  -9.788   1.493  -0.082
  727    HG2  MET  89           HG2      MET  89 -10.097  -0.189  -1.851
  728    HG3  MET  89           HG1      MET  89 -10.089   1.083  -3.072
  729    HE1  MET  89           HE1      MET  89  -6.760  -0.696  -3.721
  730    HE2  MET  89           HE2      MET  89  -7.959   0.314  -4.522
  731    HE3  MET  89           HE3      MET  89  -8.478  -1.101  -3.610
  732    H    ASP  90           HN       ASP  90 -12.847   1.065   1.062
  733    HA   ASP  90           HA       ASP  90 -13.180   3.801   2.241
  734    HB2  ASP  90           HB2      ASP  90 -14.749   1.234   2.612
  735    HB3  ASP  90           HB1      ASP  90 -14.980   2.672   3.609
  736    H    PHE  91           HN       PHE  91 -12.216   4.234   4.119
  737    HA   PHE  91           HA       PHE  91 -10.712   2.044   5.506
  738    HB2  PHE  91           HB2      PHE  91 -10.276   5.044   5.619
  739    HB3  PHE  91           HB1      PHE  91  -9.263   3.809   6.363
  740    HD1  PHE  91           HD2      PHE  91  -8.539   1.853   4.648
  741    HD2  PHE  91           HD1      PHE  91  -9.549   5.886   3.560
  742    HE1  PHE  91           HE2      PHE  91  -7.263   1.609   2.538
  743    HE2  PHE  91           HE1      PHE  91  -8.268   5.638   1.454
  744    HZ   PHE  91           HZ       PHE  91  -7.122   3.500   0.942
  745    H    LEU  92           HN       LEU  92 -11.511   1.403   7.370
  746    HA   LEU  92           HA       LEU  92 -13.439   3.116   8.863
  747    HB2  LEU  92           HB2      LEU  92 -12.675   0.181   9.188
  748    HB3  LEU  92           HB1      LEU  92 -13.901   1.016  10.139
  749    HG   LEU  92           HG       LEU  92 -14.982  -0.225   8.333
  750   HD11  LEU  92          HD11      LEU  92 -15.625   2.250   9.017
  751   HD12  LEU  92          HD12      LEU  92 -16.411   1.481   7.644
  752   HD13  LEU  92          HD13      LEU  92 -15.103   2.625   7.373
  753   HD21  LEU  92          HD21      LEU  92 -13.700   1.484   6.223
  754   HD22  LEU  92          HD22      LEU  92 -14.338  -0.147   6.110
  755   HD23  LEU  92          HD23      LEU  92 -12.771   0.123   6.854
  756    H    TYR  93           HN       TYR  93 -10.235   1.796   9.004
  757    HA   TYR  93           HA       TYR  93  -9.620   3.494  11.296
  758    HB2  TYR  93           HB2      TYR  93 -10.552   1.502  12.417
  759    HB3  TYR  93           HB1      TYR  93  -9.372   0.488  11.583
  760    HD1  TYR  93           HD1      TYR  93  -9.678   3.411  13.890
  761    HD2  TYR  93           HD2      TYR  93  -7.186   0.222  12.452
  762    HE1  TYR  93           HE1      TYR  93  -8.011   3.919  15.654
  763    HE2  TYR  93           HE2      TYR  93  -5.519   0.730  14.215
  764    HH   TYR  93           HH       TYR  93  -6.096   3.321  16.598
  765    H    LEU  94           HN       LEU  94  -7.876   4.425  10.462
  766    HA   LEU  94           HA       LEU  94  -5.825   2.748   9.084
  767    HB2  LEU  94           HB2      LEU  94  -6.669   4.542   7.663
  768    HB3  LEU  94           HB1      LEU  94  -6.376   5.729   8.932
  769    HG   LEU  94           HG       LEU  94  -3.972   5.366   8.794
  770   HD11  LEU  94          HD11      LEU  94  -4.815   3.102   6.989
  771   HD12  LEU  94          HD12      LEU  94  -3.683   3.077   8.343
  772   HD13  LEU  94          HD13      LEU  94  -3.215   3.820   6.820
  773   HD21  LEU  94          HD21      LEU  94  -4.939   5.525   5.937
  774   HD22  LEU  94          HD22      LEU  94  -3.572   6.353   6.680
  775   HD23  LEU  94          HD23      LEU  94  -5.219   6.838   7.081
  776    H    HIS  95           HN       HIS  95  -3.989   2.405  10.147
  777    HA   HIS  95           HA       HIS  95  -3.000   4.400  12.121
  778    HB2  HIS  95           HB2      HIS  95  -4.383   2.720  13.342
  779    HB3  HIS  95           HB1      HIS  95  -3.305   1.453  12.756
  780    HD1  HIS  95           HD1      HIS  95  -0.846   1.457  13.670
  781    HD2  HIS  95           HD2      HIS  95  -3.323   4.327  15.403
  782    HE1  HIS  95           HE1      HIS  95   0.364   2.299  15.729
  783    H    ASN  96           HN       ASN  96  -1.109   4.875  11.226
  784    HA   ASN  96           HA       ASN  96   0.598   2.763  10.014
  785    HB2  ASN  96           HB2      ASN  96   0.860   5.782  10.106
  786    HB3  ASN  96           HB1      ASN  96   2.011   4.707   9.321
  787   HD21  ASN  96          HD21      ASN  96  -0.182   6.777   8.345
  788   HD22  ASN  96          HD22      ASN  96  -0.937   5.931   7.079
  789    H    THR  97           HN       THR  97   2.796   2.567  10.661
  790    HA   THR  97           HA       THR  97   3.339   2.155  13.325
  791    HB   THR  97           HB       THR  97   5.770   2.470  12.737
  792    HG1  THR  97           HG1      THR  97   4.816   3.026  10.141
  793   HG21  THR  97          HG21      THR  97   5.684   0.766  10.808
  794   HG22  THR  97          HG22      THR  97   3.929   0.868  10.957
  795   HG23  THR  97          HG23      THR  97   4.900   0.306  12.319
  796    H    VAL  98           HN       VAL  98   2.637   3.663  14.744
  797    HA   VAL  98           HA       VAL  98   2.500   5.670  15.928
  798    HB   VAL  98           HB       VAL  98   5.415   5.973  15.192
  799   HG11  VAL  98          HG11      VAL  98   5.518   6.752  17.568
  800   HG12  VAL  98          HG12      VAL  98   3.767   6.563  17.674
  801   HG13  VAL  98          HG13      VAL  98   4.462   7.748  16.567
  802   HG21  VAL  98          HG21      VAL  98   5.802   4.433  17.182
  803   HG22  VAL  98          HG22      VAL  98   5.172   3.638  15.740
  804   HG23  VAL  98          HG23      VAL  98   4.093   4.004  17.084
  805    H    MET  99           HN       MET  99   1.370   6.149  13.627
  806    HA   MET  99           HA       MET  99   1.780   8.943  13.154
  807    HB2  MET  99           HB2      MET  99   3.774   8.137  11.948
  808    HB3  MET  99           HB1      MET  99   2.756   7.098  10.955
  809    HG2  MET  99           HG2      MET  99   2.044   8.846   9.649
  810    HG3  MET  99           HG1      MET  99   1.883   9.938  11.023
  811    HE1  MET  99           HE1      MET  99   4.407  10.370  12.459
  812    HE2  MET  99           HE2      MET  99   3.361  11.596  11.743
  813    HE3  MET  99           HE3      MET  99   5.103  11.678  11.490
  814    HA   PRO 100           HA       PRO 100  -2.155   6.657  11.651
  815    HB2  PRO 100           HB2      PRO 100  -3.847   7.787  13.540
  816    HB3  PRO 100           HB1      PRO 100  -3.042   6.216  13.738
  817    HG2  PRO 100           HG2      PRO 100  -2.241   8.895  14.802
  818    HG3  PRO 100           HG1      PRO 100  -2.232   7.313  15.608
  819    HD2  PRO 100           HD2      PRO 100   0.041   8.399  14.637
  820    HD3  PRO 100           HD1      PRO 100  -0.245   6.644  14.565
  821    H    LEU 101           HN       LEU 101  -3.443   7.654  10.164
  822    HA   LEU 101           HA       LEU 101  -3.342  10.654  10.027
  823    HB2  LEU 101           HB2      LEU 101  -4.127   8.770   7.790
  824    HB3  LEU 101           HB1      LEU 101  -3.637  10.458   7.675
  825    HG   LEU 101           HG       LEU 101  -1.869   8.134   8.493
  826   HD11  LEU 101          HD11      LEU 101  -2.391   8.342   6.053
  827   HD12  LEU 101          HD12      LEU 101  -0.685   8.605   6.419
  828   HD13  LEU 101          HD13      LEU 101  -1.738   9.980   6.091
  829   HD21  LEU 101          HD21      LEU 101  -1.115  10.000   9.759
  830   HD22  LEU 101          HD22      LEU 101  -1.432  11.125   8.440
  831   HD23  LEU 101          HD23      LEU 101  -0.084   9.994   8.329
  832    H    LEU 102           HN       LEU 102  -5.550   7.939   9.245
  833    HA   LEU 102           HA       LEU 102  -7.846   9.737   9.951
  834    HB2  LEU 102           HB2      LEU 102  -7.667   8.888   7.554
  835    HB3  LEU 102           HB1      LEU 102  -7.934   7.271   8.196
  836    HG   LEU 102           HG       LEU 102 -10.018   8.392   9.389
  837   HD11  LEU 102          HD11      LEU 102  -9.502  10.696   8.746
  838   HD12  LEU 102          HD12      LEU 102 -10.992  10.187   7.967
  839   HD13  LEU 102          HD13      LEU 102  -9.493  10.244   7.044
  840   HD21  LEU 102          HD21      LEU 102 -10.248   6.620   7.753
  841   HD22  LEU 102          HD22      LEU 102  -9.890   7.734   6.433
  842   HD23  LEU 102          HD23      LEU 102 -11.388   7.902   7.347
  843    H    ASP 103           HN       ASP 103  -8.835   9.234  11.774
  844    HA   ASP 103           HA       ASP 103  -9.263   6.405  12.531
  845    HB2  ASP 103           HB2      ASP 103  -7.702   8.388  14.203
  846    HB3  ASP 103           HB1      ASP 103  -8.522   7.006  14.925
  847    H    GLN 104           HN       GLN 104 -11.425   7.238  11.876
  848    HA   GLN 104           HA       GLN 104 -12.737   8.973  13.940
  849    HB2  GLN 104           HB2      GLN 104 -12.992   9.585  11.510
  850    HB3  GLN 104           HB1      GLN 104 -13.831   8.053  11.259
  851    HG2  GLN 104           HG2      GLN 104 -15.566   8.679  12.837
  852    HG3  GLN 104           HG1      GLN 104 -14.691  10.144  13.277
  853   HE21  GLN 104          HE21      GLN 104 -17.347  10.304  12.260
  854   HE22  GLN 104          HE22      GLN 104 -17.304  11.025  10.725
  855    H    ARG 105           HN       ARG 105 -13.646   7.868  15.526
  856    HA   ARG 105           HA       ARG 105 -14.212   5.049  15.469
  857    HB2  ARG 105           HB2      ARG 105 -15.051   7.251  17.385
  858    HB3  ARG 105           HB1      ARG 105 -15.389   5.540  17.653
  859    HG2  ARG 105           HG2      ARG 105 -13.007   5.018  17.618
  860    HG3  ARG 105           HG1      ARG 105 -12.619   6.693  17.229
  861    HD2  ARG 105           HD2      ARG 105 -12.282   6.299  19.627
  862    HD3  ARG 105           HD1      ARG 105 -13.633   7.409  19.388
  863    HE   ARG 105           HE       ARG 105 -14.611   4.711  19.509
  864   HH11  ARG 105          HH21      ARG 105 -13.252   7.251  21.446
  865   HH12  ARG 105          HH22      ARG 105 -14.039   6.725  22.898
  866   HH21  ARG 105          HH11      ARG 105 -15.629   4.037  21.395
  867   HH22  ARG 105          HH12      ARG 105 -15.378   4.912  22.868
  868    H    TYR 106           HN       TYR 106 -16.200   7.945  15.056
  869    HA   TYR 106           HA       TYR 106 -18.763   6.737  15.154
  870    HB2  TYR 106           HB2      TYR 106 -17.821   9.083  13.464
  871    HB3  TYR 106           HB1      TYR 106 -19.507   8.677  13.776
  872    HD1  TYR 106           HD1      TYR 106 -16.381   9.973  15.245
  873    HD2  TYR 106           HD2      TYR 106 -20.505   9.014  15.975
  874    HE1  TYR 106           HE1      TYR 106 -16.298  11.237  17.378
  875    HE2  TYR 106           HE2      TYR 106 -20.421  10.278  18.108
  876    HH   TYR 106           HH       TYR 106 -19.077  11.300  19.588
  877    H    LEU 107           HN       LEU 107 -16.513   7.196  12.461
  878    HA   LEU 107           HA       LEU 107 -18.166   6.079  10.422
  879    HB2  LEU 107           HB2      LEU 107 -16.156   7.417   9.911
  880    HB3  LEU 107           HB1      LEU 107 -15.130   6.196  10.662
  881    HG   LEU 107           HG       LEU 107 -15.827   4.554   8.971
  882   HD11  LEU 107          HD11      LEU 107 -17.110   5.610   6.944
  883   HD12  LEU 107          HD12      LEU 107 -17.641   6.805   8.127
  884   HD13  LEU 107          HD13      LEU 107 -18.021   5.098   8.361
  885   HD21  LEU 107          HD21      LEU 107 -13.864   5.845   8.415
  886   HD22  LEU 107          HD22      LEU 107 -14.849   7.205   7.874
  887   HD23  LEU 107          HD23      LEU 107 -14.838   5.701   6.952
  888    H    LEU 108           HN       LEU 108 -15.760   4.702  12.620
  889    HA   LEU 108           HA       LEU 108 -15.716   2.062  11.566
  890    HB2  LEU 108           HB2      LEU 108 -14.273   3.262  13.475
  891    HB3  LEU 108           HB1      LEU 108 -15.466   2.527  14.544
  892    HG   LEU 108           HG       LEU 108 -13.812   1.042  12.484
  893   HD11  LEU 108          HD11      LEU 108 -13.603   1.319  15.482
  894   HD12  LEU 108          HD12      LEU 108 -12.362   1.640  14.269
  895   HD13  LEU 108          HD13      LEU 108 -12.862  -0.018  14.604
  896   HD21  LEU 108          HD21      LEU 108 -15.761  -0.229  12.675
  897   HD22  LEU 108          HD22      LEU 108 -16.035   0.237  14.354
  898   HD23  LEU 108          HD23      LEU 108 -14.777  -0.928  13.954
  899    H    THR 109           HN       THR 109 -17.674   3.478  14.194
  900    HA   THR 109           HA       THR 109 -19.320   1.011  14.317
  901    HB   THR 109           HB       THR 109 -19.787   3.515  15.955
  902    HG1  THR 109           HG1      THR 109 -17.561   2.950  16.069
  903   HG21  THR 109          HG21      THR 109 -20.508   1.813  17.620
  904   HG22  THR 109          HG22      THR 109 -20.137   0.545  16.453
  905   HG23  THR 109          HG23      THR 109 -21.425   1.701  16.119
  906    H    GLY 110           HN       GLY 110 -19.222   3.668  12.423
  907    HA2  GLY 110           HA2      GLY 110 -21.687   4.908  12.304
  908    HA3  GLY 110           HA1      GLY 110 -20.780   4.477  10.856
  909    H    GLY 111           HN       GLY 111 -23.625   3.999  12.510
  910    HA2  GLY 111           HA2      GLY 111 -24.174   1.269  11.608
  911    HA3  GLY 111           HA1      GLY 111 -25.301   2.339  12.437
  912    H    GLN 112           HN       GLN 112 -26.727   1.374  10.752
  913    HA   GLN 112           HA       GLN 112 -26.497   1.947   7.981
  914    HB2  GLN 112           HB2      GLN 112 -28.998   1.603   7.946
  915    HB3  GLN 112           HB1      GLN 112 -28.098   0.295   8.708
  916    HG2  GLN 112           HG2      GLN 112 -29.207   2.573  10.354
  917    HG3  GLN 112           HG1      GLN 112 -30.215   1.193   9.921
  918   HE21  GLN 112          HE21      GLN 112 -28.682   2.199  12.528
  919   HE22  GLN 112          HE22      GLN 112 -28.006   0.760  13.121
  920    H    LEU 113           HN       LEU 113 -27.676   3.494   6.724
  921    HA   LEU 113           HA       LEU 113 -27.482   6.176   7.803
  922    HB2  LEU 113           HB2      LEU 113 -28.373   5.029   5.149
  923    HB3  LEU 113           HB1      LEU 113 -28.534   6.751   5.499
  924    HG   LEU 113           HG       LEU 113 -26.108   6.860   6.013
  925   HD11  LEU 113          HD11      LEU 113 -24.761   4.824   5.171
  926   HD12  LEU 113          HD12      LEU 113 -26.276   3.929   5.296
  927   HD13  LEU 113          HD13      LEU 113 -25.564   4.667   6.732
  928   HD21  LEU 113          HD21      LEU 113 -25.313   6.481   3.657
  929   HD22  LEU 113          HD22      LEU 113 -26.809   7.409   3.748
  930   HD23  LEU 113          HD23      LEU 113 -26.855   5.702   3.308
  931    H    GLU 114           HN       GLU 114 -29.062   7.526   8.435
  932    HA   GLU 114           HA       GLU 114 -31.920   6.776   8.148
  933    HB2  GLU 114           HB2      GLU 114 -31.123   5.762  10.295
  934    HB3  GLU 114           HB1      GLU 114 -30.624   7.366  10.834
  935    HG2  GLU 114           HG2      GLU 114 -32.935   8.172  10.648
  936    HG3  GLU 114           HG1      GLU 114 -33.449   6.595  10.051
  937    H    HIS 115           HN       HIS 115 -29.468   9.072   9.277
  938    HA   HIS 115           HA       HIS 115 -31.163  11.341   9.634
  939    HB2  HIS 115           HB2      HIS 115 -28.216  11.129   8.921
  940    HB3  HIS 115           HB1      HIS 115 -29.017  12.649   9.314
  941    HD1  HIS 115           HD1      HIS 115 -26.803  10.766  10.999
  942    HD2  HIS 115           HD2      HIS 115 -30.778  11.621  11.922
  943    HE1  HIS 115           HE1      HIS 115 -27.044  10.444  13.500
  944    H    HIS 116           HN       HIS 116 -29.370  10.154   6.811
  945    HA   HIS 116           HA       HIS 116 -30.285  12.375   5.127
  946    HB2  HIS 116           HB2      HIS 116 -28.047  11.303   4.820
  947    HB3  HIS 116           HB1      HIS 116 -28.857   9.819   4.317
  948    HD1  HIS 116           HD1      HIS 116 -30.103   9.854   2.016
  949    HD2  HIS 116           HD2      HIS 116 -28.103  13.401   2.912
  950    HE1  HIS 116           HE1      HIS 116 -30.062  11.215  -0.121
  951    H    HIS 117           HN       HIS 117 -32.048  12.399   3.930
  952    HA   HIS 117           HA       HIS 117 -33.344   9.899   3.030
  953    HB2  HIS 117           HB2      HIS 117 -34.356  10.366   5.243
  954    HB3  HIS 117           HB1      HIS 117 -34.814  11.975   4.681
  955    HD1  HIS 117           HD1      HIS 117 -35.298   8.357   3.551
  956    HD2  HIS 117           HD2      HIS 117 -37.322  12.002   3.531
  957    HE1  HIS 117           HE1      HIS 117 -37.584   7.902   2.559
  958    H    HIS 118           HN       HIS 118 -34.600  10.189   1.219
  959    HA   HIS 118           HA       HIS 118 -34.064  12.553  -0.378
  960    HB2  HIS 118           HB2      HIS 118 -35.867  10.159  -0.887
  961    HB3  HIS 118           HB1      HIS 118 -35.456  11.388  -2.086
  962    HD1  HIS 118           HD1      HIS 118 -32.758  11.663  -2.513
  963    HD2  HIS 118           HD2      HIS 118 -34.016   8.099  -0.754
  964    HE1  HIS 118           HE1      HIS 118 -30.844  10.024  -2.767
  965    H    HIS 119           HN       HIS 119 -35.494  14.110  -1.028
  966    HA   HIS 119           HA       HIS 119 -37.234  15.636  -0.812
  967    HB2  HIS 119           HB2      HIS 119 -38.511  13.822  -1.856
  968    HB3  HIS 119           HB1      HIS 119 -38.821  13.116  -0.269
  969    HD1  HIS 119           HD1      HIS 119 -39.288  16.548  -1.906
  970    HD2  HIS 119           HD2      HIS 119 -41.227  13.979   0.746
  971    HE1  HIS 119           HE1      HIS 119 -41.482  17.661  -1.303
  972    H    HIS 120           HN       HIS 120 -38.598  16.715   0.718
  973    HA   HIS 120           HA       HIS 120 -38.865  15.768   3.447
  974    HB2  HIS 120           HB2      HIS 120 -36.452  16.403   3.399
  975    HB3  HIS 120           HB1      HIS 120 -36.925  18.045   2.955
  976    HD1  HIS 120           HD1      HIS 120 -38.411  19.364   4.736
  977    HD2  HIS 120           HD2      HIS 120 -36.715  15.818   6.127
  978    HE1  HIS 120           HE1      HIS 120 -38.608  19.417   7.260
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1  -7.366  -8.023  20.043
    2    H2   MET   1           HT2      MET   1  -8.733  -7.481  19.194
    3    H3   MET   1           HT3      MET   1  -7.422  -8.159  18.352
    4    HA   MET   1           HA       MET   1  -8.109 -10.239  18.679
    5    HB2  MET   1           HB2      MET   1  -7.394 -10.053  21.057
    6    HB3  MET   1           HB1      MET   1  -8.979  -9.394  21.463
    7    HG2  MET   1           HG2      MET   1 -10.054 -11.464  20.674
    8    HG3  MET   1           HG1      MET   1  -8.476 -12.123  20.236
    9    HE1  MET   1           HE1      MET   1 -10.660 -13.524  22.440
   10    HE2  MET   1           HE2      MET   1  -9.293 -14.315  23.220
   11    HE3  MET   1           HE3      MET   1  -9.295 -14.097  21.471
   12    H    THR   2           HN       THR   2 -10.255  -7.719  19.938
   13    HA   THR   2           HA       THR   2 -12.619  -9.169  18.837
   14    HB   THR   2           HB       THR   2 -13.941  -7.549  20.119
   15    HG1  THR   2           HG1      THR   2 -12.728  -5.736  20.052
   16   HG21  THR   2          HG21      THR   2 -13.163  -9.555  21.293
   17   HG22  THR   2          HG22      THR   2 -13.183  -8.180  22.397
   18   HG23  THR   2          HG23      THR   2 -11.657  -8.742  21.715
   19    H    LEU   3           HN       LEU   3 -10.341  -6.972  17.879
   20    HA   LEU   3           HA       LEU   3 -11.865  -4.943  16.556
   21    HB2  LEU   3           HB2      LEU   3  -9.134  -6.112  15.927
   22    HB3  LEU   3           HB1      LEU   3  -9.790  -4.667  15.161
   23    HG   LEU   3           HG       LEU   3  -9.389  -4.986  18.153
   24   HD11  LEU   3          HD11      LEU   3  -7.762  -3.250  16.293
   25   HD12  LEU   3          HD12      LEU   3  -7.286  -4.908  16.656
   26   HD13  LEU   3          HD13      LEU   3  -7.394  -3.718  17.951
   27   HD21  LEU   3          HD21      LEU   3 -11.021  -3.325  17.949
   28   HD22  LEU   3          HD22      LEU   3 -10.432  -2.783  16.379
   29   HD23  LEU   3          HD23      LEU   3  -9.555  -2.354  17.847
   30    H    GLU   4           HN       GLU   4 -10.690  -8.126  15.489
   31    HA   GLU   4           HA       GLU   4 -11.514  -7.902  12.767
   32    HB2  GLU   4           HB2      GLU   4 -11.467 -10.427  12.831
   33    HB3  GLU   4           HB1      GLU   4  -9.995  -9.662  13.432
   34    HG2  GLU   4           HG2      GLU   4 -10.858  -9.899  15.759
   35    HG3  GLU   4           HG1      GLU   4 -12.264 -10.752  15.126
   36    H    LEU   5           HN       LEU   5 -13.214  -9.034  15.664
   37    HA   LEU   5           HA       LEU   5 -15.560  -9.982  14.348
   38    HB2  LEU   5           HB2      LEU   5 -14.930  -9.025  17.136
   39    HB3  LEU   5           HB1      LEU   5 -16.587  -9.441  16.701
   40    HG   LEU   5           HG       LEU   5 -14.366 -11.386  16.059
   41   HD11  LEU   5          HD11      LEU   5 -15.598 -10.852  18.765
   42   HD12  LEU   5          HD12      LEU   5 -13.897 -11.056  18.354
   43   HD13  LEU   5          HD13      LEU   5 -14.977 -12.447  18.340
   44   HD21  LEU   5          HD21      LEU   5 -16.656 -11.810  15.212
   45   HD22  LEU   5          HD22      LEU   5 -17.285 -11.691  16.853
   46   HD23  LEU   5          HD23      LEU   5 -16.204 -13.013  16.417
   47    H    GLN   6           HN       GLN   6 -14.705  -6.783  15.641
   48    HA   GLN   6           HA       GLN   6 -17.246  -5.562  15.213
   49    HB2  GLN   6           HB2      GLN   6 -14.446  -4.395  15.224
   50    HB3  GLN   6           HB1      GLN   6 -15.916  -3.422  15.185
   51    HG2  GLN   6           HG2      GLN   6 -16.657  -4.398  17.306
   52    HG3  GLN   6           HG1      GLN   6 -15.240  -5.448  17.340
   53   HE21  GLN   6          HE21      GLN   6 -15.155  -4.041  19.534
   54   HE22  GLN   6          HE22      GLN   6 -14.192  -2.645  19.436
   55    H    LEU   7           HN       LEU   7 -14.447  -6.025  13.079
   56    HA   LEU   7           HA       LEU   7 -15.356  -4.380  10.941
   57    HB2  LEU   7           HB2      LEU   7 -13.062  -5.256  11.042
   58    HB3  LEU   7           HB1      LEU   7 -13.663  -6.902  10.865
   59    HG   LEU   7           HG       LEU   7 -14.557  -6.353   8.636
   60   HD11  LEU   7          HD11      LEU   7 -13.633  -3.589   9.397
   61   HD12  LEU   7          HD12      LEU   7 -15.152  -4.091   8.654
   62   HD13  LEU   7          HD13      LEU   7 -13.672  -4.061   7.698
   63   HD21  LEU   7          HD21      LEU   7 -11.656  -5.743   9.202
   64   HD22  LEU   7          HD22      LEU   7 -12.287  -5.769   7.555
   65   HD23  LEU   7          HD23      LEU   7 -12.365  -7.222   8.551
   66    H    LYS   8           HN       LYS   8 -15.849  -7.850  11.598
   67    HA   LYS   8           HA       LYS   8 -17.347  -8.389   9.227
   68    HB2  LYS   8           HB2      LYS   8 -17.326  -9.715  11.947
   69    HB3  LYS   8           HB1      LYS   8 -18.209 -10.363  10.563
   70    HG2  LYS   8           HG2      LYS   8 -16.072 -10.380   9.263
   71    HG3  LYS   8           HG1      LYS   8 -15.218  -9.871  10.720
   72    HD2  LYS   8           HD2      LYS   8 -16.940 -12.359  10.622
   73    HD3  LYS   8           HD1      LYS   8 -15.218 -12.384  10.252
   74    HE2  LYS   8           HE2      LYS   8 -14.860 -11.272  12.534
   75    HE3  LYS   8           HE1      LYS   8 -16.544 -11.669  12.876
   76    HZ1  LYS   8           HZ1      LYS   8 -14.236 -13.408  12.682
   77    HZ2  LYS   8           HZ2      LYS   8 -15.650 -13.997  11.946
   78    HZ3  LYS   8           HZ3      LYS   8 -15.656 -13.581  13.594
   79    H    HIS   9           HN       HIS   9 -18.344  -7.385  12.484
   80    HA   HIS   9           HA       HIS   9 -21.161  -7.491  11.966
   81    HB2  HIS   9           HB2      HIS   9 -19.481  -5.973  13.978
   82    HB3  HIS   9           HB1      HIS   9 -21.243  -5.886  13.957
   83    HD1  HIS   9           HD1      HIS   9 -18.576  -8.631  13.962
   84    HD2  HIS   9           HD2      HIS   9 -22.388  -7.883  15.476
   85    HE1  HIS   9           HE1      HIS   9 -19.186 -10.634  15.385
   86    H    TYR  10           HN       TYR  10 -18.737  -4.898  11.690
   87    HA   TYR  10           HA       TYR  10 -20.545  -2.807  10.981
   88    HB2  TYR  10           HB2      TYR  10 -18.231  -2.336  11.623
   89    HB3  TYR  10           HB1      TYR  10 -17.635  -3.217  10.215
   90    HD1  TYR  10           HD1      TYR  10 -19.566  -0.230  11.304
   91    HD2  TYR  10           HD2      TYR  10 -17.605  -2.222   8.042
   92    HE1  TYR  10           HE1      TYR  10 -19.784   1.817   9.920
   93    HE2  TYR  10           HE2      TYR  10 -17.824  -0.177   6.659
   94    HH   TYR  10           HH       TYR  10 -18.939   2.850   8.021
   95    H    ILE  11           HN       ILE  11 -18.655  -5.054   8.952
   96    HA   ILE  11           HA       ILE  11 -19.566  -4.043   6.445
   97    HB   ILE  11           HB       ILE  11 -18.589  -6.797   7.269
   98   HG12  ILE  11          HG12      ILE  11 -17.173  -4.630   5.694
   99   HG13  ILE  11          HG11      ILE  11 -17.050  -4.765   7.449
  100   HG21  ILE  11          HG21      ILE  11 -19.812  -7.153   5.258
  101   HG22  ILE  11          HG22      ILE  11 -18.131  -6.987   4.750
  102   HG23  ILE  11          HG23      ILE  11 -19.250  -5.637   4.557
  103   HD11  ILE  11          HD11      ILE  11 -16.284  -6.892   5.429
  104   HD12  ILE  11          HD12      ILE  11 -16.252  -7.112   7.178
  105   HD13  ILE  11          HD13      ILE  11 -15.174  -5.942   6.416
  106    H    THR  12           HN       THR  12 -20.785  -6.661   8.524
  107    HA   THR  12           HA       THR  12 -22.894  -7.440   6.741
  108    HB   THR  12           HB       THR  12 -23.817  -8.577   8.790
  109    HG1  THR  12           HG1      THR  12 -22.779  -6.803  10.108
  110   HG21  THR  12          HG21      THR  12 -21.685  -9.966   9.173
  111   HG22  THR  12          HG22      THR  12 -20.913  -8.881   8.016
  112   HG23  THR  12          HG23      THR  12 -22.288  -9.870   7.519
  113    H    ASN  13           HN       ASN  13 -22.806  -5.196   9.516
  114    HA   ASN  13           HA       ASN  13 -25.631  -4.698   9.538
  115    HB2  ASN  13           HB2      ASN  13 -24.208  -4.150  11.450
  116    HB3  ASN  13           HB1      ASN  13 -23.317  -2.976  10.482
  117   HD21  ASN  13          HD21      ASN  13 -26.325  -3.544  12.222
  118   HD22  ASN  13          HD22      ASN  13 -26.939  -1.972  12.046
  119    H    LEU  14           HN       LEU  14 -22.927  -2.892   8.067
  120    HA   LEU  14           HA       LEU  14 -24.544  -0.830   6.933
  121    HB2  LEU  14           HB2      LEU  14 -21.767  -1.869   6.537
  122    HB3  LEU  14           HB1      LEU  14 -22.406  -0.816   5.281
  123    HG   LEU  14           HG       LEU  14 -21.125   0.361   7.125
  124   HD11  LEU  14          HD11      LEU  14 -22.438   2.255   6.958
  125   HD12  LEU  14          HD12      LEU  14 -23.944   1.388   7.245
  126   HD13  LEU  14          HD13      LEU  14 -23.162   1.302   5.667
  127   HD21  LEU  14          HD21      LEU  14 -21.922   0.464   9.318
  128   HD22  LEU  14          HD22      LEU  14 -22.277  -1.209   8.896
  129   HD23  LEU  14          HD23      LEU  14 -23.561  -0.001   8.863
  130    H    PHE  15           HN       PHE  15 -23.394  -3.912   5.585
  131    HA   PHE  15           HA       PHE  15 -24.958  -3.390   3.113
  132    HB2  PHE  15           HB2      PHE  15 -22.901  -5.466   3.901
  133    HB3  PHE  15           HB1      PHE  15 -23.834  -5.576   2.404
  134    HD1  PHE  15           HD1      PHE  15 -23.739  -3.663   0.752
  135    HD2  PHE  15           HD2      PHE  15 -21.026  -3.996   4.068
  136    HE1  PHE  15           HE1      PHE  15 -22.184  -2.085  -0.360
  137    HE2  PHE  15           HE2      PHE  15 -19.472  -2.416   2.952
  138    HZ   PHE  15           HZ       PHE  15 -20.051  -1.462   0.739
  139    H    ASN  16           HN       ASN  16 -25.538  -4.617   6.124
  140    HA   ASN  16           HA       ASN  16 -27.159  -6.062   7.011
  141    HB2  ASN  16           HB2      ASN  16 -28.573  -4.471   5.637
  142    HB3  ASN  16           HB1      ASN  16 -28.542  -5.673   4.346
  143   HD21  ASN  16          HD21      ASN  16 -30.968  -4.877   5.779
  144   HD22  ASN  16          HD22      ASN  16 -31.534  -6.246   6.606
  145    H    LEU  17           HN       LEU  17 -24.984  -7.412   5.955
  146    HA   LEU  17           HA       LEU  17 -26.079  -9.579   4.274
  147    HB2  LEU  17           HB2      LEU  17 -23.241  -9.169   5.237
  148    HB3  LEU  17           HB1      LEU  17 -23.771 -10.302   3.997
  149    HG   LEU  17           HG       LEU  17 -24.239  -7.327   3.795
  150   HD11  LEU  17          HD11      LEU  17 -22.290  -7.364   2.191
  151   HD12  LEU  17          HD12      LEU  17 -21.916  -8.981   2.787
  152   HD13  LEU  17          HD13      LEU  17 -21.848  -7.600   3.882
  153   HD21  LEU  17          HD21      LEU  17 -24.436  -9.660   1.885
  154   HD22  LEU  17          HD22      LEU  17 -24.303  -8.001   1.305
  155   HD23  LEU  17          HD23      LEU  17 -25.675  -8.478   2.297
  156    HA   PRO  18           HA       PRO  18 -26.750 -12.457   7.592
  157    HB2  PRO  18           HB2      PRO  18 -25.066 -14.400   6.049
  158    HB3  PRO  18           HB1      PRO  18 -26.699 -14.605   6.712
  159    HG2  PRO  18           HG2      PRO  18 -26.297 -14.218   4.106
  160    HG3  PRO  18           HG1      PRO  18 -27.694 -13.514   4.943
  161    HD2  PRO  18           HD2      PRO  18 -25.210 -12.160   3.970
  162    HD3  PRO  18           HD1      PRO  18 -26.869 -11.545   4.114
  163    H    ARG  19           HN       ARG  19 -25.737 -12.831   9.512
  164    HA   ARG  19           HA       ARG  19 -22.821 -12.359   9.709
  165    HB2  ARG  19           HB2      ARG  19 -24.387 -11.216  11.265
  166    HB3  ARG  19           HB1      ARG  19 -24.903 -12.787  11.877
  167    HG2  ARG  19           HG2      ARG  19 -22.645 -13.272  12.655
  168    HG3  ARG  19           HG1      ARG  19 -22.046 -11.769  11.948
  169    HD2  ARG  19           HD2      ARG  19 -23.523 -10.475  13.430
  170    HD3  ARG  19           HD1      ARG  19 -24.133 -11.970  14.140
  171    HE   ARG  19           HE       ARG  19 -21.491 -10.766  14.631
  172   HH11  ARG  19          HH21      ARG  19 -23.579 -13.514  14.840
  173   HH12  ARG  19          HH22      ARG  19 -22.680 -14.258  16.118
  174   HH21  ARG  19          HH11      ARG  19 -20.313 -11.731  16.294
  175   HH22  ARG  19          HH12      ARG  19 -20.834 -13.252  16.939
  176    H    ASP  20           HN       ASP  20 -25.087 -14.955   9.699
  177    HA   ASP  20           HA       ASP  20 -23.360 -16.811  11.173
  178    HB2  ASP  20           HB2      ASP  20 -25.084 -18.446  10.744
  179    HB3  ASP  20           HB1      ASP  20 -25.879 -16.933  11.175
  180    H    GLU  21           HN       GLU  21 -22.995 -15.444   8.251
  181    HA   GLU  21           HA       GLU  21 -22.336 -17.887   6.725
  182    HB2  GLU  21           HB2      GLU  21 -23.370 -15.945   5.583
  183    HB3  GLU  21           HB1      GLU  21 -21.962 -14.964   5.998
  184    HG2  GLU  21           HG2      GLU  21 -20.506 -16.430   4.709
  185    HG3  GLU  21           HG1      GLU  21 -21.849 -17.524   4.378
  186    H    LYS  22           HN       LYS  22 -20.381 -18.801   6.829
  187    HA   LYS  22           HA       LYS  22 -18.215 -17.542   8.314
  188    HB2  LYS  22           HB2      LYS  22 -18.314 -20.136   6.745
  189    HB3  LYS  22           HB1      LYS  22 -17.023 -19.661   7.849
  190    HG2  LYS  22           HG2      LYS  22 -19.903 -19.812   8.752
  191    HG3  LYS  22           HG1      LYS  22 -18.850 -21.224   8.785
  192    HD2  LYS  22           HD2      LYS  22 -17.225 -19.898  10.176
  193    HD3  LYS  22           HD1      LYS  22 -18.417 -18.603  10.256
  194    HE2  LYS  22           HE2      LYS  22 -18.922 -21.442  11.174
  195    HE3  LYS  22           HE1      LYS  22 -18.513 -20.098  12.240
  196    HZ1  LYS  22           HZ1      LYS  22 -20.509 -19.054  11.840
  197    HZ2  LYS  22           HZ2      LYS  22 -20.978 -20.687  11.835
  198    HZ3  LYS  22           HZ3      LYS  22 -20.770 -19.854  10.368
  199    H    TRP  23           HN       TRP  23 -16.246 -16.836   7.518
  200    HA   TRP  23           HA       TRP  23 -16.187 -16.236   4.586
  201    HB2  TRP  23           HB2      TRP  23 -15.076 -14.907   7.054
  202    HB3  TRP  23           HB1      TRP  23 -14.280 -14.634   5.507
  203    HD1  TRP  23           HD1      TRP  23 -15.765 -13.532   3.542
  204    HE1  TRP  23           HE1      TRP  23 -17.802 -11.957   3.661
  205    HE3  TRP  23           HE3      TRP  23 -17.158 -14.259   8.400
  206    HZ2  TRP  23           HZ2      TRP  23 -19.762 -11.116   5.565
  207    HZ3  TRP  23           HZ3      TRP  23 -19.112 -13.058   9.340
  208    HH2  TRP  23           HH2      TRP  23 -20.414 -11.491   7.929
  209    H    GLU  24           HN       GLU  24 -13.985 -16.270   3.593
  210    HA   GLU  24           HA       GLU  24 -12.404 -18.613   4.602
  211    HB2  GLU  24           HB2      GLU  24 -12.764 -17.467   1.817
  212    HB3  GLU  24           HB1      GLU  24 -11.614 -18.747   2.215
  213    HG2  GLU  24           HG2      GLU  24 -13.448 -20.157   3.049
  214    HG3  GLU  24           HG1      GLU  24 -14.607 -18.877   2.692
  215    H    CYS  25           HN       CYS  25 -10.494 -18.100   5.468
  216    HA   CYS  25           HA       CYS  25  -9.391 -15.408   5.191
  217    HB2  CYS  25           HB2      CYS  25  -7.577 -16.397   6.689
  218    HB3  CYS  25           HB1      CYS  25  -9.211 -16.417   7.356
  219    HG   CYS  25           HG       CYS  25  -7.587 -18.848   7.018
  220    H    GLU  26           HN       GLU  26  -7.911 -14.811   3.712
  221    HA   GLU  26           HA       GLU  26  -6.129 -16.892   2.495
  222    HB2  GLU  26           HB2      GLU  26  -8.084 -16.178   0.990
  223    HB3  GLU  26           HB1      GLU  26  -7.323 -14.587   0.936
  224    HG2  GLU  26           HG2      GLU  26  -6.508 -15.785  -0.973
  225    HG3  GLU  26           HG1      GLU  26  -5.192 -15.767   0.201
  226    H    SER  27           HN       SER  27  -4.111 -16.315   3.117
  227    HA   SER  27           HA       SER  27  -3.500 -13.454   3.637
  228    HB2  SER  27           HB2      SER  27  -1.946 -15.983   4.226
  229    HB3  SER  27           HB1      SER  27  -1.431 -14.356   4.668
  230    HG   SER  27           HG       SER  27  -2.808 -14.378   6.260
  231    H    ILE  28           HN       ILE  28  -2.622 -12.307   2.012
  232    HA   ILE  28           HA       ILE  28  -0.635 -13.649   0.222
  233    HB   ILE  28           HB       ILE  28  -2.881 -11.812  -0.674
  234   HG12  ILE  28          HG12      ILE  28  -2.323 -14.722  -1.334
  235   HG13  ILE  28          HG11      ILE  28  -3.508 -14.189  -0.145
  236   HG21  ILE  28          HG21      ILE  28  -1.969 -12.337  -2.951
  237   HG22  ILE  28          HG22      ILE  28  -0.599 -13.132  -2.176
  238   HG23  ILE  28          HG23      ILE  28  -0.852 -11.401  -1.962
  239   HD11  ILE  28          HD11      ILE  28  -4.637 -12.855  -1.940
  240   HD12  ILE  28          HD12      ILE  28  -4.658 -14.593  -2.242
  241   HD13  ILE  28          HD13      ILE  28  -3.518 -13.561  -3.106
  242    H    GLU  29           HN       GLU  29   1.182 -12.467  -0.040
  243    HA   GLU  29           HA       GLU  29   1.463  -9.963   1.426
  244    HB2  GLU  29           HB2      GLU  29   3.342 -11.561  -0.333
  245    HB3  GLU  29           HB1      GLU  29   3.816 -10.081   0.503
  246    HG2  GLU  29           HG2      GLU  29   3.273 -11.076   2.662
  247    HG3  GLU  29           HG1      GLU  29   2.668 -12.531   1.871
  248    H    GLU  30           HN       GLU  30   1.160  -7.953   0.588
  249    HA   GLU  30           HA       GLU  30   1.519  -7.538  -2.345
  250    HB2  GLU  30           HB2      GLU  30  -0.943  -6.759  -0.751
  251    HB3  GLU  30           HB1      GLU  30  -0.585  -6.164  -2.371
  252    HG2  GLU  30           HG2      GLU  30  -0.870  -9.093  -1.640
  253    HG3  GLU  30           HG1      GLU  30  -2.135  -8.120  -2.388
  254    H    VAL  31           HN       VAL  31   1.939  -5.357  -2.906
  255    HA   VAL  31           HA       VAL  31   3.389  -3.894  -0.848
  256    HB   VAL  31           HB       VAL  31   2.769  -3.073  -3.699
  257   HG11  VAL  31          HG11      VAL  31   4.700  -1.642  -3.470
  258   HG12  VAL  31          HG12      VAL  31   5.073  -2.311  -1.883
  259   HG13  VAL  31          HG13      VAL  31   3.637  -1.314  -2.105
  260   HG21  VAL  31          HG21      VAL  31   4.970  -4.070  -4.225
  261   HG22  VAL  31          HG22      VAL  31   3.851  -5.287  -3.611
  262   HG23  VAL  31          HG23      VAL  31   5.108  -4.634  -2.560
  263    H    ALA  32           HN       ALA  32   2.761  -2.016   0.168
  264    HA   ALA  32           HA       ALA  32   0.078  -1.388   0.617
  265    HB1  ALA  32           HB1      ALA  32   0.857   0.693   1.556
  266    HB2  ALA  32           HB2      ALA  32   2.324   0.646   0.579
  267    HB3  ALA  32           HB3      ALA  32   2.094  -0.522   1.879
  268    H    ASP  33           HN       ASP  33   2.220  -0.222  -1.942
  269    HA   ASP  33           HA       ASP  33   0.394   1.771  -2.966
  270    HB2  ASP  33           HB2      ASP  33   2.782   0.351  -4.177
  271    HB3  ASP  33           HB1      ASP  33   1.904   1.642  -4.997
  272    H    ASP  34           HN       ASP  34   0.566  -1.668  -3.243
  273    HA   ASP  34           HA       ASP  34  -0.959  -1.737  -5.776
  274    HB2  ASP  34           HB2      ASP  34   0.071  -3.911  -3.936
  275    HB3  ASP  34           HB1      ASP  34  -0.867  -4.228  -5.394
  276    H    ILE  35           HN       ILE  35  -1.716  -1.261  -2.565
  277    HA   ILE  35           HA       ILE  35  -4.515  -2.223  -3.018
  278    HB   ILE  35           HB       ILE  35  -4.396  -2.639  -0.385
  279   HG12  ILE  35          HG12      ILE  35  -1.566  -3.378  -1.166
  280   HG13  ILE  35          HG11      ILE  35  -1.936  -1.806  -0.464
  281   HG21  ILE  35          HG21      ILE  35  -3.272  -4.544  -2.463
  282   HG22  ILE  35          HG22      ILE  35  -4.962  -4.385  -1.983
  283   HG23  ILE  35          HG23      ILE  35  -3.776  -5.014  -0.840
  284   HD11  ILE  35          HD11      ILE  35  -1.260  -3.676   1.168
  285   HD12  ILE  35          HD12      ILE  35  -2.848  -4.369   0.842
  286   HD13  ILE  35          HD13      ILE  35  -2.716  -2.762   1.560
  287    H    LEU  36           HN       LEU  36  -2.369  -0.172  -1.013
  288    HA   LEU  36           HA       LEU  36  -4.674   1.538  -0.355
  289    HB2  LEU  36           HB2      LEU  36  -1.794   1.842   0.496
  290    HB3  LEU  36           HB1      LEU  36  -3.198   2.639   1.201
  291    HG   LEU  36           HG       LEU  36  -2.745  -0.360   1.170
  292   HD11  LEU  36          HD11      LEU  36  -2.307   1.768   3.271
  293   HD12  LEU  36          HD12      LEU  36  -1.168   0.553   2.695
  294   HD13  LEU  36          HD13      LEU  36  -2.536   0.072   3.697
  295   HD21  LEU  36          HD21      LEU  36  -4.626  -0.154   2.957
  296   HD22  LEU  36          HD22      LEU  36  -5.087  -0.025   1.264
  297   HD23  LEU  36          HD23      LEU  36  -4.928   1.432   2.246
  298    HA   PRO  37           HA       PRO  37  -3.938   4.362  -3.775
  299    HB2  PRO  37           HB2      PRO  37  -4.562   6.473  -1.740
  300    HB3  PRO  37           HB1      PRO  37  -5.250   6.231  -3.357
  301    HG2  PRO  37           HG2      PRO  37  -6.575   5.571  -1.105
  302    HG3  PRO  37           HG1      PRO  37  -6.765   4.678  -2.623
  303    HD2  PRO  37           HD2      PRO  37  -5.391   3.840  -0.128
  304    HD3  PRO  37           HD1      PRO  37  -6.070   2.854  -1.442
  305    H    ASP  38           HN       ASP  38  -2.350   5.915  -4.434
  306    HA   ASP  38           HA       ASP  38   0.171   5.782  -3.099
  307    HB2  ASP  38           HB2      ASP  38  -0.957   7.412  -5.369
  308    HB3  ASP  38           HB1      ASP  38   0.627   7.830  -4.719
  309    H    GLN  39           HN       GLN  39  -2.419   8.204  -3.066
  310    HA   GLN  39           HA       GLN  39  -0.956  10.219  -1.635
  311    HB2  GLN  39           HB2      GLN  39  -3.098  10.631  -2.857
  312    HB3  GLN  39           HB1      GLN  39  -3.951   9.713  -1.616
  313    HG2  GLN  39           HG2      GLN  39  -3.161  11.298   0.104
  314    HG3  GLN  39           HG1      GLN  39  -2.297  12.212  -1.132
  315   HE21  GLN  39          HE21      GLN  39  -3.523  14.138  -1.221
  316   HE22  GLN  39          HE22      GLN  39  -5.188  14.186  -1.547
  317    H    TYR  40           HN       TYR  40  -2.737   7.362  -0.632
  318    HA   TYR  40           HA       TYR  40  -2.556   8.106   2.225
  319    HB2  TYR  40           HB2      TYR  40  -3.808   5.848   0.659
  320    HB3  TYR  40           HB1      TYR  40  -3.579   5.689   2.400
  321    HD1  TYR  40           HD2      TYR  40  -4.910   8.131  -0.130
  322    HD2  TYR  40           HD1      TYR  40  -5.244   6.503   3.833
  323    HE1  TYR  40           HE2      TYR  40  -6.943   9.495   0.260
  324    HE2  TYR  40           HE1      TYR  40  -7.275   7.870   4.222
  325    HH   TYR  40           HH       TYR  40  -8.864   9.131   3.203
  326    H    VAL  41           HN       VAL  41  -0.441   6.945   0.009
  327    HA   VAL  41           HA       VAL  41   0.992   5.201   1.992
  328    HB   VAL  41           HB       VAL  41   1.049   5.190  -1.041
  329   HG11  VAL  41          HG11      VAL  41   2.548   3.136  -0.600
  330   HG12  VAL  41          HG12      VAL  41   2.769   3.808   1.015
  331   HG13  VAL  41          HG13      VAL  41   3.277   4.730  -0.400
  332   HG21  VAL  41          HG21      VAL  41   0.351   2.908   0.812
  333   HG22  VAL  41          HG22      VAL  41  -0.030   3.088  -0.900
  334   HG23  VAL  41          HG23      VAL  41  -0.873   4.071   0.296
  335    H    ARG  42           HN       ARG  42   1.111   8.021  -0.052
  336    HA   ARG  42           HA       ARG  42   3.897   8.441  -0.266
  337    HB2  ARG  42           HB2      ARG  42   2.158   9.844  -1.381
  338    HB3  ARG  42           HB1      ARG  42   1.756  10.548   0.185
  339    HG2  ARG  42           HG2      ARG  42   4.009  11.452   0.409
  340    HG3  ARG  42           HG1      ARG  42   4.509  10.656  -1.083
  341    HD2  ARG  42           HD2      ARG  42   4.014  13.004  -1.549
  342    HD3  ARG  42           HD1      ARG  42   2.800  11.987  -2.324
  343    HE   ARG  42           HE       ARG  42   1.908  12.761   0.299
  344   HH11  ARG  42          HH21      ARG  42   2.450  13.910  -2.916
  345   HH12  ARG  42          HH22      ARG  42   1.224  15.131  -2.824
  346   HH21  ARG  42          HH11      ARG  42   0.306  14.352   0.426
  347   HH22  ARG  42          HH12      ARG  42   0.012  15.381  -0.936
  348    H    LEU  43           HN       LEU  43   1.862  10.231   2.065
  349    HA   LEU  43           HA       LEU  43   4.061  10.829   3.790
  350    HB2  LEU  43           HB2      LEU  43   1.967  12.142   3.788
  351    HB3  LEU  43           HB1      LEU  43   1.087  10.746   4.407
  352    HG   LEU  43           HG       LEU  43   2.437  10.775   6.460
  353   HD11  LEU  43          HD11      LEU  43   3.930  12.916   4.962
  354   HD12  LEU  43          HD12      LEU  43   4.560  11.583   5.930
  355   HD13  LEU  43          HD13      LEU  43   3.860  12.992   6.723
  356   HD21  LEU  43          HD21      LEU  43   0.363  12.224   6.177
  357   HD22  LEU  43          HD22      LEU  43   1.453  13.582   5.890
  358   HD23  LEU  43          HD23      LEU  43   1.479  12.743   7.442
  359    H    GLY  44           HN       GLY  44   1.565   8.321   3.872
  360    HA2  GLY  44           HA2      GLY  44   1.992   7.132   6.327
  361    HA3  GLY  44           HA1      GLY  44   1.602   6.214   4.880
  362    HA   PRO  45           HA       PRO  45   6.501   6.282   5.966
  363    HB2  PRO  45           HB2      PRO  45   5.774   4.688   8.415
  364    HB3  PRO  45           HB1      PRO  45   7.151   5.780   8.152
  365    HG2  PRO  45           HG2      PRO  45   5.059   6.557   9.593
  366    HG3  PRO  45           HG1      PRO  45   5.881   7.682   8.495
  367    HD2  PRO  45           HD2      PRO  45   3.231   6.333   8.160
  368    HD3  PRO  45           HD1      PRO  45   3.769   7.918   7.574
  369    H    LEU  46           HN       LEU  46   3.800   4.280   5.691
  370    HA   LEU  46           HA       LEU  46   4.928   1.657   5.629
  371    HB2  LEU  46           HB2      LEU  46   2.591   2.847   4.104
  372    HB3  LEU  46           HB1      LEU  46   2.934   1.122   4.212
  373    HG   LEU  46           HG       LEU  46   2.437   2.920   6.605
  374   HD11  LEU  46          HD11      LEU  46   0.210   2.055   6.683
  375   HD12  LEU  46          HD12      LEU  46   0.557   0.859   5.433
  376   HD13  LEU  46          HD13      LEU  46   0.469   2.571   5.017
  377   HD21  LEU  46          HD21      LEU  46   2.996  -0.022   6.240
  378   HD22  LEU  46          HD22      LEU  46   1.978   0.502   7.583
  379   HD23  LEU  46          HD23      LEU  46   3.631   1.092   7.451
  380    H    SER  47           HN       SER  47   4.529   4.145   3.135
  381    HA   SER  47           HA       SER  47   5.388   4.319   0.968
  382    HB2  SER  47           HB2      SER  47   7.450   4.425   2.467
  383    HB3  SER  47           HB1      SER  47   7.713   2.733   2.058
  384    HG   SER  47           HG       SER  47   8.299   3.300   0.108
  385    H    ASN  48           HN       ASN  48   7.284   2.428  -0.214
  386    HA   ASN  48           HA       ASN  48   5.330   0.548  -1.321
  387    HB2  ASN  48           HB2      ASN  48   7.167   1.845  -2.592
  388    HB3  ASN  48           HB1      ASN  48   8.290   0.654  -1.940
  389   HD21  ASN  48          HD21      ASN  48   8.085  -1.573  -2.687
  390   HD22  ASN  48          HD22      ASN  48   7.163  -1.965  -4.058
  391    H    LYS  49           HN       LYS  49   5.948   0.091   1.453
  392    HA   LYS  49           HA       LYS  49   7.816  -2.168   1.571
  393    HB2  LYS  49           HB2      LYS  49   5.933  -0.942   3.601
  394    HB3  LYS  49           HB1      LYS  49   6.990  -2.313   3.945
  395    HG2  LYS  49           HG2      LYS  49   8.963  -0.997   3.426
  396    HG3  LYS  49           HG1      LYS  49   7.969   0.356   2.894
  397    HD2  LYS  49           HD2      LYS  49   8.599   0.948   5.094
  398    HD3  LYS  49           HD1      LYS  49   6.965   0.316   5.278
  399    HE2  LYS  49           HE2      LYS  49   7.809  -1.821   6.043
  400    HE3  LYS  49           HE1      LYS  49   9.467  -1.355   5.667
  401    HZ1  LYS  49           HZ1      LYS  49   9.547  -0.684   7.774
  402    HZ2  LYS  49           HZ2      LYS  49   7.858  -0.720   7.959
  403    HZ3  LYS  49           HZ3      LYS  49   8.612   0.642   7.278
  404    H    ILE  50           HN       ILE  50   7.196  -4.336   2.042
  405    HA   ILE  50           HA       ILE  50   4.631  -5.112   0.832
  406    HB   ILE  50           HB       ILE  50   6.949  -6.708   1.966
  407   HG12  ILE  50          HG12      ILE  50   7.274  -7.284  -0.447
  408   HG13  ILE  50          HG11      ILE  50   5.967  -6.176  -0.859
  409   HG21  ILE  50          HG21      ILE  50   5.741  -8.614   0.719
  410   HG22  ILE  50          HG22      ILE  50   4.318  -7.574   0.759
  411   HG23  ILE  50          HG23      ILE  50   5.059  -8.113   2.266
  412   HD11  ILE  50          HD11      ILE  50   7.227  -4.290  -0.369
  413   HD12  ILE  50          HD12      ILE  50   8.499  -5.376  -0.919
  414   HD13  ILE  50          HD13      ILE  50   8.237  -5.132   0.808
  415    H    LEU  51           HN       LEU  51   2.831  -5.283   2.042
  416    HA   LEU  51           HA       LEU  51   3.099  -5.860   4.978
  417    HB2  LEU  51           HB2      LEU  51   0.840  -4.439   3.539
  418    HB3  LEU  51           HB1      LEU  51   1.060  -4.592   5.284
  419    HG   LEU  51           HG       LEU  51   2.957  -3.164   3.395
  420   HD11  LEU  51          HD11      LEU  51   0.720  -2.057   3.846
  421   HD12  LEU  51          HD12      LEU  51   2.131  -1.119   4.333
  422   HD13  LEU  51          HD13      LEU  51   1.185  -1.983   5.546
  423   HD21  LEU  51          HD21      LEU  51   3.011  -3.747   6.355
  424   HD22  LEU  51          HD22      LEU  51   3.822  -2.319   5.716
  425   HD23  LEU  51          HD23      LEU  51   4.306  -3.922   5.173
  426    H    GLN  52           HN       GLN  52   1.847  -7.477   5.854
  427    HA   GLN  52           HA       GLN  52   0.947  -9.549   4.044
  428    HB2  GLN  52           HB2      GLN  52   0.791  -9.132   7.035
  429    HB3  GLN  52           HB1      GLN  52   0.069 -10.541   6.256
  430    HG2  GLN  52           HG2      GLN  52   2.311 -11.132   6.979
  431    HG3  GLN  52           HG1      GLN  52   2.302 -11.038   5.219
  432   HE21  GLN  52          HE21      GLN  52   4.446 -10.316   4.826
  433   HE22  GLN  52          HE22      GLN  52   5.078  -8.868   5.446
  434    H    THR  53           HN       THR  53  -0.902  -9.294   2.891
  435    HA   THR  53           HA       THR  53  -3.193  -7.822   4.122
  436    HB   THR  53           HB       THR  53  -2.638  -8.621   1.247
  437    HG1  THR  53           HG1      THR  53  -2.559  -6.155   2.638
  438   HG21  THR  53          HG21      THR  53  -4.567  -6.976   0.859
  439   HG22  THR  53          HG22      THR  53  -4.926  -7.170   2.573
  440   HG23  THR  53          HG23      THR  53  -5.000  -8.564   1.495
  441    H    ASN  54           HN       ASN  54  -4.700  -9.078   5.044
  442    HA   ASN  54           HA       ASN  54  -5.079 -11.874   4.059
  443    HB2  ASN  54           HB2      ASN  54  -4.581 -11.409   6.516
  444    HB3  ASN  54           HB1      ASN  54  -6.171 -10.648   6.600
  445   HD21  ASN  54          HD21      ASN  54  -7.180 -12.273   7.918
  446   HD22  ASN  54          HD22      ASN  54  -7.432 -13.863   7.378
  447    H    THR  55           HN       THR  55  -6.458 -11.608   2.342
  448    HA   THR  55           HA       THR  55  -8.821  -9.869   2.580
  449    HB   THR  55           HB       THR  55  -8.018 -11.731   0.329
  450    HG1  THR  55           HG1      THR  55  -6.429 -10.278   0.406
  451   HG21  THR  55          HG21      THR  55 -10.316 -11.137   0.102
  452   HG22  THR  55          HG22      THR  55  -9.436 -10.038  -0.962
  453   HG23  THR  55          HG23      THR  55 -10.010  -9.476   0.607
  454    H    TYR  56           HN       TYR  56 -10.911 -10.591   2.786
  455    HA   TYR  56           HA       TYR  56 -11.282 -13.506   3.387
  456    HB2  TYR  56           HB2      TYR  56 -12.854 -11.058   4.252
  457    HB3  TYR  56           HB1      TYR  56 -13.315 -12.720   4.615
  458    HD1  TYR  56           HD1      TYR  56 -10.817 -10.073   5.228
  459    HD2  TYR  56           HD2      TYR  56 -12.094 -14.048   6.231
  460    HE1  TYR  56           HE1      TYR  56  -9.280 -10.075   7.173
  461    HE2  TYR  56           HE2      TYR  56 -10.559 -14.051   8.178
  462    HH   TYR  56           HH       TYR  56  -9.459 -11.760   9.650
  463    H    TYR  57           HN       TYR  57 -12.647 -14.649   2.068
  464    HA   TYR  57           HA       TYR  57 -14.306 -13.085   0.093
  465    HB2  TYR  57           HB2      TYR  57 -12.855 -15.728  -0.273
  466    HB3  TYR  57           HB1      TYR  57 -13.948 -15.005  -1.454
  467    HD1  TYR  57           HD2      TYR  57 -13.428 -12.446  -2.013
  468    HD2  TYR  57           HD1      TYR  57 -10.566 -15.260  -0.479
  469    HE1  TYR  57           HE2      TYR  57 -11.581 -11.049  -2.895
  470    HE2  TYR  57           HE1      TYR  57  -8.719 -13.861  -1.357
  471    HH   TYR  57           HH       TYR  57  -8.178 -12.052  -2.522
  472    H    SER  58           HN       SER  58 -16.415 -13.556   0.063
  473    HA   SER  58           HA       SER  58 -17.384 -16.120   1.249
  474    HB2  SER  58           HB2      SER  58 -18.032 -14.890   3.071
  475    HB3  SER  58           HB1      SER  58 -17.853 -13.366   2.208
  476    HG   SER  58           HG       SER  58 -20.030 -15.156   2.276
  477    H    ASP  59           HN       ASP  59 -19.642 -16.568   0.580
  478    HA   ASP  59           HA       ASP  59 -20.019 -16.277  -2.226
  479    HB2  ASP  59           HB2      ASP  59 -21.025 -18.085  -0.884
  480    HB3  ASP  59           HB1      ASP  59 -22.041 -16.908  -0.053
  481    H    THR  60           HN       THR  60 -21.667 -14.652   0.504
  482    HA   THR  60           HA       THR  60 -23.295 -12.958  -1.137
  483    HB   THR  60           HB       THR  60 -23.599 -11.646   0.958
  484    HG1  THR  60           HG1      THR  60 -21.515 -11.825   1.781
  485   HG21  THR  60          HG21      THR  60 -23.677 -14.665   1.154
  486   HG22  THR  60          HG22      THR  60 -24.995 -13.584   0.700
  487   HG23  THR  60          HG23      THR  60 -24.401 -13.604   2.358
  488    H    LEU  61           HN       LEU  61 -20.057 -12.597   0.228
  489    HA   LEU  61           HA       LEU  61 -19.716  -9.825  -0.388
  490    HB2  LEU  61           HB2      LEU  61 -17.869 -12.146   0.136
  491    HB3  LEU  61           HB1      LEU  61 -17.189 -10.624  -0.432
  492    HG   LEU  61           HG       LEU  61 -17.277 -10.909   2.099
  493   HD11  LEU  61          HD11      LEU  61 -17.574  -8.642   2.439
  494   HD12  LEU  61          HD12      LEU  61 -18.981  -8.541   1.387
  495   HD13  LEU  61          HD13      LEU  61 -17.368  -8.656   0.691
  496   HD21  LEU  61          HD21      LEU  61 -19.650 -11.957   1.930
  497   HD22  LEU  61          HD22      LEU  61 -20.223 -10.293   1.835
  498   HD23  LEU  61          HD23      LEU  61 -19.332 -10.840   3.255
  499    H    HIS  62           HN       HIS  62 -19.099 -12.783  -2.238
  500    HA   HIS  62           HA       HIS  62 -17.831 -11.571  -4.481
  501    HB2  HIS  62           HB2      HIS  62 -19.343 -14.103  -3.935
  502    HB3  HIS  62           HB1      HIS  62 -19.160 -13.653  -5.630
  503    HD1  HIS  62           HD1      HIS  62 -16.463 -12.766  -3.179
  504    HD2  HIS  62           HD2      HIS  62 -17.218 -15.712  -6.032
  505    HE1  HIS  62           HE1      HIS  62 -14.276 -13.993  -3.542
  506    H    LYS  63           HN       LYS  63 -21.247 -12.100  -3.676
  507    HA   LYS  63           HA       LYS  63 -22.341 -11.111  -6.124
  508    HB2  LYS  63           HB2      LYS  63 -23.451 -11.262  -3.311
  509    HB3  LYS  63           HB1      LYS  63 -24.410 -10.747  -4.699
  510    HG2  LYS  63           HG2      LYS  63 -23.944 -12.890  -5.827
  511    HG3  LYS  63           HG1      LYS  63 -22.977 -13.409  -4.445
  512    HD2  LYS  63           HD2      LYS  63 -24.919 -13.318  -2.987
  513    HD3  LYS  63           HD1      LYS  63 -25.906 -12.645  -4.284
  514    HE2  LYS  63           HE2      LYS  63 -26.338 -15.046  -4.083
  515    HE3  LYS  63           HE1      LYS  63 -25.525 -14.714  -5.612
  516    HZ1  LYS  63           HZ1      LYS  63 -24.560 -16.614  -4.450
  517    HZ2  LYS  63           HZ2      LYS  63 -24.183 -15.622  -3.123
  518    HZ3  LYS  63           HZ3      LYS  63 -23.435 -15.356  -4.625
  519    H    SER  64           HN       SER  64 -21.535  -9.476  -3.061
  520    HA   SER  64           HA       SER  64 -22.500  -6.900  -4.046
  521    HB2  SER  64           HB2      SER  64 -21.613  -6.024  -1.932
  522    HB3  SER  64           HB1      SER  64 -22.559  -7.482  -1.638
  523    HG   SER  64           HG       SER  64 -20.338  -7.236  -0.661
  524    H    ASN  65           HN       ASN  65 -19.795  -8.737  -4.671
  525    HA   ASN  65           HA       ASN  65 -17.752  -8.274  -5.700
  526    HB2  ASN  65           HB2      ASN  65 -19.368  -6.920  -7.156
  527    HB3  ASN  65           HB1      ASN  65 -18.858  -5.511  -6.229
  528   HD21  ASN  65          HD21      ASN  65 -16.758  -8.254  -7.183
  529   HD22  ASN  65          HD22      ASN  65 -15.736  -7.330  -8.173
  530    H    ILE  66           HN       ILE  66 -17.973  -7.838  -2.877
  531    HA   ILE  66           HA       ILE  66 -16.047  -5.564  -2.481
  532    HB   ILE  66           HB       ILE  66 -18.042  -6.759  -0.534
  533   HG12  ILE  66          HG12      ILE  66 -17.828  -3.950  -1.658
  534   HG13  ILE  66          HG11      ILE  66 -18.900  -5.184  -2.320
  535   HG21  ILE  66          HG21      ILE  66 -15.760  -4.809  -0.214
  536   HG22  ILE  66          HG22      ILE  66 -16.186  -6.183   0.800
  537   HG23  ILE  66          HG23      ILE  66 -17.164  -4.719   0.849
  538   HD11  ILE  66          HD11      ILE  66 -19.890  -5.421   0.005
  539   HD12  ILE  66          HD12      ILE  66 -20.211  -3.879  -0.790
  540   HD13  ILE  66          HD13      ILE  66 -18.970  -3.987   0.458
  541    H    TYR  67           HN       TYR  67 -14.094  -6.079  -1.664
  542    HA   TYR  67           HA       TYR  67 -13.655  -8.894  -0.686
  543    HB2  TYR  67           HB2      TYR  67 -11.579  -7.134  -1.997
  544    HB3  TYR  67           HB1      TYR  67 -11.513  -8.872  -1.708
  545    HD1  TYR  67           HD1      TYR  67 -13.757 -10.128  -2.686
  546    HD2  TYR  67           HD2      TYR  67 -11.972  -6.533  -4.223
  547    HE1  TYR  67           HE1      TYR  67 -14.795 -10.555  -4.898
  548    HE2  TYR  67           HE2      TYR  67 -13.010  -6.961  -6.430
  549    HH   TYR  67           HH       TYR  67 -15.442  -9.327  -6.894
  550    HA   PRO  68           HA       PRO  68 -12.722  -6.021   2.835
  551    HB2  PRO  68           HB2      PRO  68 -13.216  -8.512   4.390
  552    HB3  PRO  68           HB1      PRO  68 -13.923  -6.897   4.601
  553    HG2  PRO  68           HG2      PRO  68 -15.341  -8.935   3.595
  554    HG3  PRO  68           HG1      PRO  68 -15.574  -7.267   3.039
  555    HD2  PRO  68           HD2      PRO  68 -14.105  -9.514   1.691
  556    HD3  PRO  68           HD1      PRO  68 -15.125  -8.247   0.979
  557    H    PHE  69           HN       PHE  69 -10.736  -5.865   3.985
  558    HA   PHE  69           HA       PHE  69  -9.034  -8.243   4.208
  559    HB2  PHE  69           HB2      PHE  69  -7.224  -7.432   2.838
  560    HB3  PHE  69           HB1      PHE  69  -8.685  -7.420   1.856
  561    HD1  PHE  69           HD2      PHE  69  -9.847  -5.280   1.347
  562    HD2  PHE  69           HD1      PHE  69  -6.124  -5.384   3.490
  563    HE1  PHE  69           HE2      PHE  69  -9.529  -2.858   0.919
  564    HE2  PHE  69           HE1      PHE  69  -5.806  -2.965   3.057
  565    HZ   PHE  69           HZ       PHE  69  -7.508  -1.701   1.772
  566    H    ILE  70           HN       ILE  70  -7.121  -7.869   5.455
  567    HA   ILE  70           HA       ILE  70  -7.028  -5.265   6.925
  568    HB   ILE  70           HB       ILE  70  -6.932  -8.024   8.185
  569   HG12  ILE  70          HG12      ILE  70  -8.877  -5.739   8.625
  570   HG13  ILE  70          HG11      ILE  70  -9.200  -7.089   7.536
  571   HG21  ILE  70          HG21      ILE  70  -6.479  -5.232   9.267
  572   HG22  ILE  70          HG22      ILE  70  -5.368  -6.599   9.322
  573   HG23  ILE  70          HG23      ILE  70  -6.831  -6.613  10.305
  574   HD11  ILE  70          HD11      ILE  70  -8.911  -8.669   9.421
  575   HD12  ILE  70          HD12      ILE  70 -10.202  -7.510   9.740
  576   HD13  ILE  70          HD13      ILE  70  -8.628  -7.307  10.505
  577    H    LEU  71           HN       LEU  71  -4.957  -4.601   7.426
  578    HA   LEU  71           HA       LEU  71  -2.753  -6.192   6.194
  579    HB2  LEU  71           HB2      LEU  71  -2.749  -3.314   7.152
  580    HB3  LEU  71           HB1      LEU  71  -1.530  -4.101   6.148
  581    HG   LEU  71           HG       LEU  71  -4.424  -3.608   5.388
  582   HD11  LEU  71          HD11      LEU  71  -3.000  -1.593   5.346
  583   HD12  LEU  71          HD12      LEU  71  -3.456  -2.084   3.716
  584   HD13  LEU  71          HD13      LEU  71  -1.838  -2.436   4.324
  585   HD21  LEU  71          HD21      LEU  71  -3.437  -4.373   3.090
  586   HD22  LEU  71          HD22      LEU  71  -3.870  -5.603   4.271
  587   HD23  LEU  71          HD23      LEU  71  -2.181  -5.136   4.066
  588    H    TYR  72           HN       TYR  72  -1.084  -6.962   7.385
  589    HA   TYR  72           HA       TYR  72  -0.950  -6.225  10.285
  590    HB2  TYR  72           HB2      TYR  72  -0.759  -8.994   9.063
  591    HB3  TYR  72           HB1      TYR  72  -0.374  -8.615  10.742
  592    HD1  TYR  72           HD1      TYR  72  -2.188  -7.482  12.164
  593    HD2  TYR  72           HD2      TYR  72  -2.998  -9.412   8.415
  594    HE1  TYR  72           HE1      TYR  72  -4.584  -7.651  12.772
  595    HE2  TYR  72           HE2      TYR  72  -5.395  -9.584   9.022
  596    HH   TYR  72           HH       TYR  72  -6.556  -8.576  12.221
  597    H    TYR  73           HN       TYR  73   1.077  -5.819  11.008
  598    HA   TYR  73           HA       TYR  73   3.448  -6.964   9.836
  599    HB2  TYR  73           HB2      TYR  73   2.888  -5.261   8.100
  600    HB3  TYR  73           HB1      TYR  73   3.006  -4.008   9.335
  601    HD1  TYR  73           HD2      TYR  73   4.933  -6.804   7.778
  602    HD2  TYR  73           HD1      TYR  73   5.101  -3.063   9.884
  603    HE1  TYR  73           HE2      TYR  73   7.394  -6.750   7.487
  604    HE2  TYR  73           HE1      TYR  73   7.564  -3.011   9.594
  605    HH   TYR  73           HH       TYR  73   9.234  -5.452   7.648
  606    H    GLN  74           HN       GLN  74   4.814  -7.106  11.529
  607    HA   GLN  74           HA       GLN  74   5.707  -6.751  13.670
  608    HB2  GLN  74           HB2      GLN  74   5.510  -3.899  12.663
  609    HB3  GLN  74           HB1      GLN  74   6.482  -4.423  14.036
  610    HG2  GLN  74           HG2      GLN  74   6.794  -5.486  11.215
  611    HG3  GLN  74           HG1      GLN  74   7.808  -4.232  11.929
  612   HE21  GLN  74          HE21      GLN  74   8.119  -7.324  11.169
  613   HE22  GLN  74          HE22      GLN  74   8.984  -7.922  12.501
  614    H    LYS  75           HN       LYS  75   4.003  -3.666  13.647
  615    HA   LYS  75           HA       LYS  75   2.951  -4.100  16.284
  616    HB2  LYS  75           HB2      LYS  75   2.314  -2.028  14.166
  617    HB3  LYS  75           HB1      LYS  75   1.672  -1.979  15.810
  618    HG2  LYS  75           HG2      LYS  75   3.979  -1.959  16.705
  619    HG3  LYS  75           HG1      LYS  75   4.612  -1.984  15.059
  620    HD2  LYS  75           HD2      LYS  75   3.491   0.160  14.587
  621    HD3  LYS  75           HD1      LYS  75   2.846   0.188  16.228
  622    HE2  LYS  75           HE2      LYS  75   5.146   0.200  17.133
  623    HE3  LYS  75           HE1      LYS  75   5.790   0.186  15.491
  624    HZ1  LYS  75           HZ1      LYS  75   5.667   2.424  16.507
  625    HZ2  LYS  75           HZ2      LYS  75   3.975   2.284  16.547
  626    HZ3  LYS  75           HZ3      LYS  75   4.795   2.292  15.059
  627    H    GLN  76           HN       GLN  76   2.103  -6.293  14.976
  628    HA   GLN  76           HA       GLN  76   0.247  -7.516  14.212
  629    HB2  GLN  76           HB2      GLN  76  -0.882  -5.787  16.424
  630    HB3  GLN  76           HB1      GLN  76  -1.721  -7.175  15.731
  631    HG2  GLN  76           HG2      GLN  76   0.124  -8.647  16.388
  632    HG3  GLN  76           HG1      GLN  76   1.012  -7.267  17.037
  633   HE21  GLN  76          HE21      GLN  76   0.686  -8.950  19.012
  634   HE22  GLN  76          HE22      GLN  76  -0.654  -8.614  19.999
  635    H    LEU  77           HN       LEU  77  -2.291  -5.542  15.013
  636    HA   LEU  77           HA       LEU  77  -3.177  -5.264  12.325
  637    HB2  LEU  77           HB2      LEU  77  -4.690  -5.328  14.285
  638    HB3  LEU  77           HB1      LEU  77  -4.082  -3.754  14.793
  639    HG   LEU  77           HG       LEU  77  -4.869  -2.785  12.630
  640   HD11  LEU  77          HD11      LEU  77  -6.649  -4.363  11.478
  641   HD12  LEU  77          HD12      LEU  77  -5.673  -5.651  12.180
  642   HD13  LEU  77          HD13      LEU  77  -4.947  -4.503  11.055
  643   HD21  LEU  77          HD21      LEU  77  -6.291  -2.627  14.592
  644   HD22  LEU  77          HD22      LEU  77  -6.928  -4.246  14.304
  645   HD23  LEU  77          HD23      LEU  77  -7.297  -2.939  13.179
  646    H    ILE  78           HN       ILE  78  -2.908  -3.681  10.859
  647    HA   ILE  78           HA       ILE  78  -1.443  -1.194  11.685
  648    HB   ILE  78           HB       ILE  78  -1.485  -2.597   8.997
  649   HG12  ILE  78          HG12      ILE  78  -0.184  -3.868  10.623
  650   HG13  ILE  78          HG11      ILE  78   0.904  -3.065   9.498
  651   HG21  ILE  78          HG21      ILE  78  -1.236  -0.226   8.676
  652   HG22  ILE  78          HG22      ILE  78   0.363  -0.950   8.499
  653   HG23  ILE  78          HG23      ILE  78  -0.066  -0.117   9.992
  654   HD11  ILE  78          HD11      ILE  78   0.901  -1.150  11.335
  655   HD12  ILE  78          HD12      ILE  78   1.926  -2.571  11.529
  656   HD13  ILE  78          HD13      ILE  78   0.395  -2.468  12.392
  657    H    ALA  79           HN       ALA  79  -3.881  -2.510   9.415
  658    HA   ALA  79           HA       ALA  79  -5.496  -0.090   9.791
  659    HB1  ALA  79           HB1      ALA  79  -4.015  -0.668   7.237
  660    HB2  ALA  79           HB2      ALA  79  -4.183   0.861   8.097
  661    HB3  ALA  79           HB3      ALA  79  -5.548   0.198   7.198
  662    H    ILE  80           HN       ILE  80  -7.607  -0.290   8.843
  663    HA   ILE  80           HA       ILE  80  -8.358  -3.065   7.982
  664    HB   ILE  80           HB       ILE  80  -9.856  -1.204   9.855
  665   HG12  ILE  80          HG12      ILE  80  -8.766  -3.992  10.335
  666   HG13  ILE  80          HG11      ILE  80  -7.899  -2.522  10.777
  667   HG21  ILE  80          HG21      ILE  80 -11.512  -2.280   8.543
  668   HG22  ILE  80          HG22      ILE  80 -11.386  -3.277   9.992
  669   HG23  ILE  80          HG23      ILE  80 -10.609  -3.793   8.495
  670   HD11  ILE  80          HD11      ILE  80 -10.738  -2.909  11.706
  671   HD12  ILE  80          HD12      ILE  80  -9.453  -1.938  12.425
  672   HD13  ILE  80          HD13      ILE  80  -9.415  -3.695  12.567
  673    H    GLY  81           HN       GLY  81  -9.664  -3.116   6.162
  674    HA2  GLY  81           HA2      GLY  81 -11.453  -1.000   5.438
  675    HA3  GLY  81           HA1      GLY  81  -9.948  -0.812   4.539
  676    H    PHE  82           HN       PHE  82 -12.285  -1.311   3.159
  677    HA   PHE  82           HA       PHE  82 -11.776  -4.071   2.120
  678    HB2  PHE  82           HB2      PHE  82 -14.182  -4.447   1.879
  679    HB3  PHE  82           HB1      PHE  82 -13.800  -4.115   3.568
  680    HD1  PHE  82           HD1      PHE  82 -15.203  -2.658   0.454
  681    HD2  PHE  82           HD2      PHE  82 -14.606  -2.153   4.676
  682    HE1  PHE  82           HE1      PHE  82 -16.800  -0.763   0.452
  683    HE2  PHE  82           HE2      PHE  82 -16.198  -0.254   4.674
  684    HZ   PHE  82           HZ       PHE  82 -17.297   0.442   2.562
  685    H    ILE  83           HN       ILE  83 -12.242  -4.339  -0.111
  686    HA   ILE  83           HA       ILE  83 -12.001  -1.828  -1.638
  687    HB   ILE  83           HB       ILE  83 -12.020  -4.733  -2.516
  688   HG12  ILE  83          HG12      ILE  83  -9.730  -2.755  -2.330
  689   HG13  ILE  83          HG11      ILE  83 -10.098  -3.939  -1.078
  690   HG21  ILE  83          HG21      ILE  83 -11.505  -2.155  -4.023
  691   HG22  ILE  83          HG22      ILE  83 -12.751  -3.357  -4.359
  692   HG23  ILE  83          HG23      ILE  83 -11.054  -3.747  -4.635
  693   HD11  ILE  83          HD11      ILE  83  -8.338  -4.709  -2.687
  694   HD12  ILE  83          HD12      ILE  83  -9.547  -4.646  -3.970
  695   HD13  ILE  83          HD13      ILE  83  -9.746  -5.770  -2.627
  696    H    ASP  84           HN       ASP  84 -13.717  -0.816  -2.481
  697    HA   ASP  84           HA       ASP  84 -16.369  -2.133  -2.423
  698    HB2  ASP  84           HB2      ASP  84 -15.904   0.221  -1.539
  699    HB3  ASP  84           HB1      ASP  84 -15.740   0.714  -3.223
  700    H    GLU  85           HN       GLU  85 -17.187  -3.033  -4.203
  701    HA   GLU  85           HA       GLU  85 -17.509  -3.633  -6.432
  702    HB2  GLU  85           HB2      GLU  85 -16.854  -0.701  -6.831
  703    HB3  GLU  85           HB1      GLU  85 -17.548  -1.752  -8.062
  704    HG2  GLU  85           HG2      GLU  85 -18.821  -1.157  -5.374
  705    HG3  GLU  85           HG1      GLU  85 -19.279  -0.401  -6.897
  706    H    ASN  86           HN       ASN  86 -15.354  -1.264  -7.692
  707    HA   ASN  86           HA       ASN  86 -13.321  -3.402  -8.251
  708    HB2  ASN  86           HB2      ASN  86 -14.205  -0.985  -9.852
  709    HB3  ASN  86           HB1      ASN  86 -12.756  -1.915 -10.235
  710   HD21  ASN  86          HD21      ASN  86 -15.011  -1.759 -12.035
  711   HD22  ASN  86          HD22      ASN  86 -15.696  -3.308 -12.152
  712    H    HIS  87           HN       HIS  87 -13.879  -0.195  -6.973
  713    HA   HIS  87           HA       HIS  87 -11.141  -0.149  -5.904
  714    HB2  HIS  87           HB2      HIS  87 -12.111   2.010  -7.799
  715    HB3  HIS  87           HB1      HIS  87 -10.626   2.079  -6.854
  716    HD1  HIS  87           HD1      HIS  87  -8.850   0.106  -7.360
  717    HD2  HIS  87           HD2      HIS  87 -11.843   0.654 -10.207
  718    HE1  HIS  87           HE1      HIS  87  -8.066  -1.075  -9.458
  719    H    ASP  88           HN       ASP  88 -11.227   2.686  -5.327
  720    HA   ASP  88           HA       ASP  88 -12.031   4.148  -3.703
  721    HB2  ASP  88           HB2      ASP  88 -14.131   3.923  -5.164
  722    HB3  ASP  88           HB1      ASP  88 -14.710   2.768  -3.965
  723    H    MET  89           HN       MET  89 -10.577   2.457  -2.521
  724    HA   MET  89           HA       MET  89 -11.846   0.544  -0.786
  725    HB2  MET  89           HB2      MET  89  -9.142   1.900  -0.531
  726    HB3  MET  89           HB1      MET  89  -9.648   0.434   0.311
  727    HG2  MET  89           HG2      MET  89  -8.478  -0.427  -1.531
  728    HG3  MET  89           HG1      MET  89 -10.147  -0.476  -2.095
  729    HE1  MET  89           HE1      MET  89  -8.398  -0.915  -4.027
  730    HE2  MET  89           HE2      MET  89  -6.935   0.024  -3.740
  731    HE3  MET  89           HE3      MET  89  -7.922   0.357  -5.160
  732    H    ASP  90           HN       ASP  90 -12.858   0.878   1.100
  733    HA   ASP  90           HA       ASP  90 -12.808   3.614   2.293
  734    HB2  ASP  90           HB2      ASP  90 -14.988   2.442   1.639
  735    HB3  ASP  90           HB1      ASP  90 -14.683   1.345   2.986
  736    H    PHE  91           HN       PHE  91 -11.470   3.871   3.980
  737    HA   PHE  91           HA       PHE  91 -10.563   1.502   5.523
  738    HB2  PHE  91           HB2      PHE  91  -9.652   4.392   5.643
  739    HB3  PHE  91           HB1      PHE  91  -8.866   3.014   6.417
  740    HD1  PHE  91           HD1      PHE  91  -8.276   1.001   4.829
  741    HD2  PHE  91           HD2      PHE  91  -8.945   5.028   3.492
  742    HE1  PHE  91           HE1      PHE  91  -7.041   0.512   2.738
  743    HE2  PHE  91           HE2      PHE  91  -7.705   4.540   1.401
  744    HZ   PHE  91           HZ       PHE  91  -6.752   2.282   1.023
  745    H    LEU  92           HN       LEU  92 -11.451   1.031   7.444
  746    HA   LEU  92           HA       LEU  92 -13.254   3.004   8.747
  747    HB2  LEU  92           HB2      LEU  92 -12.739   0.084   9.400
  748    HB3  LEU  92           HB1      LEU  92 -14.046   1.086  10.031
  749    HG   LEU  92           HG       LEU  92 -13.630   0.374   7.112
  750   HD11  LEU  92          HD11      LEU  92 -14.373  -1.551   8.424
  751   HD12  LEU  92          HD12      LEU  92 -15.701  -0.964   7.422
  752   HD13  LEU  92          HD13      LEU  92 -15.664  -0.589   9.145
  753   HD21  LEU  92          HD21      LEU  92 -16.086   1.319   7.089
  754   HD22  LEU  92          HD22      LEU  92 -14.733   2.444   7.060
  755   HD23  LEU  92          HD23      LEU  92 -15.594   2.142   8.570
  756    H    TYR  93           HN       TYR  93 -10.115   1.620   9.033
  757    HA   TYR  93           HA       TYR  93  -9.550   3.289  11.355
  758    HB2  TYR  93           HB2      TYR  93 -10.515   1.311  12.467
  759    HB3  TYR  93           HB1      TYR  93  -9.376   0.270  11.613
  760    HD1  TYR  93           HD2      TYR  93  -9.561   3.168  13.963
  761    HD2  TYR  93           HD1      TYR  93  -7.194  -0.091  12.466
  762    HE1  TYR  93           HE2      TYR  93  -7.859   3.598  15.714
  763    HE2  TYR  93           HE1      TYR  93  -5.492   0.342  14.218
  764    HH   TYR  93           HH       TYR  93  -5.782   3.111  16.417
  765    H    LEU  94           HN       LEU  94  -7.738   4.195  10.520
  766    HA   LEU  94           HA       LEU  94  -5.691   2.398   9.253
  767    HB2  LEU  94           HB2      LEU  94  -6.670   4.311   7.869
  768    HB3  LEU  94           HB1      LEU  94  -5.880   5.412   9.000
  769    HG   LEU  94           HG       LEU  94  -3.739   3.930   8.483
  770   HD11  LEU  94          HD11      LEU  94  -3.714   2.676   6.560
  771   HD12  LEU  94          HD12      LEU  94  -4.923   3.671   5.749
  772   HD13  LEU  94          HD13      LEU  94  -5.419   2.484   6.951
  773   HD21  LEU  94          HD21      LEU  94  -3.691   6.236   7.951
  774   HD22  LEU  94          HD22      LEU  94  -4.946   6.067   6.722
  775   HD23  LEU  94          HD23      LEU  94  -3.329   5.427   6.426
  776    H    HIS  95           HN       HIS  95  -3.899   2.076  10.426
  777    HA   HIS  95           HA       HIS  95  -3.056   4.154  12.413
  778    HB2  HIS  95           HB2      HIS  95  -4.192   2.276  13.567
  779    HB3  HIS  95           HB1      HIS  95  -3.054   1.148  12.831
  780    HD1  HIS  95           HD1      HIS  95  -0.648   1.105  13.740
  781    HD2  HIS  95           HD2      HIS  95  -3.071   3.927  15.622
  782    HE1  HIS  95           HE1      HIS  95   0.621   1.885  15.789
  783    H    ASN  96           HN       ASN  96  -1.283   4.919  11.371
  784    HA   ASN  96           HA       ASN  96   0.491   3.217   9.822
  785    HB2  ASN  96           HB2      ASN  96   0.621   6.102  10.711
  786    HB3  ASN  96           HB1      ASN  96   1.907   5.339   9.781
  787   HD21  ASN  96          HD21      ASN  96   0.456   7.499   8.667
  788   HD22  ASN  96          HD22      ASN  96  -0.501   6.922   7.392
  789    H    THR  97           HN       THR  97   2.987   3.716  10.362
  790    HA   THR  97           HA       THR  97   3.634   2.180  12.661
  791    HB   THR  97           HB       THR  97   5.967   2.925  12.205
  792    HG1  THR  97           HG1      THR  97   4.603   4.644  10.413
  793   HG21  THR  97          HG21      THR  97   4.194   2.122   9.894
  794   HG22  THR  97          HG22      THR  97   5.234   1.092  10.880
  795   HG23  THR  97          HG23      THR  97   5.947   2.229   9.734
  796    H    VAL  98           HN       VAL  98   3.304   5.684  12.236
  797    HA   VAL  98           HA       VAL  98   3.067   6.088  15.073
  798    HB   VAL  98           HB       VAL  98   5.530   5.773  14.921
  799   HG11  VAL  98          HG11      VAL  98   5.626   8.329  13.315
  800   HG12  VAL  98          HG12      VAL  98   5.573   6.751  12.527
  801   HG13  VAL  98          HG13      VAL  98   6.913   7.158  13.597
  802   HG21  VAL  98          HG21      VAL  98   5.259   8.712  15.436
  803   HG22  VAL  98          HG22      VAL  98   5.961   7.454  16.447
  804   HG23  VAL  98          HG23      VAL  98   4.214   7.649  16.376
  805    H    MET  99           HN       MET  99   1.532   6.758  12.783
  806    HA   MET  99           HA       MET  99   1.006   9.523  13.292
  807    HB2  MET  99           HB2      MET  99   1.581  10.343  10.963
  808    HB3  MET  99           HB1      MET  99   2.935  10.092  12.061
  809    HG2  MET  99           HG2      MET  99   3.101   7.725  11.000
  810    HG3  MET  99           HG1      MET  99   2.074   8.383   9.725
  811    HE1  MET  99           HE1      MET  99   3.316  11.612  10.023
  812    HE2  MET  99           HE2      MET  99   2.425  10.687   8.815
  813    HE3  MET  99           HE3      MET  99   3.989  11.385   8.404
  814    HA   PRO 100           HA       PRO 100  -2.270   6.852  11.277
  815    HB2  PRO 100           HB2      PRO 100  -4.319   7.695  12.937
  816    HB3  PRO 100           HB1      PRO 100  -3.267   6.309  13.281
  817    HG2  PRO 100           HG2      PRO 100  -3.109   9.103  14.316
  818    HG3  PRO 100           HG1      PRO 100  -2.864   7.569  15.170
  819    HD2  PRO 100           HD2      PRO 100  -0.795   9.093  14.370
  820    HD3  PRO 100           HD1      PRO 100  -0.682   7.321  14.381
  821    H    LEU 101           HN       LEU 101  -3.682   7.508   9.694
  822    HA   LEU 101           HA       LEU 101  -4.026  10.458   9.309
  823    HB2  LEU 101           HB2      LEU 101  -4.490   8.295   7.240
  824    HB3  LEU 101           HB1      LEU 101  -4.221  10.017   6.980
  825    HG   LEU 101           HG       LEU 101  -2.173   8.096   8.119
  826   HD11  LEU 101          HD11      LEU 101  -2.588   7.657   5.760
  827   HD12  LEU 101          HD12      LEU 101  -1.031   8.464   5.944
  828   HD13  LEU 101          HD13      LEU 101  -2.436   9.373   5.386
  829   HD21  LEU 101          HD21      LEU 101  -1.725  10.271   8.988
  830   HD22  LEU 101          HD22      LEU 101  -2.146  11.049   7.462
  831   HD23  LEU 101          HD23      LEU 101  -0.663  10.105   7.591
  832    H    LEU 102           HN       LEU 102  -5.763   7.363   8.829
  833    HA   LEU 102           HA       LEU 102  -8.330   8.851   9.278
  834    HB2  LEU 102           HB2      LEU 102  -7.743   7.568   7.019
  835    HB3  LEU 102           HB1      LEU 102  -8.207   6.145   7.949
  836    HG   LEU 102           HG       LEU 102 -10.168   6.975   6.782
  837   HD11  LEU 102          HD11      LEU 102 -11.675   7.110   8.607
  838   HD12  LEU 102          HD12      LEU 102 -10.477   7.886   9.646
  839   HD13  LEU 102          HD13      LEU 102 -10.304   6.184   9.221
  840   HD21  LEU 102          HD21      LEU 102 -10.737   9.183   6.569
  841   HD22  LEU 102          HD22      LEU 102  -9.053   9.480   6.988
  842   HD23  LEU 102          HD23      LEU 102 -10.301   9.576   8.230
  843    H    ASP 103           HN       ASP 103  -9.086   8.494  11.241
  844    HA   ASP 103           HA       ASP 103  -9.337   5.748  12.264
  845    HB2  ASP 103           HB2      ASP 103  -7.657   7.883  13.591
  846    HB3  ASP 103           HB1      ASP 103  -8.443   6.632  14.552
  847    H    GLN 104           HN       GLN 104 -11.483   6.817  11.481
  848    HA   GLN 104           HA       GLN 104 -12.665   8.554  13.595
  849    HB2  GLN 104           HB2      GLN 104 -13.589   7.798  10.813
  850    HB3  GLN 104           HB1      GLN 104 -14.574   8.719  11.952
  851    HG2  GLN 104           HG2      GLN 104 -12.807  10.427  12.112
  852    HG3  GLN 104           HG1      GLN 104 -11.819   9.516  10.972
  853   HE21  GLN 104          HE21      GLN 104 -11.888  10.686   9.040
  854   HE22  GLN 104          HE22      GLN 104 -13.307  11.263   8.310
  855    H    ARG 105           HN       ARG 105 -13.715   7.571  15.171
  856    HA   ARG 105           HA       ARG 105 -14.413   4.795  15.175
  857    HB2  ARG 105           HB2      ARG 105 -15.229   7.112  16.950
  858    HB3  ARG 105           HB1      ARG 105 -15.677   5.436  17.274
  859    HG2  ARG 105           HG2      ARG 105 -13.320   4.788  17.380
  860    HG3  ARG 105           HG1      ARG 105 -12.828   6.426  16.951
  861    HD2  ARG 105           HD2      ARG 105 -12.651   6.128  19.375
  862    HD3  ARG 105           HD1      ARG 105 -13.937   7.274  19.005
  863    HE   ARG 105           HE       ARG 105 -15.536   5.686  19.764
  864   HH11  ARG 105          HH21      ARG 105 -12.349   4.371  19.498
  865   HH12  ARG 105          HH22      ARG 105 -12.739   2.918  20.354
  866   HH21  ARG 105          HH11      ARG 105 -16.053   3.794  20.879
  867   HH22  ARG 105          HH12      ARG 105 -14.832   2.591  21.134
  868    H    TYR 106           HN       TYR 106 -16.234   7.752  14.486
  869    HA   TYR 106           HA       TYR 106 -18.856   6.726  14.519
  870    HB2  TYR 106           HB2      TYR 106 -17.687   8.757  12.590
  871    HB3  TYR 106           HB1      TYR 106 -19.402   8.534  12.937
  872    HD1  TYR 106           HD1      TYR 106 -20.261   8.950  15.274
  873    HD2  TYR 106           HD2      TYR 106 -16.283  10.016  14.051
  874    HE1  TYR 106           HE1      TYR 106 -20.067  10.469  17.225
  875    HE2  TYR 106           HE2      TYR 106 -16.089  11.534  16.000
  876    HH   TYR 106           HH       TYR 106 -17.032  12.173  17.934
  877    H    LEU 107           HN       LEU 107 -16.521   6.799  11.822
  878    HA   LEU 107           HA       LEU 107 -18.216   5.429   9.957
  879    HB2  LEU 107           HB2      LEU 107 -15.242   5.907  10.174
  880    HB3  LEU 107           HB1      LEU 107 -15.878   4.864   8.904
  881    HG   LEU 107           HG       LEU 107 -15.594   7.275   8.216
  882   HD11  LEU 107          HD11      LEU 107 -18.547   6.793   8.107
  883   HD12  LEU 107          HD12      LEU 107 -17.507   5.544   7.421
  884   HD13  LEU 107          HD13      LEU 107 -17.416   7.194   6.817
  885   HD21  LEU 107          HD21      LEU 107 -16.966   8.979   9.155
  886   HD22  LEU 107          HD22      LEU 107 -16.324   8.093  10.538
  887   HD23  LEU 107          HD23      LEU 107 -17.978   7.808   9.999
  888    H    LEU 108           HN       LEU 108 -15.845   4.364  12.341
  889    HA   LEU 108           HA       LEU 108 -15.737   1.622  11.606
  890    HB2  LEU 108           HB2      LEU 108 -14.350   3.045  13.335
  891    HB3  LEU 108           HB1      LEU 108 -15.581   2.528  14.484
  892    HG   LEU 108           HG       LEU 108 -13.933   0.661  12.751
  893   HD11  LEU 108          HD11      LEU 108 -13.728   1.102  15.737
  894   HD12  LEU 108          HD12      LEU 108 -12.704   1.945  14.575
  895   HD13  LEU 108          HD13      LEU 108 -12.631   0.188  14.701
  896   HD21  LEU 108          HD21      LEU 108 -14.887  -0.938  14.666
  897   HD22  LEU 108          HD22      LEU 108 -15.835  -0.586  13.225
  898   HD23  LEU 108          HD23      LEU 108 -16.171   0.274  14.727
  899    H    THR 109           HN       THR 109 -17.880   3.352  13.882
  900    HA   THR 109           HA       THR 109 -19.486   0.875  14.251
  901    HB   THR 109           HB       THR 109 -18.821   2.298  16.221
  902    HG1  THR 109           HG1      THR 109 -21.561   2.543  16.151
  903   HG21  THR 109          HG21      THR 109 -20.902   4.249  15.260
  904   HG22  THR 109          HG22      THR 109 -19.207   4.449  14.824
  905   HG23  THR 109          HG23      THR 109 -19.688   4.464  16.520
  906    H    GLY 110           HN       GLY 110 -19.355   3.420  12.122
  907    HA2  GLY 110           HA2      GLY 110 -20.899   4.376  10.642
  908    HA3  GLY 110           HA1      GLY 110 -21.744   2.834  10.777
  909    H    GLY 111           HN       GLY 111 -21.333   5.935  12.496
  910    HA2  GLY 111           HA2      GLY 111 -23.601   5.596  14.213
  911    HA3  GLY 111           HA1      GLY 111 -22.830   7.136  13.839
  912    H    GLN 112           HN       GLN 112 -25.697   6.492  14.048
  913    HA   GLN 112           HA       GLN 112 -26.750   6.601  11.312
  914    HB2  GLN 112           HB2      GLN 112 -28.039   6.754  14.046
  915    HB3  GLN 112           HB1      GLN 112 -28.951   6.876  12.540
  916    HG2  GLN 112           HG2      GLN 112 -28.108   4.682  11.829
  917    HG3  GLN 112           HG1      GLN 112 -27.158   4.556  13.309
  918   HE21  GLN 112          HE21      GLN 112 -29.690   6.065  14.562
  919   HE22  GLN 112          HE22      GLN 112 -30.733   4.768  14.895
  920    H    LEU 113           HN       LEU 113 -28.437   8.379  10.866
  921    HA   LEU 113           HA       LEU 113 -27.090  10.944  11.116
  922    HB2  LEU 113           HB2      LEU 113 -28.235  10.403   9.041
  923    HB3  LEU 113           HB1      LEU 113 -29.756  10.161   9.897
  924    HG   LEU 113           HG       LEU 113 -29.832  12.523  10.518
  925   HD11  LEU 113          HD11      LEU 113 -27.612  13.204  10.860
  926   HD12  LEU 113          HD12      LEU 113 -28.013  14.005   9.343
  927   HD13  LEU 113          HD13      LEU 113 -27.059  12.521   9.331
  928   HD21  LEU 113          HD21      LEU 113 -30.762  11.917   8.338
  929   HD22  LEU 113          HD22      LEU 113 -29.176  12.099   7.587
  930   HD23  LEU 113          HD23      LEU 113 -30.008  13.508   8.242
  931    H    GLU 114           HN       GLU 114 -27.493  12.508  12.590
  932    HA   GLU 114           HA       GLU 114 -29.295  11.986  14.801
  933    HB2  GLU 114           HB2      GLU 114 -27.155  13.207  15.078
  934    HB3  GLU 114           HB1      GLU 114 -27.790  14.521  14.087
  935    HG2  GLU 114           HG2      GLU 114 -29.590  14.912  15.699
  936    HG3  GLU 114           HG1      GLU 114 -29.041  13.547  16.672
  937    H    HIS 115           HN       HIS 115 -31.282  12.908  15.220
  938    HA   HIS 115           HA       HIS 115 -32.726  14.026  12.941
  939    HB2  HIS 115           HB2      HIS 115 -33.767  12.423  14.544
  940    HB3  HIS 115           HB1      HIS 115 -33.645  13.650  15.805
  941    HD1  HIS 115           HD1      HIS 115 -35.234  15.680  15.667
  942    HD2  HIS 115           HD2      HIS 115 -35.716  12.982  12.527
  943    HE1  HIS 115           HE1      HIS 115 -37.354  16.359  14.459
  944    H    HIS 116           HN       HIS 116 -33.248  16.137  12.618
  945    HA   HIS 116           HA       HIS 116 -31.864  18.183  14.113
  946    HB2  HIS 116           HB2      HIS 116 -34.045  18.353  12.015
  947    HB3  HIS 116           HB1      HIS 116 -33.137  19.736  12.627
  948    HD1  HIS 116           HD1      HIS 116 -30.456  19.599  12.257
  949    HD2  HIS 116           HD2      HIS 116 -32.744  16.951   9.991
  950    HE1  HIS 116           HE1      HIS 116 -28.956  18.772  10.390
  951    H    HIS 117           HN       HIS 117 -32.569  19.339  15.833
  952    HA   HIS 117           HA       HIS 117 -34.982  18.638  17.223
  953    HB2  HIS 117           HB2      HIS 117 -33.015  20.918  17.518
  954    HB3  HIS 117           HB1      HIS 117 -34.403  20.720  18.588
  955    HD1  HIS 117           HD1      HIS 117 -31.201  18.989  17.556
  956    HD2  HIS 117           HD2      HIS 117 -34.130  18.682  20.506
  957    HE1  HIS 117           HE1      HIS 117 -30.341  17.311  19.247
  958    H    HIS 118           HN       HIS 118 -34.099  21.312  15.058
  959    HA   HIS 118           HA       HIS 118 -37.000  21.943  14.771
  960    HB2  HIS 118           HB2      HIS 118 -35.837  23.485  16.470
  961    HB3  HIS 118           HB1      HIS 118 -34.936  24.129  15.096
  962    HD1  HIS 118           HD1      HIS 118 -36.871  24.494  12.929
  963    HD2  HIS 118           HD2      HIS 118 -37.996  25.148  16.888
  964    HE1  HIS 118           HE1      HIS 118 -38.915  25.985  12.853
  965    H    HIS 119           HN       HIS 119 -37.556  22.672  12.725
  966    HA   HIS 119           HA       HIS 119 -35.635  22.139  10.595
  967    HB2  HIS 119           HB2      HIS 119 -37.499  22.529   9.097
  968    HB3  HIS 119           HB1      HIS 119 -38.090  21.587  10.465
  969    HD1  HIS 119           HD1      HIS 119 -38.119  25.105   9.073
  970    HD2  HIS 119           HD2      HIS 119 -40.024  22.885  12.043
  971    HE1  HIS 119           HE1      HIS 119 -40.014  26.544   9.939
  972    H    HIS 120           HN       HIS 120 -35.635  24.602  12.581
  973    HA   HIS 120           HA       HIS 120 -35.064  26.874  12.476
  974    HB2  HIS 120           HB2      HIS 120 -33.781  25.892   9.909
  975    HB3  HIS 120           HB1      HIS 120 -33.408  27.416  10.717
  976    HD1  HIS 120           HD1      HIS 120 -32.522  27.136  13.286
  977    HD2  HIS 120           HD2      HIS 120 -32.317  23.743  10.875
  978    HE1  HIS 120           HE1      HIS 120 -30.923  25.540  14.430
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1  -6.570  -9.921  17.219
    2    H2   MET   1           HT2      MET   1  -7.806  -9.020  16.477
    3    H3   MET   1           HT3      MET   1  -7.972 -10.699  16.669
    4    HA   MET   1           HA       MET   1  -8.047 -10.466  19.061
    5    HB2  MET   1           HB2      MET   1  -7.735  -7.531  18.378
    6    HB3  MET   1           HB1      MET   1  -8.224  -8.125  19.964
    7    HG2  MET   1           HG2      MET   1  -6.136  -9.376  20.176
    8    HG3  MET   1           HG1      MET   1  -5.652  -8.880  18.555
    9    HE1  MET   1           HE1      MET   1  -6.719  -7.985  21.960
   10    HE2  MET   1           HE2      MET   1  -7.428  -6.469  21.409
   11    HE3  MET   1           HE3      MET   1  -5.960  -6.445  22.382
   12    H    THR   2           HN       THR   2  -9.693  -7.598  18.974
   13    HA   THR   2           HA       THR   2 -12.265  -8.977  18.320
   14    HB   THR   2           HB       THR   2 -11.697  -6.434  19.868
   15    HG1  THR   2           HG1      THR   2 -11.139  -8.216  21.059
   16   HG21  THR   2          HG21      THR   2 -14.250  -7.877  19.147
   17   HG22  THR   2          HG22      THR   2 -13.840  -6.183  18.872
   18   HG23  THR   2          HG23      THR   2 -14.154  -6.760  20.509
   19    H    LEU   3           HN       LEU   3 -10.042  -6.665  17.137
   20    HA   LEU   3           HA       LEU   3 -11.820  -4.888  15.735
   21    HB2  LEU   3           HB2      LEU   3  -9.047  -5.757  14.872
   22    HB3  LEU   3           HB1      LEU   3  -9.872  -4.263  14.429
   23    HG   LEU   3           HG       LEU   3  -9.044  -5.049  17.242
   24   HD11  LEU   3          HD11      LEU   3  -7.939  -2.891  15.420
   25   HD12  LEU   3          HD12      LEU   3  -7.164  -4.452  15.687
   26   HD13  LEU   3          HD13      LEU   3  -7.349  -3.319  17.026
   27   HD21  LEU   3          HD21      LEU   3 -10.930  -3.656  17.501
   28   HD22  LEU   3          HD22      LEU   3 -10.535  -2.694  16.077
   29   HD23  LEU   3          HD23      LEU   3  -9.592  -2.510  17.556
   30    H    GLU   4           HN       GLU   4 -10.304  -7.968  14.846
   31    HA   GLU   4           HA       GLU   4 -11.171  -8.039  12.122
   32    HB2  GLU   4           HB2      GLU   4 -10.775 -10.482  12.298
   33    HB3  GLU   4           HB1      GLU   4  -9.456  -9.567  13.030
   34    HG2  GLU   4           HG2      GLU   4 -10.787  -9.827  15.251
   35    HG3  GLU   4           HG1      GLU   4 -11.673 -11.094  14.402
   36    H    LEU   5           HN       LEU   5 -12.624  -9.451  15.049
   37    HA   LEU   5           HA       LEU   5 -14.965 -10.438  13.715
   38    HB2  LEU   5           HB2      LEU   5 -14.282 -11.259  15.941
   39    HB3  LEU   5           HB1      LEU   5 -14.565  -9.659  16.623
   40    HG   LEU   5           HG       LEU   5 -16.952  -9.811  16.052
   41   HD11  LEU   5          HD11      LEU   5 -17.159 -11.102  14.125
   42   HD12  LEU   5          HD12      LEU   5 -17.683 -12.258  15.348
   43   HD13  LEU   5          HD13      LEU   5 -16.044 -12.341  14.702
   44   HD21  LEU   5          HD21      LEU   5 -15.754 -12.112  17.609
   45   HD22  LEU   5          HD22      LEU   5 -17.495 -11.849  17.520
   46   HD23  LEU   5          HD23      LEU   5 -16.454 -10.619  18.234
   47    H    GLN   6           HN       GLN   6 -14.201  -7.433  15.380
   48    HA   GLN   6           HA       GLN   6 -16.816  -6.275  15.276
   49    HB2  GLN   6           HB2      GLN   6 -15.014  -5.390  16.712
   50    HB3  GLN   6           HB1      GLN   6 -14.101  -4.936  15.274
   51    HG2  GLN   6           HG2      GLN   6 -15.770  -3.345  14.610
   52    HG3  GLN   6           HG1      GLN   6 -16.881  -3.902  15.860
   53   HE21  GLN   6          HE21      GLN   6 -16.004  -1.161  15.677
   54   HE22  GLN   6          HE22      GLN   6 -15.071  -0.819  17.054
   55    H    LEU   7           HN       LEU   7 -14.117  -6.287  12.995
   56    HA   LEU   7           HA       LEU   7 -15.162  -4.343  11.183
   57    HB2  LEU   7           HB2      LEU   7 -12.839  -5.180  11.068
   58    HB3  LEU   7           HB1      LEU   7 -13.439  -6.771  10.606
   59    HG   LEU   7           HG       LEU   7 -14.445  -5.796   8.558
   60   HD11  LEU   7          HD11      LEU   7 -14.953  -3.565   9.019
   61   HD12  LEU   7          HD12      LEU   7 -13.504  -3.391   8.034
   62   HD13  LEU   7          HD13      LEU   7 -13.396  -3.258   9.789
   63   HD21  LEU   7          HD21      LEU   7 -11.497  -5.386   9.079
   64   HD22  LEU   7          HD22      LEU   7 -12.202  -5.088   7.491
   65   HD23  LEU   7          HD23      LEU   7 -12.288  -6.698   8.204
   66    H    LYS   8           HN       LYS   8 -15.526  -7.873  11.302
   67    HA   LYS   8           HA       LYS   8 -17.129  -8.115   8.941
   68    HB2  LYS   8           HB2      LYS   8 -16.014 -10.021  10.121
   69    HB3  LYS   8           HB1      LYS   8 -17.193  -9.855  11.422
   70    HG2  LYS   8           HG2      LYS   8 -19.023 -10.316   9.875
   71    HG3  LYS   8           HG1      LYS   8 -17.897 -10.388   8.521
   72    HD2  LYS   8           HD2      LYS   8 -16.753 -12.310   9.590
   73    HD3  LYS   8           HD1      LYS   8 -17.913 -12.251  10.917
   74    HE2  LYS   8           HE2      LYS   8 -18.675 -12.636   8.009
   75    HE3  LYS   8           HE1      LYS   8 -18.496 -13.952   9.166
   76    HZ1  LYS   8           HZ1      LYS   8 -20.664 -12.134   8.815
   77    HZ2  LYS   8           HZ2      LYS   8 -20.108 -12.132  10.421
   78    HZ3  LYS   8           HZ3      LYS   8 -20.607 -13.584   9.692
   79    H    HIS   9           HN       HIS   9 -17.963  -7.588  12.341
   80    HA   HIS   9           HA       HIS   9 -20.806  -7.781  12.032
   81    HB2  HIS   9           HB2      HIS   9 -19.649  -7.823  14.227
   82    HB3  HIS   9           HB1      HIS   9 -19.208  -6.129  14.006
   83    HD1  HIS   9           HD1      HIS   9 -20.759  -4.597  15.206
   84    HD2  HIS   9           HD2      HIS   9 -22.726  -8.016  13.854
   85    HE1  HIS   9           HE1      HIS   9 -23.179  -4.359  15.915
   86    H    TYR  10           HN       TYR  10 -18.631  -4.951  11.992
   87    HA   TYR  10           HA       TYR  10 -20.684  -3.007  11.540
   88    HB2  TYR  10           HB2      TYR  10 -18.447  -2.353  12.267
   89    HB3  TYR  10           HB1      TYR  10 -17.756  -2.972  10.767
   90    HD1  TYR  10           HD1      TYR  10 -20.249  -0.512  12.073
   91    HD2  TYR  10           HD2      TYR  10 -17.604  -1.584   8.865
   92    HE1  TYR  10           HE1      TYR  10 -20.715   1.654  10.963
   93    HE2  TYR  10           HE2      TYR  10 -18.071   0.583   7.756
   94    HH   TYR  10           HH       TYR  10 -19.018   2.599   7.993
   95    H    ILE  11           HN       ILE  11 -18.566  -4.718   9.227
   96    HA   ILE  11           HA       ILE  11 -19.653  -3.475   6.881
   97    HB   ILE  11           HB       ILE  11 -18.308  -6.161   7.267
   98   HG12  ILE  11          HG12      ILE  11 -16.922  -4.194   7.799
   99   HG13  ILE  11          HG11      ILE  11 -16.342  -5.007   6.351
  100   HG21  ILE  11          HG21      ILE  11 -17.871  -5.900   4.748
  101   HG22  ILE  11          HG22      ILE  11 -19.178  -4.717   4.764
  102   HG23  ILE  11          HG23      ILE  11 -19.498  -6.389   5.224
  103   HD11  ILE  11          HD11      ILE  11 -16.320  -2.856   5.545
  104   HD12  ILE  11          HD12      ILE  11 -17.576  -2.312   6.648
  105   HD13  ILE  11          HD13      ILE  11 -18.008  -3.198   5.192
  106    H    THR  12           HN       THR  12 -20.500  -6.484   8.562
  107    HA   THR  12           HA       THR  12 -22.485  -7.331   6.693
  108    HB   THR  12           HB       THR  12 -23.377  -8.620   8.709
  109    HG1  THR  12           HG1      THR  12 -21.173  -8.174  10.173
  110   HG21  THR  12          HG21      THR  12 -21.126  -9.887   8.962
  111   HG22  THR  12          HG22      THR  12 -20.516  -8.748   7.766
  112   HG23  THR  12          HG23      THR  12 -21.862  -9.816   7.364
  113    H    ASN  13           HN       ASN  13 -22.751  -5.391   9.660
  114    HA   ASN  13           HA       ASN  13 -25.599  -5.075   9.570
  115    HB2  ASN  13           HB2      ASN  13 -23.363  -3.479  10.819
  116    HB3  ASN  13           HB1      ASN  13 -25.044  -2.973  10.964
  117   HD21  ASN  13          HD21      ASN  13 -23.591  -3.726  13.288
  118   HD22  ASN  13          HD22      ASN  13 -24.219  -5.189  13.876
  119    H    LEU  14           HN       LEU  14 -22.936  -3.163   8.225
  120    HA   LEU  14           HA       LEU  14 -24.541  -1.005   7.265
  121    HB2  LEU  14           HB2      LEU  14 -22.102  -0.822   7.414
  122    HB3  LEU  14           HB1      LEU  14 -21.916  -2.094   6.210
  123    HG   LEU  14           HG       LEU  14 -23.011  -0.692   4.513
  124   HD11  LEU  14          HD11      LEU  14 -23.323   1.813   5.276
  125   HD12  LEU  14          HD12      LEU  14 -23.463   1.107   6.886
  126   HD13  LEU  14          HD13      LEU  14 -24.587   0.633   5.614
  127   HD21  LEU  14          HD21      LEU  14 -20.928   0.991   5.925
  128   HD22  LEU  14          HD22      LEU  14 -21.244   0.881   4.194
  129   HD23  LEU  14          HD23      LEU  14 -20.522  -0.484   5.046
  130    H    PHE  15           HN       PHE  15 -23.502  -4.023   5.697
  131    HA   PHE  15           HA       PHE  15 -25.191  -3.359   3.330
  132    HB2  PHE  15           HB2      PHE  15 -23.051  -5.426   3.869
  133    HB3  PHE  15           HB1      PHE  15 -24.085  -5.512   2.442
  134    HD1  PHE  15           HD1      PHE  15 -24.109  -3.590   0.813
  135    HD2  PHE  15           HD2      PHE  15 -21.255  -3.848   4.014
  136    HE1  PHE  15           HE1      PHE  15 -22.683  -1.911  -0.324
  137    HE2  PHE  15           HE2      PHE  15 -19.829  -2.167   2.877
  138    HZ   PHE  15           HZ       PHE  15 -20.544  -1.198   0.708
  139    H    ASN  16           HN       ASN  16 -25.630  -4.702   6.267
  140    HA   ASN  16           HA       ASN  16 -27.223  -6.161   7.172
  141    HB2  ASN  16           HB2      ASN  16 -28.659  -4.619   5.755
  142    HB3  ASN  16           HB1      ASN  16 -28.628  -5.862   4.504
  143   HD21  ASN  16          HD21      ASN  16 -30.867  -6.466   4.687
  144   HD22  ASN  16          HD22      ASN  16 -31.504  -7.196   6.081
  145    H    LEU  17           HN       LEU  17 -24.994  -7.407   5.993
  146    HA   LEU  17           HA       LEU  17 -26.016  -9.667   4.395
  147    HB2  LEU  17           HB2      LEU  17 -23.235  -9.140   5.479
  148    HB3  LEU  17           HB1      LEU  17 -23.653 -10.350   4.276
  149    HG   LEU  17           HG       LEU  17 -24.250  -7.414   3.868
  150   HD11  LEU  17          HD11      LEU  17 -21.861  -7.535   4.183
  151   HD12  LEU  17          HD12      LEU  17 -22.176  -7.387   2.455
  152   HD13  LEU  17          HD13      LEU  17 -21.748  -8.954   3.141
  153   HD21  LEU  17          HD21      LEU  17 -24.083  -9.844   2.070
  154   HD22  LEU  17          HD22      LEU  17 -24.082  -8.199   1.440
  155   HD23  LEU  17          HD23      LEU  17 -25.470  -8.792   2.344
  156    HA   PRO  18           HA       PRO  18 -26.737 -12.290   7.897
  157    HB2  PRO  18           HB2      PRO  18 -26.180 -14.763   6.817
  158    HB3  PRO  18           HB1      PRO  18 -27.651 -13.843   6.446
  159    HG2  PRO  18           HG2      PRO  18 -25.106 -14.043   4.886
  160    HG3  PRO  18           HG1      PRO  18 -26.784 -14.134   4.315
  161    HD2  PRO  18           HD2      PRO  18 -25.353 -11.872   4.066
  162    HD3  PRO  18           HD1      PRO  18 -27.091 -11.820   4.432
  163    H    ARG  19           HN       ARG  19 -25.600 -13.095   9.640
  164    HA   ARG  19           HA       ARG  19 -22.655 -13.032   9.491
  165    HB2  ARG  19           HB2      ARG  19 -24.576 -13.488  11.787
  166    HB3  ARG  19           HB1      ARG  19 -22.826 -13.385  11.965
  167    HG2  ARG  19           HG2      ARG  19 -24.296 -11.150  10.569
  168    HG3  ARG  19           HG1      ARG  19 -24.324 -11.232  12.329
  169    HD2  ARG  19           HD2      ARG  19 -21.777 -11.278  10.686
  170    HD3  ARG  19           HD1      ARG  19 -22.448  -9.823  11.423
  171    HE   ARG  19           HE       ARG  19 -22.218 -11.811  13.440
  172   HH11  ARG  19          HH21      ARG  19 -20.295  -9.869  11.342
  173   HH12  ARG  19          HH22      ARG  19 -18.944  -9.809  12.424
  174   HH21  ARG  19          HH11      ARG  19 -20.470 -11.752  14.854
  175   HH22  ARG  19          HH12      ARG  19 -19.043 -10.875  14.412
  176    H    ASP  20           HN       ASP  20 -25.110 -15.382   9.204
  177    HA   ASP  20           HA       ASP  20 -23.532 -17.587  10.325
  178    HB2  ASP  20           HB2      ASP  20 -25.342 -19.014   9.603
  179    HB3  ASP  20           HB1      ASP  20 -26.068 -17.545  10.252
  180    H    GLU  21           HN       GLU  21 -23.166 -15.747   7.642
  181    HA   GLU  21           HA       GLU  21 -22.677 -17.775   5.632
  182    HB2  GLU  21           HB2      GLU  21 -23.185 -15.370   5.129
  183    HB3  GLU  21           HB1      GLU  21 -21.589 -14.951   5.750
  184    HG2  GLU  21           HG2      GLU  21 -21.398 -15.142   3.355
  185    HG3  GLU  21           HG1      GLU  21 -20.610 -16.557   4.050
  186    H    LYS  22           HN       LYS  22 -20.844 -18.920   5.260
  187    HA   LYS  22           HA       LYS  22 -18.661 -18.755   7.210
  188    HB2  LYS  22           HB2      LYS  22 -18.949 -20.482   4.733
  189    HB3  LYS  22           HB1      LYS  22 -17.790 -20.727   6.038
  190    HG2  LYS  22           HG2      LYS  22 -20.774 -20.694   6.529
  191    HG3  LYS  22           HG1      LYS  22 -19.913 -22.172   6.109
  192    HD2  LYS  22           HD2      LYS  22 -18.416 -21.828   8.067
  193    HD3  LYS  22           HD1      LYS  22 -19.349 -20.402   8.510
  194    HE2  LYS  22           HE2      LYS  22 -21.374 -21.779   8.725
  195    HE3  LYS  22           HE1      LYS  22 -20.441 -23.214   8.298
  196    HZ1  LYS  22           HZ1      LYS  22 -20.671 -22.952  10.703
  197    HZ2  LYS  22           HZ2      LYS  22 -19.896 -21.443  10.619
  198    HZ3  LYS  22           HZ3      LYS  22 -19.048 -22.860  10.221
  199    H    TRP  23           HN       TRP  23 -17.102 -17.285   6.963
  200    HA   TRP  23           HA       TRP  23 -16.449 -16.261   4.252
  201    HB2  TRP  23           HB2      TRP  23 -15.822 -15.352   7.064
  202    HB3  TRP  23           HB1      TRP  23 -14.945 -14.697   5.683
  203    HD1  TRP  23           HD1      TRP  23 -18.603 -15.572   5.220
  204    HE1  TRP  23           HE1      TRP  23 -19.959 -13.397   4.943
  205    HE3  TRP  23           HE3      TRP  23 -15.008 -12.145   6.387
  206    HZ2  TRP  23           HZ2      TRP  23 -19.564 -10.570   5.186
  207    HZ3  TRP  23           HZ3      TRP  23 -15.520  -9.721   6.357
  208    HH2  TRP  23           HH2      TRP  23 -17.792  -8.930   5.759
  209    H    GLU  24           HN       GLU  24 -14.374 -16.433   3.379
  210    HA   GLU  24           HA       GLU  24 -12.575 -18.452   4.681
  211    HB2  GLU  24           HB2      GLU  24 -13.007 -17.706   1.780
  212    HB3  GLU  24           HB1      GLU  24 -11.696 -18.753   2.328
  213    HG2  GLU  24           HG2      GLU  24 -13.321 -20.306   3.313
  214    HG3  GLU  24           HG1      GLU  24 -14.646 -19.248   2.828
  215    H    CYS  25           HN       CYS  25 -10.766 -17.619   5.511
  216    HA   CYS  25           HA       CYS  25  -9.926 -14.883   4.804
  217    HB2  CYS  25           HB2      CYS  25  -8.472 -16.701   6.718
  218    HB3  CYS  25           HB1      CYS  25  -8.630 -14.945   6.763
  219    HG   CYS  25           HG       CYS  25 -10.702 -16.964   7.815
  220    H    GLU  26           HN       GLU  26  -8.247 -14.423   3.481
  221    HA   GLU  26           HA       GLU  26  -6.483 -16.674   2.564
  222    HB2  GLU  26           HB2      GLU  26  -7.457 -14.197   1.118
  223    HB3  GLU  26           HB1      GLU  26  -6.164 -15.234   0.502
  224    HG2  GLU  26           HG2      GLU  26  -7.687 -17.169   0.564
  225    HG3  GLU  26           HG1      GLU  26  -8.978 -16.138   1.176
  226    H    SER  27           HN       SER  27  -4.553 -16.510   3.513
  227    HA   SER  27           HA       SER  27  -3.535 -13.855   4.367
  228    HB2  SER  27           HB2      SER  27  -3.503 -15.845   5.921
  229    HB3  SER  27           HB1      SER  27  -2.332 -16.596   4.841
  230    HG   SER  27           HG       SER  27  -0.845 -15.226   5.495
  231    H    ILE  28           HN       ILE  28  -2.720 -12.882   2.561
  232    HA   ILE  28           HA       ILE  28  -0.444 -14.256   1.188
  233    HB   ILE  28           HB       ILE  28  -2.401 -14.304  -0.308
  234   HG12  ILE  28          HG12      ILE  28  -0.429 -12.177  -1.182
  235   HG13  ILE  28          HG11      ILE  28  -0.060 -13.902  -1.158
  236   HG21  ILE  28          HG21      ILE  28  -3.475 -12.266  -1.047
  237   HG22  ILE  28          HG22      ILE  28  -2.350 -11.281  -0.111
  238   HG23  ILE  28          HG23      ILE  28  -3.526 -12.305   0.715
  239   HD11  ILE  28          HD11      ILE  28  -0.795 -13.211  -3.401
  240   HD12  ILE  28          HD12      ILE  28  -2.305 -12.599  -2.724
  241   HD13  ILE  28          HD13      ILE  28  -1.956 -14.328  -2.683
  242    H    GLU  29           HN       GLU  29   1.320 -12.963   0.887
  243    HA   GLU  29           HA       GLU  29   1.256 -10.311   2.206
  244    HB2  GLU  29           HB2      GLU  29   3.021 -11.961   2.792
  245    HB3  GLU  29           HB1      GLU  29   3.592 -11.904   1.123
  246    HG2  GLU  29           HG2      GLU  29   4.068  -9.516   1.332
  247    HG3  GLU  29           HG1      GLU  29   3.426  -9.510   2.974
  248    H    GLU  30           HN       GLU  30   1.353  -8.431   1.094
  249    HA   GLU  30           HA       GLU  30   2.387  -8.425  -1.692
  250    HB2  GLU  30           HB2      GLU  30  -0.387  -7.519  -0.894
  251    HB3  GLU  30           HB1      GLU  30   0.390  -7.039  -2.403
  252    HG2  GLU  30           HG2      GLU  30   0.650  -9.415  -3.024
  253    HG3  GLU  30           HG1      GLU  30  -0.136  -9.890  -1.520
  254    H    VAL  31           HN       VAL  31   2.802  -6.238  -2.464
  255    HA   VAL  31           HA       VAL  31   3.989  -4.593  -0.415
  256    HB   VAL  31           HB       VAL  31   3.501  -3.819  -3.289
  257   HG11  VAL  31          HG11      VAL  31   4.302  -2.064  -1.709
  258   HG12  VAL  31          HG12      VAL  31   5.499  -2.450  -2.945
  259   HG13  VAL  31          HG13      VAL  31   5.681  -3.088  -1.309
  260   HG21  VAL  31          HG21      VAL  31   5.697  -4.844  -3.758
  261   HG22  VAL  31          HG22      VAL  31   4.560  -6.056  -3.169
  262   HG23  VAL  31          HG23      VAL  31   5.795  -5.408  -2.090
  263    H    ALA  32           HN       ALA  32   3.364  -2.589   0.338
  264    HA   ALA  32           HA       ALA  32   0.568  -2.050   0.584
  265    HB1  ALA  32           HB1      ALA  32   2.060  -1.220   2.266
  266    HB2  ALA  32           HB2      ALA  32   1.415   0.200   1.440
  267    HB3  ALA  32           HB3      ALA  32   3.038  -0.378   1.063
  268    H    ASP  33           HN       ASP  33   3.036  -0.780  -1.625
  269    HA   ASP  33           HA       ASP  33   1.331   1.276  -2.750
  270    HB2  ASP  33           HB2      ASP  33   3.881   1.181  -2.843
  271    HB3  ASP  33           HB1      ASP  33   3.689  -0.033  -4.106
  272    H    ASP  34           HN       ASP  34   1.322  -2.096  -3.055
  273    HA   ASP  34           HA       ASP  34   0.281  -2.086  -5.832
  274    HB2  ASP  34           HB2      ASP  34   0.812  -4.291  -3.830
  275    HB3  ASP  34           HB1      ASP  34   0.073  -4.580  -5.405
  276    H    ILE  35           HN       ILE  35  -0.892  -2.081  -2.563
  277    HA   ILE  35           HA       ILE  35  -3.672  -2.700  -3.522
  278    HB   ILE  35           HB       ILE  35  -3.940  -2.723  -0.821
  279   HG12  ILE  35          HG12      ILE  35  -1.160  -3.864  -1.190
  280   HG13  ILE  35          HG11      ILE  35  -1.397  -2.189  -0.703
  281   HG21  ILE  35          HG21      ILE  35  -3.502  -5.205  -0.942
  282   HG22  ILE  35          HG22      ILE  35  -2.923  -4.956  -2.589
  283   HG23  ILE  35          HG23      ILE  35  -4.597  -4.585  -2.177
  284   HD11  ILE  35          HD11      ILE  35  -2.714  -2.908   1.236
  285   HD12  ILE  35          HD12      ILE  35  -1.134  -3.692   1.260
  286   HD13  ILE  35          HD13      ILE  35  -2.557  -4.591   0.735
  287    H    LEU  36           HN       LEU  36  -2.542  -0.854  -0.725
  288    HA   LEU  36           HA       LEU  36  -4.589   1.042  -0.781
  289    HB2  LEU  36           HB2      LEU  36  -1.748   1.554   0.143
  290    HB3  LEU  36           HB1      LEU  36  -3.201   2.363   0.722
  291    HG   LEU  36           HG       LEU  36  -2.536  -0.577   1.043
  292   HD11  LEU  36          HD11      LEU  36  -2.972   1.464   3.225
  293   HD12  LEU  36          HD12      LEU  36  -1.379   1.210   2.511
  294   HD13  LEU  36          HD13      LEU  36  -2.197  -0.115   3.339
  295   HD21  LEU  36          HD21      LEU  36  -5.034   1.031   1.570
  296   HD22  LEU  36          HD22      LEU  36  -4.659  -0.355   2.592
  297   HD23  LEU  36          HD23      LEU  36  -4.877  -0.576   0.859
  298    HA   PRO  37           HA       PRO  37  -3.718   3.615  -4.267
  299    HB2  PRO  37           HB2      PRO  37  -4.663   6.052  -3.398
  300    HB3  PRO  37           HB1      PRO  37  -5.719   4.706  -3.876
  301    HG2  PRO  37           HG2      PRO  37  -4.845   5.528  -1.135
  302    HG3  PRO  37           HG1      PRO  37  -6.465   5.086  -1.709
  303    HD2  PRO  37           HD2      PRO  37  -4.949   3.316  -0.376
  304    HD3  PRO  37           HD1      PRO  37  -5.981   2.795  -1.722
  305    H    ASP  38           HN       ASP  38  -2.122   4.966  -5.057
  306    HA   ASP  38           HA       ASP  38   0.276   5.315  -3.641
  307    HB2  ASP  38           HB2      ASP  38  -0.153   5.535  -6.158
  308    HB3  ASP  38           HB1      ASP  38  -0.651   7.192  -5.815
  309    H    GLN  39           HN       GLN  39  -2.641   7.124  -3.437
  310    HA   GLN  39           HA       GLN  39  -1.584   9.655  -2.572
  311    HB2  GLN  39           HB2      GLN  39  -3.936   9.320  -3.299
  312    HB3  GLN  39           HB1      GLN  39  -4.222   8.351  -1.853
  313    HG2  GLN  39           HG2      GLN  39  -3.725  10.253  -0.418
  314    HG3  GLN  39           HG1      GLN  39  -3.283  11.232  -1.816
  315   HE21  GLN  39          HE21      GLN  39  -4.955  12.775  -1.896
  316   HE22  GLN  39          HE22      GLN  39  -6.606  12.387  -1.958
  317    H    TYR  40           HN       TYR  40  -2.465   6.696  -0.835
  318    HA   TYR  40           HA       TYR  40  -1.751   7.936   1.755
  319    HB2  TYR  40           HB2      TYR  40  -3.679   6.457   1.746
  320    HB3  TYR  40           HB1      TYR  40  -2.730   5.167   1.009
  321    HD1  TYR  40           HD1      TYR  40  -2.376   7.505   3.935
  322    HD2  TYR  40           HD2      TYR  40  -2.062   3.475   2.478
  323    HE1  TYR  40           HE1      TYR  40  -1.640   6.753   6.173
  324    HE2  TYR  40           HE2      TYR  40  -1.343   2.721   4.730
  325    HH   TYR  40           HH       TYR  40  -0.780   3.352   6.781
  326    H    VAL  41           HN       VAL  41   0.004   6.798  -0.715
  327    HA   VAL  41           HA       VAL  41   1.991   5.331   0.975
  328    HB   VAL  41           HB       VAL  41   1.878   5.640  -2.034
  329   HG11  VAL  41          HG11      VAL  41   3.605   4.053  -0.141
  330   HG12  VAL  41          HG12      VAL  41   4.108   5.135  -1.441
  331   HG13  VAL  41          HG13      VAL  41   3.402   3.566  -1.825
  332   HG21  VAL  41          HG21      VAL  41   0.875   3.477  -2.135
  333   HG22  VAL  41          HG22      VAL  41  -0.045   4.346  -0.910
  334   HG23  VAL  41          HG23      VAL  41   1.178   3.173  -0.426
  335    H    ARG  42           HN       ARG  42   1.272   8.397  -0.048
  336    HA   ARG  42           HA       ARG  42   3.900   9.379  -0.798
  337    HB2  ARG  42           HB2      ARG  42   1.413  10.766   0.250
  338    HB3  ARG  42           HB1      ARG  42   2.868  11.635  -0.232
  339    HG2  ARG  42           HG2      ARG  42   2.693  10.679  -2.501
  340    HG3  ARG  42           HG1      ARG  42   1.248   9.794  -2.014
  341    HD2  ARG  42           HD2      ARG  42   0.098  11.920  -1.530
  342    HD3  ARG  42           HD1      ARG  42   1.536  12.814  -2.012
  343    HE   ARG  42           HE       ARG  42  -0.331  11.421  -3.826
  344   HH11  ARG  42          HH21      ARG  42   2.686  13.040  -3.330
  345   HH12  ARG  42          HH22      ARG  42   2.944  13.333  -5.015
  346   HH21  ARG  42          HH11      ARG  42   0.004  11.802  -6.012
  347   HH22  ARG  42          HH12      ARG  42   1.433  12.631  -6.531
  348    H    LEU  43           HN       LEU  43   2.701   8.183   2.061
  349    HA   LEU  43           HA       LEU  43   3.735   9.971   4.031
  350    HB2  LEU  43           HB2      LEU  43   3.075   7.038   3.980
  351    HB3  LEU  43           HB1      LEU  43   3.799   7.753   5.417
  352    HG   LEU  43           HG       LEU  43   1.278   7.693   5.444
  353   HD11  LEU  43          HD11      LEU  43   1.995  10.607   5.409
  354   HD12  LEU  43          HD12      LEU  43   2.881   9.565   6.521
  355   HD13  LEU  43          HD13      LEU  43   1.127   9.672   6.625
  356   HD21  LEU  43          HD21      LEU  43   0.017   9.094   3.963
  357   HD22  LEU  43          HD22      LEU  43   1.133   8.188   2.943
  358   HD23  LEU  43          HD23      LEU  43   1.474   9.871   3.347
  359    H    GLY  44           HN       GLY  44   5.228   7.201   2.379
  360    HA2  GLY  44           HA2      GLY  44   7.651   7.448   1.805
  361    HA3  GLY  44           HA1      GLY  44   7.901   8.135   3.402
  362    HA   PRO  45           HA       PRO  45   8.737   4.228   5.303
  363    HB2  PRO  45           HB2      PRO  45   6.186   4.314   6.871
  364    HB3  PRO  45           HB1      PRO  45   7.855   4.116   7.444
  365    HG2  PRO  45           HG2      PRO  45   6.541   6.423   7.738
  366    HG3  PRO  45           HG1      PRO  45   8.280   6.381   7.395
  367    HD2  PRO  45           HD2      PRO  45   6.016   7.070   5.565
  368    HD3  PRO  45           HD1      PRO  45   7.679   7.693   5.591
  369    H    LEU  46           HN       LEU  46   5.354   4.575   4.305
  370    HA   LEU  46           HA       LEU  46   5.030   1.669   3.952
  371    HB2  LEU  46           HB2      LEU  46   3.202   3.971   3.213
  372    HB3  LEU  46           HB1      LEU  46   2.758   2.264   3.201
  373    HG   LEU  46           HG       LEU  46   3.664   3.823   5.644
  374   HD11  LEU  46          HD11      LEU  46   1.478   4.585   5.142
  375   HD12  LEU  46          HD12      LEU  46   1.225   3.302   6.326
  376   HD13  LEU  46          HD13      LEU  46   0.952   2.988   4.613
  377   HD21  LEU  46          HD21      LEU  46   2.603   1.632   6.710
  378   HD22  LEU  46          HD22      LEU  46   4.269   1.619   6.137
  379   HD23  LEU  46          HD23      LEU  46   2.990   0.929   5.139
  380    H    SER  47           HN       SER  47   6.577   4.001   2.272
  381    HA   SER  47           HA       SER  47   5.909   4.059  -0.381
  382    HB2  SER  47           HB2      SER  47   8.599   3.592   0.892
  383    HB3  SER  47           HB1      SER  47   8.432   3.796  -0.849
  384    HG   SER  47           HG       SER  47   7.221   5.618   0.915
  385    H    ASN  48           HN       ASN  48   8.474   1.742   0.162
  386    HA   ASN  48           HA       ASN  48   6.988  -0.247  -1.517
  387    HB2  ASN  48           HB2      ASN  48   9.156   0.605  -2.395
  388    HB3  ASN  48           HB1      ASN  48   9.958  -0.011  -0.949
  389   HD21  ASN  48          HD21      ASN  48   7.835  -1.163  -3.624
  390   HD22  ASN  48          HD22      ASN  48   8.520  -2.713  -3.694
  391    H    LYS  49           HN       LYS  49   6.666   0.139   1.417
  392    HA   LYS  49           HA       LYS  49   8.083  -2.025   2.738
  393    HB2  LYS  49           HB2      LYS  49   7.224  -0.030   3.943
  394    HB3  LYS  49           HB1      LYS  49   5.580  -0.570   3.616
  395    HG2  LYS  49           HG2      LYS  49   5.980  -2.638   4.862
  396    HG3  LYS  49           HG1      LYS  49   7.657  -2.169   5.140
  397    HD2  LYS  49           HD2      LYS  49   6.883  -0.168   6.380
  398    HD3  LYS  49           HD1      LYS  49   5.210  -0.667   6.124
  399    HE2  LYS  49           HE2      LYS  49   5.638  -2.758   7.355
  400    HE3  LYS  49           HE1      LYS  49   7.316  -2.279   7.597
  401    HZ1  LYS  49           HZ1      LYS  49   5.262  -1.718   9.271
  402    HZ2  LYS  49           HZ2      LYS  49   5.429  -0.270   8.400
  403    HZ3  LYS  49           HZ3      LYS  49   6.756  -0.913   9.246
  404    H    ILE  50           HN       ILE  50   7.458  -4.103   3.030
  405    HA   ILE  50           HA       ILE  50   5.101  -5.061   1.520
  406    HB   ILE  50           HB       ILE  50   7.313  -6.564   2.941
  407   HG12  ILE  50          HG12      ILE  50   6.868  -6.067  -0.019
  408   HG13  ILE  50          HG11      ILE  50   7.990  -5.139   0.973
  409   HG21  ILE  50          HG21      ILE  50   6.472  -8.472   1.561
  410   HG22  ILE  50          HG22      ILE  50   5.123  -7.460   1.046
  411   HG23  ILE  50          HG23      ILE  50   5.287  -7.915   2.742
  412   HD11  ILE  50          HD11      ILE  50   8.095  -8.128   0.468
  413   HD12  ILE  50          HD12      ILE  50   9.175  -7.254   1.555
  414   HD13  ILE  50          HD13      ILE  50   9.205  -6.918  -0.176
  415    H    LEU  51           HN       LEU  51   3.212  -5.435   2.542
  416    HA   LEU  51           HA       LEU  51   3.242  -5.914   5.511
  417    HB2  LEU  51           HB2      LEU  51   1.047  -4.668   3.839
  418    HB3  LEU  51           HB1      LEU  51   1.064  -4.833   5.596
  419    HG   LEU  51           HG       LEU  51   3.052  -3.229   3.962
  420   HD11  LEU  51          HD11      LEU  51   0.862  -2.299   5.839
  421   HD12  LEU  51          HD12      LEU  51   0.754  -2.262   4.081
  422   HD13  LEU  51          HD13      LEU  51   1.954  -1.272   4.910
  423   HD21  LEU  51          HD21      LEU  51   4.246  -3.884   5.875
  424   HD22  LEU  51          HD22      LEU  51   2.809  -3.887   6.897
  425   HD23  LEU  51          HD23      LEU  51   3.536  -2.359   6.398
  426    H    GLN  52           HN       GLN  52   1.964  -7.540   6.321
  427    HA   GLN  52           HA       GLN  52   1.246  -9.673   4.453
  428    HB2  GLN  52           HB2      GLN  52   2.214 -10.119   6.711
  429    HB3  GLN  52           HB1      GLN  52   0.753  -9.450   7.438
  430    HG2  GLN  52           HG2      GLN  52  -0.601 -11.166   6.281
  431    HG3  GLN  52           HG1      GLN  52   0.867 -11.843   5.580
  432   HE21  GLN  52          HE21      GLN  52   1.108 -13.807   6.685
  433   HE22  GLN  52          HE22      GLN  52   1.143 -13.955   8.377
  434    H    THR  53           HN       THR  53  -0.595  -9.308   3.273
  435    HA   THR  53           HA       THR  53  -2.843  -7.816   4.462
  436    HB   THR  53           HB       THR  53  -3.754  -7.756   2.284
  437    HG1  THR  53           HG1      THR  53  -2.904 -10.219   2.170
  438   HG21  THR  53          HG21      THR  53  -0.825  -7.985   1.629
  439   HG22  THR  53          HG22      THR  53  -1.423  -6.667   2.636
  440   HG23  THR  53          HG23      THR  53  -2.014  -6.855   0.985
  441    H    ASN  54           HN       ASN  54  -5.038  -8.708   4.386
  442    HA   ASN  54           HA       ASN  54  -5.210 -11.680   4.446
  443    HB2  ASN  54           HB2      ASN  54  -4.857 -10.663   6.793
  444    HB3  ASN  54           HB1      ASN  54  -6.474  -9.984   6.609
  445   HD21  ASN  54          HD21      ASN  54  -4.923 -13.178   5.939
  446   HD22  ASN  54          HD22      ASN  54  -6.163 -14.093   6.649
  447    H    THR  55           HN       THR  55  -6.317 -11.397   2.451
  448    HA   THR  55           HA       THR  55  -8.746  -9.738   2.352
  449    HB   THR  55           HB       THR  55  -7.643 -11.718   0.340
  450    HG1  THR  55           HG1      THR  55  -6.892  -9.757  -0.645
  451   HG21  THR  55          HG21      THR  55  -9.051 -10.452  -1.257
  452   HG22  THR  55          HG22      THR  55  -9.672  -9.480   0.077
  453   HG23  THR  55          HG23      THR  55 -10.025 -11.206   0.005
  454    H    TYR  56           HN       TYR  56 -10.828 -10.509   2.544
  455    HA   TYR  56           HA       TYR  56 -11.131 -13.404   3.261
  456    HB2  TYR  56           HB2      TYR  56 -12.916 -11.024   3.834
  457    HB3  TYR  56           HB1      TYR  56 -13.227 -12.680   4.353
  458    HD1  TYR  56           HD2      TYR  56 -11.868 -13.740   6.082
  459    HD2  TYR  56           HD1      TYR  56 -11.121  -9.700   4.835
  460    HE1  TYR  56           HE2      TYR  56 -10.435 -13.391   8.075
  461    HE2  TYR  56           HE1      TYR  56  -9.686  -9.351   6.828
  462    HH   TYR  56           HH       TYR  56  -8.885 -12.017   9.004
  463    H    TYR  57           HN       TYR  57 -12.353 -14.685   1.981
  464    HA   TYR  57           HA       TYR  57 -13.906 -13.414  -0.256
  465    HB2  TYR  57           HB2      TYR  57 -12.258 -15.939  -0.107
  466    HB3  TYR  57           HB1      TYR  57 -13.511 -15.749  -1.334
  467    HD1  TYR  57           HD1      TYR  57 -10.422 -14.166   0.054
  468    HD2  TYR  57           HD2      TYR  57 -13.136 -14.438  -3.263
  469    HE1  TYR  57           HE1      TYR  57  -8.882 -12.793  -1.325
  470    HE2  TYR  57           HE2      TYR  57 -11.598 -13.069  -4.639
  471    HH   TYR  57           HH       TYR  57  -9.035 -11.309  -3.327
  472    H    SER  58           HN       SER  58 -16.023 -13.630   0.019
  473    HA   SER  58           HA       SER  58 -17.105 -16.158   1.191
  474    HB2  SER  58           HB2      SER  58 -18.175 -13.406   1.864
  475    HB3  SER  58           HB1      SER  58 -18.662 -14.946   2.566
  476    HG   SER  58           HG       SER  58 -16.018 -13.928   2.688
  477    H    ASP  59           HN       ASP  59 -19.216 -16.669   0.410
  478    HA   ASP  59           HA       ASP  59 -19.704 -16.003  -2.326
  479    HB2  ASP  59           HB2      ASP  59 -21.423 -17.258  -0.183
  480    HB3  ASP  59           HB1      ASP  59 -21.968 -17.082  -1.850
  481    H    THR  60           HN       THR  60 -21.161 -14.800   0.683
  482    HA   THR  60           HA       THR  60 -23.169 -13.172  -0.552
  483    HB   THR  60           HB       THR  60 -23.090 -11.913   1.644
  484    HG1  THR  60           HG1      THR  60 -21.424 -12.200   2.874
  485   HG21  THR  60          HG21      THR  60 -24.580 -13.773   1.520
  486   HG22  THR  60          HG22      THR  60 -23.672 -13.988   3.016
  487   HG23  THR  60          HG23      THR  60 -23.251 -14.930   1.585
  488    H    LEU  61           HN       LEU  61 -19.823 -12.492   0.407
  489    HA   LEU  61           HA       LEU  61 -19.842  -9.702  -0.267
  490    HB2  LEU  61           HB2      LEU  61 -17.607 -11.737  -0.168
  491    HB3  LEU  61           HB1      LEU  61 -17.332 -10.016  -0.428
  492    HG   LEU  61           HG       LEU  61 -18.816 -11.149   1.963
  493   HD11  LEU  61          HD11      LEU  61 -15.949 -10.169   1.850
  494   HD12  LEU  61          HD12      LEU  61 -16.410 -11.870   1.853
  495   HD13  LEU  61          HD13      LEU  61 -16.783 -10.853   3.245
  496   HD21  LEU  61          HD21      LEU  61 -19.455  -8.898   1.844
  497   HD22  LEU  61          HD22      LEU  61 -17.930  -8.392   1.117
  498   HD23  LEU  61          HD23      LEU  61 -18.005  -8.777   2.836
  499    H    HIS  62           HN       HIS  62 -19.077 -12.599  -2.165
  500    HA   HIS  62           HA       HIS  62 -18.138 -11.290  -4.506
  501    HB2  HIS  62           HB2      HIS  62 -19.698 -13.869  -4.201
  502    HB3  HIS  62           HB1      HIS  62 -18.894 -13.365  -5.685
  503    HD1  HIS  62           HD1      HIS  62 -17.838 -15.918  -4.595
  504    HD2  HIS  62           HD2      HIS  62 -16.409 -12.240  -3.246
  505    HE1  HIS  62           HE1      HIS  62 -15.555 -16.360  -3.593
  506    H    LYS  63           HN       LYS  63 -21.421 -12.086  -3.434
  507    HA   LYS  63           HA       LYS  63 -22.784 -11.258  -5.816
  508    HB2  LYS  63           HB2      LYS  63 -23.674 -11.261  -2.917
  509    HB3  LYS  63           HB1      LYS  63 -24.755 -10.976  -4.279
  510    HG2  LYS  63           HG2      LYS  63 -24.183 -13.192  -5.201
  511    HG3  LYS  63           HG1      LYS  63 -23.097 -13.477  -3.842
  512    HD2  LYS  63           HD2      LYS  63 -24.998 -13.288  -2.277
  513    HD3  LYS  63           HD1      LYS  63 -26.089 -13.006  -3.635
  514    HE2  LYS  63           HE2      LYS  63 -25.513 -15.214  -4.567
  515    HE3  LYS  63           HE1      LYS  63 -24.407 -15.498  -3.223
  516    HZ1  LYS  63           HZ1      LYS  63 -26.591 -16.534  -2.894
  517    HZ2  LYS  63           HZ2      LYS  63 -27.321 -15.002  -2.942
  518    HZ3  LYS  63           HZ3      LYS  63 -26.238 -15.390  -1.693
  519    H    SER  64           HN       SER  64 -21.838  -9.489  -2.877
  520    HA   SER  64           HA       SER  64 -22.953  -6.963  -3.872
  521    HB2  SER  64           HB2      SER  64 -21.014  -7.322  -1.578
  522    HB3  SER  64           HB1      SER  64 -22.180  -6.023  -1.808
  523    HG   SER  64           HG       SER  64 -23.761  -7.315  -1.163
  524    H    ASN  65           HN       ASN  65 -20.192  -8.739  -4.519
  525    HA   ASN  65           HA       ASN  65 -18.183  -8.259  -5.618
  526    HB2  ASN  65           HB2      ASN  65 -19.720  -5.741  -6.336
  527    HB3  ASN  65           HB1      ASN  65 -18.121  -6.116  -6.966
  528   HD21  ASN  65          HD21      ASN  65 -19.114  -9.141  -6.798
  529   HD22  ASN  65          HD22      ASN  65 -19.982  -9.302  -8.245
  530    H    ILE  66           HN       ILE  66 -18.376  -7.668  -2.818
  531    HA   ILE  66           HA       ILE  66 -16.597  -5.263  -2.569
  532    HB   ILE  66           HB       ILE  66 -18.268  -6.657  -0.459
  533   HG12  ILE  66          HG12      ILE  66 -18.589  -3.932  -1.749
  534   HG13  ILE  66          HG11      ILE  66 -19.496  -5.359  -2.236
  535   HG21  ILE  66          HG21      ILE  66 -17.641  -4.437   0.764
  536   HG22  ILE  66          HG22      ILE  66 -16.329  -4.337  -0.410
  537   HG23  ILE  66          HG23      ILE  66 -16.428  -5.712   0.689
  538   HD11  ILE  66          HD11      ILE  66 -20.788  -3.979  -0.656
  539   HD12  ILE  66          HD12      ILE  66 -19.499  -4.138   0.535
  540   HD13  ILE  66          HD13      ILE  66 -20.418  -5.558   0.035
  541    H    TYR  67           HN       TYR  67 -14.530  -5.590  -1.999
  542    HA   TYR  67           HA       TYR  67 -13.688  -8.334  -1.130
  543    HB2  TYR  67           HB2      TYR  67 -12.125  -6.174  -2.566
  544    HB3  TYR  67           HB1      TYR  67 -11.507  -7.767  -2.123
  545    HD1  TYR  67           HD1      TYR  67 -12.358  -9.803  -3.213
  546    HD2  TYR  67           HD2      TYR  67 -13.711  -5.901  -4.392
  547    HE1  TYR  67           HE1      TYR  67 -13.317 -10.763  -5.288
  548    HE2  TYR  67           HE2      TYR  67 -14.670  -6.862  -6.469
  549    HH   TYR  67           HH       TYR  67 -14.425  -8.792  -7.883
  550    HA   PRO  68           HA       PRO  68 -12.707  -5.529   2.412
  551    HB2  PRO  68           HB2      PRO  68 -13.453  -7.201   4.431
  552    HB3  PRO  68           HB1      PRO  68 -14.606  -6.171   3.559
  553    HG2  PRO  68           HG2      PRO  68 -14.072  -9.084   3.258
  554    HG3  PRO  68           HG1      PRO  68 -15.601  -8.198   3.136
  555    HD2  PRO  68           HD2      PRO  68 -14.101  -9.060   0.956
  556    HD3  PRO  68           HD1      PRO  68 -15.296  -7.747   0.893
  557    H    PHE  69           HN       PHE  69 -10.781  -5.478   3.557
  558    HA   PHE  69           HA       PHE  69  -9.307  -7.999   4.015
  559    HB2  PHE  69           HB2      PHE  69  -7.329  -7.284   2.804
  560    HB3  PHE  69           HB1      PHE  69  -8.704  -7.254   1.699
  561    HD1  PHE  69           HD1      PHE  69  -9.682  -5.126   0.947
  562    HD2  PHE  69           HD2      PHE  69  -6.303  -5.218   3.600
  563    HE1  PHE  69           HE1      PHE  69  -9.254  -2.725   0.490
  564    HE2  PHE  69           HE2      PHE  69  -5.880  -2.817   3.145
  565    HZ   PHE  69           HZ       PHE  69  -7.354  -1.571   1.589
  566    H    ILE  70           HN       ILE  70  -7.486  -7.716   5.410
  567    HA   ILE  70           HA       ILE  70  -7.391  -5.130   6.915
  568    HB   ILE  70           HB       ILE  70  -7.335  -7.942   8.055
  569   HG12  ILE  70          HG12      ILE  70  -9.202  -5.622   8.636
  570   HG13  ILE  70          HG11      ILE  70  -9.576  -6.900   7.481
  571   HG21  ILE  70          HG21      ILE  70  -6.732  -5.236   9.263
  572   HG22  ILE  70          HG22      ILE  70  -5.719  -6.673   9.272
  573   HG23  ILE  70          HG23      ILE  70  -7.186  -6.624  10.251
  574   HD11  ILE  70          HD11      ILE  70  -9.057  -7.237  10.449
  575   HD12  ILE  70          HD12      ILE  70  -9.245  -8.578   9.320
  576   HD13  ILE  70          HD13      ILE  70 -10.590  -7.477   9.612
  577    H    LEU  71           HN       LEU  71  -5.332  -4.412   7.316
  578    HA   LEU  71           HA       LEU  71  -3.097  -6.034   6.184
  579    HB2  LEU  71           HB2      LEU  71  -3.218  -3.111   6.971
  580    HB3  LEU  71           HB1      LEU  71  -1.872  -3.901   6.149
  581    HG   LEU  71           HG       LEU  71  -4.698  -3.658   5.073
  582   HD11  LEU  71          HD11      LEU  71  -3.674  -1.507   4.949
  583   HD12  LEU  71          HD12      LEU  71  -3.478  -2.218   3.347
  584   HD13  LEU  71          HD13      LEU  71  -2.121  -2.194   4.471
  585   HD21  LEU  71          HD21      LEU  71  -3.884  -5.615   4.078
  586   HD22  LEU  71          HD22      LEU  71  -2.211  -5.055   4.108
  587   HD23  LEU  71          HD23      LEU  71  -3.343  -4.398   2.928
  588    H    TYR  72           HN       TYR  72  -1.674  -6.969   7.473
  589    HA   TYR  72           HA       TYR  72  -1.516  -6.123  10.350
  590    HB2  TYR  72           HB2      TYR  72  -1.188  -8.859   9.091
  591    HB3  TYR  72           HB1      TYR  72  -0.838  -8.496  10.781
  592    HD1  TYR  72           HD1      TYR  72  -2.712  -7.394  12.168
  593    HD2  TYR  72           HD2      TYR  72  -3.390  -9.410   8.438
  594    HE1  TYR  72           HE1      TYR  72  -5.109  -7.649  12.744
  595    HE2  TYR  72           HE2      TYR  72  -5.789  -9.667   9.014
  596    HH   TYR  72           HH       TYR  72  -6.995  -9.090  12.154
  597    H    TYR  73           HN       TYR  73   0.535  -6.036  11.268
  598    HA   TYR  73           HA       TYR  73   2.878  -6.475   9.466
  599    HB2  TYR  73           HB2      TYR  73   2.387  -4.087   9.377
  600    HB3  TYR  73           HB1      TYR  73   2.328  -4.011  11.140
  601    HD1  TYR  73           HD1      TYR  73   4.602  -5.159   8.387
  602    HD2  TYR  73           HD2      TYR  73   4.274  -3.381  12.283
  603    HE1  TYR  73           HE1      TYR  73   7.058  -4.826   8.441
  604    HE2  TYR  73           HE2      TYR  73   6.730  -3.047  12.337
  605    HH   TYR  73           HH       TYR  73   8.614  -2.909   9.960
  606    H    GLN  74           HN       GLN  74   3.617  -8.229  10.553
  607    HA   GLN  74           HA       GLN  74   4.671  -9.463  12.228
  608    HB2  GLN  74           HB2      GLN  74   6.150  -7.436  12.277
  609    HB3  GLN  74           HB1      GLN  74   5.131  -6.776  13.556
  610    HG2  GLN  74           HG2      GLN  74   5.593  -8.758  14.953
  611    HG3  GLN  74           HG1      GLN  74   6.625  -9.410  13.680
  612   HE21  GLN  74          HE21      GLN  74   7.693  -8.851  16.260
  613   HE22  GLN  74          HE22      GLN  74   8.768  -7.544  16.131
  614    H    LYS  75           HN       LYS  75   3.200  -6.803  14.118
  615    HA   LYS  75           HA       LYS  75   1.186  -8.624  15.214
  616    HB2  LYS  75           HB2      LYS  75   1.955  -8.384  17.560
  617    HB3  LYS  75           HB1      LYS  75   3.147  -9.223  16.570
  618    HG2  LYS  75           HG2      LYS  75   4.430  -7.140  16.314
  619    HG3  LYS  75           HG1      LYS  75   3.219  -6.270  17.249
  620    HD2  LYS  75           HD2      LYS  75   4.957  -6.770  18.795
  621    HD3  LYS  75           HD1      LYS  75   3.667  -7.918  19.138
  622    HE2  LYS  75           HE2      LYS  75   4.818  -9.701  18.070
  623    HE3  LYS  75           HE1      LYS  75   5.940  -8.605  17.265
  624    HZ1  LYS  75           HZ1      LYS  75   6.206  -9.841  19.751
  625    HZ2  LYS  75           HZ2      LYS  75   6.082  -8.168  20.024
  626    HZ3  LYS  75           HZ3      LYS  75   7.286  -8.777  18.988
  627    H    GLN  76           HN       GLN  76   1.915  -5.744  14.043
  628    HA   GLN  76           HA       GLN  76   0.116  -4.222  15.913
  629    HB2  GLN  76           HB2      GLN  76   2.402  -3.291  14.173
  630    HB3  GLN  76           HB1      GLN  76   1.232  -2.178  14.884
  631    HG2  GLN  76           HG2      GLN  76   1.791  -3.020  17.132
  632    HG3  GLN  76           HG1      GLN  76   2.946  -4.145  16.424
  633   HE21  GLN  76          HE21      GLN  76   2.737  -1.116  17.848
  634   HE22  GLN  76          HE22      GLN  76   4.160  -0.434  17.223
  635    H    LEU  77           HN       LEU  77  -1.702  -3.323  15.083
  636    HA   LEU  77           HA       LEU  77  -2.549  -4.100  12.424
  637    HB2  LEU  77           HB2      LEU  77  -4.205  -3.915  14.199
  638    HB3  LEU  77           HB1      LEU  77  -3.789  -2.223  14.460
  639    HG   LEU  77           HG       LEU  77  -4.612  -1.632  12.232
  640   HD11  LEU  77          HD11      LEU  77  -4.845  -4.627  11.952
  641   HD12  LEU  77          HD12      LEU  77  -4.135  -3.460  10.837
  642   HD13  LEU  77          HD13      LEU  77  -5.885  -3.567  11.002
  643   HD21  LEU  77          HD21      LEU  77  -6.670  -3.447  13.508
  644   HD22  LEU  77          HD22      LEU  77  -6.948  -1.950  12.617
  645   HD23  LEU  77          HD23      LEU  77  -6.201  -1.900  14.213
  646    H    ILE  78           HN       ILE  78  -2.415  -2.937  10.549
  647    HA   ILE  78           HA       ILE  78  -1.099  -0.258  10.681
  648    HB   ILE  78           HB       ILE  78  -1.625  -2.051   8.302
  649   HG12  ILE  78          HG12      ILE  78  -0.130  -3.161   9.878
  650   HG13  ILE  78          HG11      ILE  78   0.797  -2.601   8.490
  651   HG21  ILE  78          HG21      ILE  78   0.005   0.459   8.713
  652   HG22  ILE  78          HG22      ILE  78  -1.309   0.201   7.564
  653   HG23  ILE  78          HG23      ILE  78   0.239  -0.612   7.333
  654   HD11  ILE  78          HD11      ILE  78   0.783  -1.561  11.307
  655   HD12  ILE  78          HD12      ILE  78   1.162  -0.442  10.000
  656   HD13  ILE  78          HD13      ILE  78   2.153  -1.876  10.244
  657    H    ALA  79           HN       ALA  79  -3.754  -1.819   8.817
  658    HA   ALA  79           HA       ALA  79  -5.461   0.505   9.298
  659    HB1  ALA  79           HB1      ALA  79  -4.697   0.014   6.420
  660    HB2  ALA  79           HB2      ALA  79  -3.821   1.165   7.426
  661    HB3  ALA  79           HB3      ALA  79  -5.541   1.400   7.111
  662    H    ILE  80           HN       ILE  80  -7.599   0.230   8.367
  663    HA   ILE  80           HA       ILE  80  -8.199  -2.544   7.404
  664    HB   ILE  80           HB       ILE  80  -9.713  -0.975   9.509
  665   HG12  ILE  80          HG12      ILE  80  -8.389  -3.686   9.682
  666   HG13  ILE  80          HG11      ILE  80  -7.571  -2.198  10.149
  667   HG21  ILE  80          HG21      ILE  80 -10.303  -3.550   8.035
  668   HG22  ILE  80          HG22      ILE  80 -11.324  -2.117   8.160
  669   HG23  ILE  80          HG23      ILE  80 -11.066  -3.141   9.572
  670   HD11  ILE  80          HD11      ILE  80 -10.241  -3.040  11.291
  671   HD12  ILE  80          HD12      ILE  80  -9.178  -1.760  11.875
  672   HD13  ILE  80          HD13      ILE  80  -8.701  -3.449  12.045
  673    H    GLY  81           HN       GLY  81  -9.627  -2.601   5.701
  674    HA2  GLY  81           HA2      GLY  81 -11.567  -0.512   5.220
  675    HA3  GLY  81           HA1      GLY  81 -10.153  -0.280   4.190
  676    H    PHE  82           HN       PHE  82 -12.435  -0.758   2.877
  677    HA   PHE  82           HA       PHE  82 -12.001  -3.485   1.795
  678    HB2  PHE  82           HB2      PHE  82 -14.464  -3.886   1.733
  679    HB3  PHE  82           HB1      PHE  82 -13.841  -3.774   3.378
  680    HD1  PHE  82           HD2      PHE  82 -14.123  -1.664   4.684
  681    HD2  PHE  82           HD1      PHE  82 -16.046  -2.274   0.892
  682    HE1  PHE  82           HE2      PHE  82 -15.704   0.176   5.189
  683    HE2  PHE  82           HE1      PHE  82 -17.628  -0.423   1.415
  684    HZ   PHE  82           HZ       PHE  82 -17.457   0.791   3.550
  685    H    ILE  83           HN       ILE  83 -12.713  -3.723  -0.383
  686    HA   ILE  83           HA       ILE  83 -12.907  -1.104  -1.811
  687    HB   ILE  83           HB       ILE  83 -12.343  -3.799  -3.052
  688   HG12  ILE  83          HG12      ILE  83 -10.428  -1.857  -1.717
  689   HG13  ILE  83          HG11      ILE  83 -10.692  -3.549  -1.298
  690   HG21  ILE  83          HG21      ILE  83 -11.452  -2.517  -4.845
  691   HG22  ILE  83          HG22      ILE  83 -11.381  -1.050  -3.868
  692   HG23  ILE  83          HG23      ILE  83 -12.939  -1.683  -4.399
  693   HD11  ILE  83          HD11      ILE  83  -8.686  -3.524  -2.587
  694   HD12  ILE  83          HD12      ILE  83  -9.383  -2.435  -3.786
  695   HD13  ILE  83          HD13      ILE  83  -9.939  -4.106  -3.683
  696    H    ASP  84           HN       ASP  84 -14.863  -0.540  -2.600
  697    HA   ASP  84           HA       ASP  84 -17.001  -2.586  -2.762
  698    HB2  ASP  84           HB2      ASP  84 -17.065   0.416  -3.130
  699    HB3  ASP  84           HB1      ASP  84 -18.474  -0.645  -3.023
  700    H    GLU  85           HN       GLU  85 -18.082  -3.088  -4.594
  701    HA   GLU  85           HA       GLU  85 -18.202  -3.678  -6.846
  702    HB2  GLU  85           HB2      GLU  85 -17.681  -0.703  -7.034
  703    HB3  GLU  85           HB1      GLU  85 -18.151  -1.709  -8.408
  704    HG2  GLU  85           HG2      GLU  85 -20.210  -2.361  -7.271
  705    HG3  GLU  85           HG1      GLU  85 -19.736  -1.449  -5.838
  706    H    ASN  86           HN       ASN  86 -16.191  -1.334  -8.202
  707    HA   ASN  86           HA       ASN  86 -13.910  -3.284  -8.357
  708    HB2  ASN  86           HB2      ASN  86 -13.499  -2.439 -10.610
  709    HB3  ASN  86           HB1      ASN  86 -15.170  -2.986 -10.483
  710   HD21  ASN  86          HD21      ASN  86 -15.237  -1.372 -12.458
  711   HD22  ASN  86          HD22      ASN  86 -15.610   0.240 -12.080
  712    H    HIS  87           HN       HIS  87 -14.729  -0.510  -6.845
  713    HA   HIS  87           HA       HIS  87 -11.937   0.277  -6.545
  714    HB2  HIS  87           HB2      HIS  87 -12.818   1.398  -8.730
  715    HB3  HIS  87           HB1      HIS  87 -13.742   2.437  -7.647
  716    HD1  HIS  87           HD1      HIS  87 -12.525   4.476  -6.874
  717    HD2  HIS  87           HD2      HIS  87  -9.891   1.417  -7.912
  718    HE1  HIS  87           HE1      HIS  87 -10.188   5.417  -6.597
  719    H    ASP  88           HN       ASP  88 -12.675   3.017  -5.779
  720    HA   ASP  88           HA       ASP  88 -13.379   4.207  -3.912
  721    HB2  ASP  88           HB2      ASP  88 -15.639   3.373  -4.689
  722    HB3  ASP  88           HB1      ASP  88 -15.474   2.053  -3.533
  723    H    MET  89           HN       MET  89 -11.640   3.954  -2.562
  724    HA   MET  89           HA       MET  89 -11.378   1.477  -0.953
  725    HB2  MET  89           HB2      MET  89  -9.630   3.958  -1.074
  726    HB3  MET  89           HB1      MET  89  -9.223   2.447  -0.256
  727    HG2  MET  89           HG2      MET  89  -9.764   2.735  -3.229
  728    HG3  MET  89           HG1      MET  89  -8.167   2.584  -2.503
  729    HE1  MET  89           HE1      MET  89  -7.420   0.902  -1.084
  730    HE2  MET  89           HE2      MET  89  -7.749  -0.817  -1.270
  731    HE3  MET  89           HE3      MET  89  -8.711   0.138  -0.145
  732    H    ASP  90           HN       ASP  90 -12.805   1.480   0.705
  733    HA   ASP  90           HA       ASP  90 -13.251   3.979   2.267
  734    HB2  ASP  90           HB2      ASP  90 -15.180   2.558   1.421
  735    HB3  ASP  90           HB1      ASP  90 -14.659   1.318   2.564
  736    H    PHE  91           HN       PHE  91 -11.909   4.239   3.963
  737    HA   PHE  91           HA       PHE  91 -10.839   1.820   5.370
  738    HB2  PHE  91           HB2      PHE  91  -9.877   4.697   5.378
  739    HB3  PHE  91           HB1      PHE  91  -9.119   3.362   6.250
  740    HD1  PHE  91           HD1      PHE  91  -8.174   1.418   4.971
  741    HD2  PHE  91           HD2      PHE  91  -9.521   5.006   3.035
  742    HE1  PHE  91           HE1      PHE  91  -6.910   0.790   2.936
  743    HE2  PHE  91           HE2      PHE  91  -8.255   4.380   0.995
  744    HZ   PHE  91           HZ       PHE  91  -6.948   2.272   0.945
  745    H    LEU  92           HN       LEU  92 -11.546   1.402   7.371
  746    HA   LEU  92           HA       LEU  92 -13.307   3.380   8.744
  747    HB2  LEU  92           HB2      LEU  92 -12.752   0.488   9.462
  748    HB3  LEU  92           HB1      LEU  92 -14.082   1.491  10.040
  749    HG   LEU  92           HG       LEU  92 -13.639   0.634   7.164
  750   HD11  LEU  92          HD11      LEU  92 -15.681  -0.722   7.527
  751   HD12  LEU  92          HD12      LEU  92 -15.698  -0.229   9.220
  752   HD13  LEU  92          HD13      LEU  92 -14.375  -1.219   8.605
  753   HD21  LEU  92          HD21      LEU  92 -14.748   2.716   7.052
  754   HD22  LEU  92          HD22      LEU  92 -15.667   2.410   8.524
  755   HD23  LEU  92          HD23      LEU  92 -16.075   1.558   7.038
  756    H    TYR  93           HN       TYR  93 -10.190   1.874   8.887
  757    HA   TYR  93           HA       TYR  93  -9.538   3.514  11.264
  758    HB2  TYR  93           HB2      TYR  93 -10.235   1.357  12.229
  759    HB3  TYR  93           HB1      TYR  93  -9.088   0.515  11.187
  760    HD1  TYR  93           HD2      TYR  93  -9.324   3.145  13.825
  761    HD2  TYR  93           HD1      TYR  93  -6.825   0.274  11.837
  762    HE1  TYR  93           HE2      TYR  93  -7.528   3.560  15.484
  763    HE2  TYR  93           HE1      TYR  93  -5.028   0.690  13.496
  764    HH   TYR  93           HH       TYR  93  -4.402   1.854  15.272
  765    H    LEU  94           HN       LEU  94  -7.770   4.585  10.651
  766    HA   LEU  94           HA       LEU  94  -5.769   3.190   8.908
  767    HB2  LEU  94           HB2      LEU  94  -6.945   5.128   7.843
  768    HB3  LEU  94           HB1      LEU  94  -6.316   6.165   9.123
  769    HG   LEU  94           HG       LEU  94  -4.007   5.575   8.464
  770   HD11  LEU  94          HD11      LEU  94  -3.960   3.485   7.481
  771   HD12  LEU  94          HD12      LEU  94  -3.979   4.464   6.020
  772   HD13  LEU  94          HD13      LEU  94  -5.470   3.731   6.605
  773   HD21  LEU  94          HD21      LEU  94  -5.429   6.436   5.946
  774   HD22  LEU  94          HD22      LEU  94  -3.916   7.035   6.623
  775   HD23  LEU  94          HD23      LEU  94  -5.449   7.471   7.374
  776    H    HIS  95           HN       HIS  95  -3.872   2.820   9.884
  777    HA   HIS  95           HA       HIS  95  -2.925   4.703  12.007
  778    HB2  HIS  95           HB2      HIS  95  -3.845   2.793  13.198
  779    HB3  HIS  95           HB1      HIS  95  -2.971   1.673  12.151
  780    HD1  HIS  95           HD1      HIS  95  -2.640   3.563  15.260
  781    HD2  HIS  95           HD2      HIS  95  -0.020   1.989  12.427
  782    HE1  HIS  95           HE1      HIS  95  -0.354   3.503  16.349
  783    H    ASN  96           HN       ASN  96  -1.153   5.557  11.054
  784    HA   ASN  96           HA       ASN  96   0.603   3.808   9.385
  785    HB2  ASN  96           HB2      ASN  96  -0.178   5.957   8.416
  786    HB3  ASN  96           HB1      ASN  96   0.606   6.819   9.741
  787   HD21  ASN  96          HD21      ASN  96   2.910   7.067   9.660
  788   HD22  ASN  96          HD22      ASN  96   3.846   6.530   8.351
  789    H    THR  97           HN       THR  97   1.840   2.735  10.886
  790    HA   THR  97           HA       THR  97   3.180   2.455  12.844
  791    HB   THR  97           HB       THR  97   5.417   3.483  12.359
  792    HG1  THR  97           HG1      THR  97   3.966   5.234  11.109
  793   HG21  THR  97          HG21      THR  97   3.837   2.074  10.205
  794   HG22  THR  97          HG22      THR  97   4.993   1.381  11.343
  795   HG23  THR  97          HG23      THR  97   5.558   2.407  10.025
  796    H    VAL  98           HN       VAL  98   1.537   3.726  14.155
  797    HA   VAL  98           HA       VAL  98   1.145   5.218  15.891
  798    HB   VAL  98           HB       VAL  98   4.085   5.909  15.708
  799   HG11  VAL  98          HG11      VAL  98   2.018   5.949  17.920
  800   HG12  VAL  98          HG12      VAL  98   2.874   7.330  17.233
  801   HG13  VAL  98          HG13      VAL  98   3.749   6.138  18.193
  802   HG21  VAL  98          HG21      VAL  98   2.664   3.567  17.001
  803   HG22  VAL  98          HG22      VAL  98   4.342   4.001  17.325
  804   HG23  VAL  98          HG23      VAL  98   3.858   3.487  15.709
  805    H    MET  99           HN       MET  99   0.192   6.210  13.737
  806    HA   MET  99           HA       MET  99   0.330   9.041  14.067
  807    HB2  MET  99           HB2      MET  99   2.496   8.796  12.869
  808    HB3  MET  99           HB1      MET  99   1.653   8.023  11.531
  809    HG2  MET  99           HG2      MET  99   0.718  10.006  10.790
  810    HG3  MET  99           HG1      MET  99   0.610  10.687  12.414
  811    HE1  MET  99           HE1      MET  99   2.985  10.901  13.838
  812    HE2  MET  99           HE2      MET  99   2.039  12.307  13.347
  813    HE3  MET  99           HE3      MET  99   3.794  12.337  13.190
  814    HA   PRO 100           HA       PRO 100  -3.265   7.062  11.747
  815    HB2  PRO 100           HB2      PRO 100  -4.867   8.241  13.958
  816    HB3  PRO 100           HB1      PRO 100  -4.883   6.586  13.318
  817    HG2  PRO 100           HG2      PRO 100  -3.826   7.157  15.716
  818    HG3  PRO 100           HG1      PRO 100  -3.143   5.901  14.666
  819    HD2  PRO 100           HD2      PRO 100  -2.162   8.707  15.128
  820    HD3  PRO 100           HD1      PRO 100  -1.239   7.198  14.991
  821    H    LEU 101           HN       LEU 101  -4.428   8.253  10.261
  822    HA   LEU 101           HA       LEU 101  -4.406  11.240  10.547
  823    HB2  LEU 101           HB2      LEU 101  -4.753   9.610   8.024
  824    HB3  LEU 101           HB1      LEU 101  -4.423  11.338   8.144
  825    HG   LEU 101           HG       LEU 101  -2.567   9.108   9.038
  826   HD11  LEU 101          HD11      LEU 101  -1.165   9.812   7.169
  827   HD12  LEU 101          HD12      LEU 101  -2.307  11.092   6.759
  828   HD13  LEU 101          HD13      LEU 101  -2.773   9.401   6.570
  829   HD21  LEU 101          HD21      LEU 101  -2.098  10.908  10.491
  830   HD22  LEU 101          HD22      LEU 101  -2.448  12.120   9.259
  831   HD23  LEU 101          HD23      LEU 101  -0.963  11.173   9.170
  832    H    LEU 102           HN       LEU 102  -6.424   8.404  10.141
  833    HA   LEU 102           HA       LEU 102  -8.784  10.122  10.575
  834    HB2  LEU 102           HB2      LEU 102  -8.327   9.768   8.022
  835    HB3  LEU 102           HB1      LEU 102  -8.907   8.127   8.311
  836    HG   LEU 102           HG       LEU 102 -10.433  10.655   9.013
  837   HD11  LEU 102          HD11      LEU 102 -10.736   8.718   6.708
  838   HD12  LEU 102          HD12      LEU 102 -10.282  10.419   6.610
  839   HD13  LEU 102          HD13      LEU 102 -11.907   9.970   7.125
  840   HD21  LEU 102          HD21      LEU 102 -12.331   8.843   9.100
  841   HD22  LEU 102          HD22      LEU 102 -11.245   9.005  10.476
  842   HD23  LEU 102          HD23      LEU 102 -10.999   7.705   9.308
  843    H    ASP 103           HN       ASP 103  -9.649   9.166  12.320
  844    HA   ASP 103           HA       ASP 103 -10.307   6.283  12.220
  845    HB2  ASP 103           HB2      ASP 103  -8.154   6.221  13.338
  846    HB3  ASP 103           HB1      ASP 103  -8.625   7.540  14.409
  847    H    GLN 104           HN       GLN 104 -12.493   6.690  12.320
  848    HA   GLN 104           HA       GLN 104 -13.507   8.417  14.552
  849    HB2  GLN 104           HB2      GLN 104 -14.700   7.685  11.871
  850    HB3  GLN 104           HB1      GLN 104 -15.620   8.482  13.150
  851    HG2  GLN 104           HG2      GLN 104 -14.000  10.327  13.191
  852    HG3  GLN 104           HG1      GLN 104 -13.042   9.530  11.943
  853   HE21  GLN 104          HE21      GLN 104 -15.379  11.889  12.370
  854   HE22  GLN 104          HE22      GLN 104 -16.053  11.881  10.812
  855    H    ARG 105           HN       ARG 105 -14.205   7.283  16.213
  856    HA   ARG 105           HA       ARG 105 -14.769   4.468  16.198
  857    HB2  ARG 105           HB2      ARG 105 -15.460   6.696  18.127
  858    HB3  ARG 105           HB1      ARG 105 -15.802   4.998  18.460
  859    HG2  ARG 105           HG2      ARG 105 -13.406   4.466  18.240
  860    HG3  ARG 105           HG1      ARG 105 -13.061   6.154  17.869
  861    HD2  ARG 105           HD2      ARG 105 -13.909   6.833  20.070
  862    HD3  ARG 105           HD1      ARG 105 -14.299   5.159  20.453
  863    HE   ARG 105           HE       ARG 105 -11.585   6.332  20.348
  864   HH11  ARG 105          HH21      ARG 105 -13.623   3.546  20.597
  865   HH12  ARG 105          HH22      ARG 105 -12.376   2.542  21.252
  866   HH21  ARG 105          HH11      ARG 105  -9.966   5.028  21.196
  867   HH22  ARG 105          HH12      ARG 105 -10.310   3.377  21.589
  868    H    TYR 106           HN       TYR 106 -16.732   7.357  15.848
  869    HA   TYR 106           HA       TYR 106 -19.322   6.195  16.101
  870    HB2  TYR 106           HB2      TYR 106 -18.448   8.488  14.317
  871    HB3  TYR 106           HB1      TYR 106 -20.094   8.177  14.874
  872    HD1  TYR 106           HD2      TYR 106 -20.643   8.359  17.304
  873    HD2  TYR 106           HD1      TYR 106 -16.812   9.518  15.747
  874    HE1  TYR 106           HE2      TYR 106 -20.166   9.597  19.399
  875    HE2  TYR 106           HE1      TYR 106 -16.332  10.755  17.842
  876    HH   TYR 106           HH       TYR 106 -17.088  10.662  20.242
  877    H    LEU 107           HN       LEU 107 -17.200   6.611  13.283
  878    HA   LEU 107           HA       LEU 107 -19.014   5.524  11.352
  879    HB2  LEU 107           HB2      LEU 107 -16.974   6.793  10.734
  880    HB3  LEU 107           HB1      LEU 107 -15.978   5.485  11.370
  881    HG   LEU 107           HG       LEU 107 -16.961   3.933   9.713
  882   HD11  LEU 107          HD11      LEU 107 -18.620   6.357   9.078
  883   HD12  LEU 107          HD12      LEU 107 -19.105   4.668   9.196
  884   HD13  LEU 107          HD13      LEU 107 -18.227   5.230   7.778
  885   HD21  LEU 107          HD21      LEU 107 -14.901   5.268   9.193
  886   HD22  LEU 107          HD22      LEU 107 -15.926   6.466   8.399
  887   HD23  LEU 107          HD23      LEU 107 -15.826   4.826   7.757
  888    H    LEU 108           HN       LEU 108 -16.496   4.045  13.363
  889    HA   LEU 108           HA       LEU 108 -16.737   1.389  12.323
  890    HB2  LEU 108           HB2      LEU 108 -15.752   2.547  14.923
  891    HB3  LEU 108           HB1      LEU 108 -15.818   0.801  14.697
  892    HG   LEU 108           HG       LEU 108 -14.459   2.570  12.656
  893   HD11  LEU 108          HD11      LEU 108 -13.182   1.368  15.136
  894   HD12  LEU 108          HD12      LEU 108 -13.446   3.088  14.853
  895   HD13  LEU 108          HD13      LEU 108 -12.327   2.189  13.831
  896   HD21  LEU 108          HD21      LEU 108 -14.243  -0.348  13.476
  897   HD22  LEU 108          HD22      LEU 108 -13.081   0.434  12.409
  898   HD23  LEU 108          HD23      LEU 108 -14.766   0.293  11.920
  899    H    THR 109           HN       THR 109 -18.376   3.065  14.973
  900    HA   THR 109           HA       THR 109 -20.052   0.676  15.512
  901    HB   THR 109           HB       THR 109 -20.897   1.964  17.411
  902    HG1  THR 109           HG1      THR 109 -20.479   4.076  17.624
  903   HG21  THR 109          HG21      THR 109 -18.777   2.323  18.616
  904   HG22  THR 109          HG22      THR 109 -17.900   2.289  17.086
  905   HG23  THR 109          HG23      THR 109 -18.717   0.838  17.667
  906    H    GLY 110           HN       GLY 110 -20.064   3.130  13.322
  907    HA2  GLY 110           HA2      GLY 110 -21.791   3.571  11.733
  908    HA3  GLY 110           HA1      GLY 110 -22.954   2.793  12.805
  909    H    GLY 111           HN       GLY 111 -21.163   5.757  12.209
  910    HA2  GLY 111           HA2      GLY 111 -22.325   7.273  14.372
  911    HA3  GLY 111           HA1      GLY 111 -21.503   7.954  12.970
  912    H    GLN 112           HN       GLN 112 -23.999   8.814  14.291
  913    HA   GLN 112           HA       GLN 112 -26.176   8.155  12.460
  914    HB2  GLN 112           HB2      GLN 112 -27.461   9.784  13.777
  915    HB3  GLN 112           HB1      GLN 112 -26.605   8.662  14.832
  916    HG2  GLN 112           HG2      GLN 112 -24.785  10.341  15.102
  917    HG3  GLN 112           HG1      GLN 112 -25.713  11.474  14.118
  918   HE21  GLN 112          HE21      GLN 112 -25.689  12.841  16.183
  919   HE22  GLN 112          HE22      GLN 112 -26.865  12.521  17.364
  920    H    LEU 113           HN       LEU 113 -27.056   9.494  10.888
  921    HA   LEU 113           HA       LEU 113 -25.223  11.226   9.517
  922    HB2  LEU 113           HB2      LEU 113 -26.938   9.970   8.313
  923    HB3  LEU 113           HB1      LEU 113 -28.209  10.845   9.164
  924    HG   LEU 113           HG       LEU 113 -27.476  12.956   8.138
  925   HD11  LEU 113          HD11      LEU 113 -25.247  11.207   7.115
  926   HD12  LEU 113          HD12      LEU 113 -25.166  12.823   7.816
  927   HD13  LEU 113          HD13      LEU 113 -25.754  12.609   6.169
  928   HD21  LEU 113          HD21      LEU 113 -28.204  12.497   5.884
  929   HD22  LEU 113          HD22      LEU 113 -29.082  11.408   6.957
  930   HD23  LEU 113          HD23      LEU 113 -27.717  10.806   6.013
  931    H    GLU 114           HN       GLU 114 -25.022  13.423   9.535
  932    HA   GLU 114           HA       GLU 114 -25.841  14.952  11.756
  933    HB2  GLU 114           HB2      GLU 114 -24.024  15.566  10.135
  934    HB3  GLU 114           HB1      GLU 114 -25.274  16.023   8.978
  935    HG2  GLU 114           HG2      GLU 114 -24.579  18.033  10.118
  936    HG3  GLU 114           HG1      GLU 114 -26.181  17.618  10.726
  937    H    HIS 115           HN       HIS 115 -27.547  16.352  12.126
  938    HA   HIS 115           HA       HIS 115 -29.942  15.926  10.411
  939    HB2  HIS 115           HB2      HIS 115 -29.633  17.115  13.182
  940    HB3  HIS 115           HB1      HIS 115 -31.166  16.886  12.342
  941    HD1  HIS 115           HD1      HIS 115 -31.747  14.332  11.688
  942    HD2  HIS 115           HD2      HIS 115 -28.718  14.842  14.505
  943    HE1  HIS 115           HE1      HIS 115 -31.439  12.088  12.822
  944    H    HIS 116           HN       HIS 116 -30.556  17.478   9.057
  945    HA   HIS 116           HA       HIS 116 -29.491  20.258   9.393
  946    HB2  HIS 116           HB2      HIS 116 -28.859  19.113   7.291
  947    HB3  HIS 116           HB1      HIS 116 -30.564  18.836   6.936
  948    HD1  HIS 116           HD1      HIS 116 -31.987  20.870   6.213
  949    HD2  HIS 116           HD2      HIS 116 -27.998  21.810   6.967
  950    HE1  HIS 116           HE1      HIS 116 -31.625  23.216   5.329
  951    H    HIS 117           HN       HIS 117 -32.110  18.511  10.174
  952    HA   HIS 117           HA       HIS 117 -34.219  20.281   9.147
  953    HB2  HIS 117           HB2      HIS 117 -35.750  18.821  10.278
  954    HB3  HIS 117           HB1      HIS 117 -34.493  17.782   9.613
  955    HD1  HIS 117           HD1      HIS 117 -36.105  16.807  12.039
  956    HD2  HIS 117           HD2      HIS 117 -32.504  18.881  12.379
  957    HE1  HIS 117           HE1      HIS 117 -35.156  16.228  14.316
  958    H    HIS 118           HN       HIS 118 -31.899  20.887  11.216
  959    HA   HIS 118           HA       HIS 118 -31.634  22.210  13.140
  960    HB2  HIS 118           HB2      HIS 118 -34.105  23.457  11.910
  961    HB3  HIS 118           HB1      HIS 118 -33.147  24.195  13.194
  962    HD1  HIS 118           HD1      HIS 118 -33.117  23.441   9.538
  963    HD2  HIS 118           HD2      HIS 118 -30.539  25.071  12.380
  964    HE1  HIS 118           HE1      HIS 118 -31.229  24.534   8.250
  965    H    HIS 119           HN       HIS 119 -33.109  23.297  14.989
  966    HA   HIS 119           HA       HIS 119 -35.332  21.556  15.837
  967    HB2  HIS 119           HB2      HIS 119 -33.262  20.374  16.611
  968    HB3  HIS 119           HB1      HIS 119 -32.806  21.830  17.497
  969    HD1  HIS 119           HD1      HIS 119 -34.273  22.493  19.559
  970    HD2  HIS 119           HD2      HIS 119 -35.346  18.873  17.795
  971    HE1  HIS 119           HE1      HIS 119 -35.830  21.337  21.188
  972    H    HIS 120           HN       HIS 120 -33.014  24.074  16.823
  973    HA   HIS 120           HA       HIS 120 -33.333  26.056  18.045
  974    HB2  HIS 120           HB2      HIS 120 -35.965  25.965  16.530
  975    HB3  HIS 120           HB1      HIS 120 -35.294  27.390  17.325
  976    HD1  HIS 120           HD1      HIS 120 -32.807  28.111  16.413
  977    HD2  HIS 120           HD2      HIS 120 -35.050  25.620  13.934
  978    HE1  HIS 120           HE1      HIS 120 -31.769  28.270  14.107
  Start of MODEL   11
    1    H1   MET   1           HT1      MET   1 -13.103 -11.025  19.538
    2    H2   MET   1           HT2      MET   1 -14.501 -11.646  20.278
    3    H3   MET   1           HT3      MET   1 -13.117 -11.321  21.208
    4    HA   MET   1           HA       MET   1 -15.007  -9.412  19.981
    5    HB2  MET   1           HB2      MET   1 -15.387 -10.236  22.301
    6    HB3  MET   1           HB1      MET   1 -13.790  -9.638  22.752
    7    HG2  MET   1           HG2      MET   1 -14.452  -7.353  22.169
    8    HG3  MET   1           HG1      MET   1 -16.032  -7.928  21.634
    9    HE1  MET   1           HE1      MET   1 -18.116  -8.437  24.602
   10    HE2  MET   1           HE2      MET   1 -17.563  -9.472  23.290
   11    HE3  MET   1           HE3      MET   1 -17.977  -7.792  22.961
   12    H    THR   2           HN       THR   2 -13.322  -8.751  18.396
   13    HA   THR   2           HA       THR   2 -11.510  -6.724  19.607
   14    HB   THR   2           HB       THR   2 -10.100  -8.702  19.327
   15    HG1  THR   2           HG1      THR   2  -9.512  -7.089  17.108
   16   HG21  THR   2          HG21      THR   2  -9.806  -9.734  17.120
   17   HG22  THR   2          HG22      THR   2 -10.991  -8.624  16.430
   18   HG23  THR   2          HG23      THR   2 -11.497  -9.826  17.617
   19    H    LEU   3           HN       LEU   3 -10.213  -5.964  17.294
   20    HA   LEU   3           HA       LEU   3 -12.144  -4.296  16.016
   21    HB2  LEU   3           HB2      LEU   3  -9.348  -5.117  15.188
   22    HB3  LEU   3           HB1      LEU   3 -10.274  -3.853  14.384
   23    HG   LEU   3           HG       LEU   3  -9.646  -3.850  17.352
   24   HD11  LEU   3          HD11      LEU   3  -7.614  -3.697  15.814
   25   HD12  LEU   3          HD12      LEU   3  -7.840  -2.349  16.928
   26   HD13  LEU   3          HD13      LEU   3  -8.287  -2.173  15.232
   27   HD21  LEU   3          HD21      LEU   3 -11.452  -2.396  17.112
   28   HD22  LEU   3          HD22      LEU   3 -11.019  -1.948  15.463
   29   HD23  LEU   3          HD23      LEU   3 -10.116  -1.287  16.822
   30    H    GLU   4           HN       GLU   4 -10.640  -7.356  15.021
   31    HA   GLU   4           HA       GLU   4 -11.655  -7.472  12.381
   32    HB2  GLU   4           HB2      GLU   4 -11.180  -9.734  14.348
   33    HB3  GLU   4           HB1      GLU   4 -11.393  -9.933  12.610
   34    HG2  GLU   4           HG2      GLU   4  -9.215  -8.252  13.881
   35    HG3  GLU   4           HG1      GLU   4  -8.989  -9.901  13.298
   36    H    LEU   5           HN       LEU   5 -13.108  -8.649  15.423
   37    HA   LEU   5           HA       LEU   5 -15.482  -9.689  14.224
   38    HB2  LEU   5           HB2      LEU   5 -14.778 -10.224  16.536
   39    HB3  LEU   5           HB1      LEU   5 -15.076  -8.553  17.009
   40    HG   LEU   5           HG       LEU   5 -17.467  -8.812  16.415
   41   HD11  LEU   5          HD11      LEU   5 -16.504 -11.533  15.550
   42   HD12  LEU   5          HD12      LEU   5 -17.604 -10.426  14.726
   43   HD13  LEU   5          HD13      LEU   5 -18.161 -11.338  16.124
   44   HD21  LEU   5          HD21      LEU   5 -17.988 -10.581  18.202
   45   HD22  LEU   5          HD22      LEU   5 -16.968  -9.235  18.707
   46   HD23  LEU   5          HD23      LEU   5 -16.244 -10.801  18.338
   47    H    GLN   6           HN       GLN   6 -14.728  -6.489  15.598
   48    HA   GLN   6           HA       GLN   6 -17.347  -5.383  15.238
   49    HB2  GLN   6           HB2      GLN   6 -14.624  -4.059  15.362
   50    HB3  GLN   6           HB1      GLN   6 -16.151  -3.176  15.383
   51    HG2  GLN   6           HG2      GLN   6 -16.835  -4.391  17.415
   52    HG3  GLN   6           HG1      GLN   6 -15.317  -5.289  17.394
   53   HE21  GLN   6          HE21      GLN   6 -14.087  -4.437  19.090
   54   HE22  GLN   6          HE22      GLN   6 -13.825  -2.781  19.356
   55    H    LEU   7           HN       LEU   7 -14.476  -5.453  13.140
   56    HA   LEU   7           HA       LEU   7 -15.508  -3.754  11.099
   57    HB2  LEU   7           HB2      LEU   7 -13.141  -4.391  11.209
   58    HB3  LEU   7           HB1      LEU   7 -13.564  -6.073  10.900
   59    HG   LEU   7           HG       LEU   7 -14.426  -5.478   8.678
   60   HD11  LEU   7          HD11      LEU   7 -13.817  -3.035   7.930
   61   HD12  LEU   7          HD12      LEU   7 -13.874  -2.680   9.656
   62   HD13  LEU   7          HD13      LEU   7 -15.303  -3.311   8.835
   63   HD21  LEU   7          HD21      LEU   7 -12.134  -6.052   8.619
   64   HD22  LEU   7          HD22      LEU   7 -11.644  -4.556   9.410
   65   HD23  LEU   7          HD23      LEU   7 -12.205  -4.528   7.738
   66    H    LYS   8           HN       LYS   8 -15.675  -7.300  11.488
   67    HA   LYS   8           HA       LYS   8 -17.082  -7.800   9.044
   68    HB2  LYS   8           HB2      LYS   8 -17.058  -9.316  11.669
   69    HB3  LYS   8           HB1      LYS   8 -17.798  -9.921  10.187
   70    HG2  LYS   8           HG2      LYS   8 -15.629  -9.785   9.035
   71    HG3  LYS   8           HG1      LYS   8 -14.881  -9.153  10.502
   72    HD2  LYS   8           HD2      LYS   8 -15.525 -11.236  11.698
   73    HD3  LYS   8           HD1      LYS   8 -16.187 -11.873  10.192
   74    HE2  LYS   8           HE2      LYS   8 -13.308 -10.993  10.546
   75    HE3  LYS   8           HE1      LYS   8 -13.854 -12.666  10.663
   76    HZ1  LYS   8           HZ1      LYS   8 -13.078 -11.446   8.386
   77    HZ2  LYS   8           HZ2      LYS   8 -14.769 -11.300   8.299
   78    HZ3  LYS   8           HZ3      LYS   8 -14.051 -12.832   8.460
   79    H    HIS   9           HN       HIS   9 -18.186  -7.117  12.347
   80    HA   HIS   9           HA       HIS   9 -20.985  -7.423  11.810
   81    HB2  HIS   9           HB2      HIS   9 -19.451  -5.874  13.907
   82    HB3  HIS   9           HB1      HIS   9 -21.215  -5.931  13.873
   83    HD1  HIS   9           HD1      HIS   9 -21.457  -7.364  16.003
   84    HD2  HIS   9           HD2      HIS   9 -19.085  -9.147  13.076
   85    HE1  HIS   9           HE1      HIS   9 -21.099  -9.763  16.733
   86    H    TYR  10           HN       TYR  10 -18.825  -4.589  11.728
   87    HA   TYR  10           HA       TYR  10 -20.840  -2.651  11.170
   88    HB2  TYR  10           HB2      TYR  10 -18.580  -1.994  11.833
   89    HB3  TYR  10           HB1      TYR  10 -17.920  -2.703  10.359
   90    HD1  TYR  10           HD2      TYR  10 -18.567  -1.743   8.117
   91    HD2  TYR  10           HD1      TYR  10 -19.572   0.177  11.826
   92    HE1  TYR  10           HE2      TYR  10 -19.009   0.374   6.902
   93    HE2  TYR  10           HE1      TYR  10 -20.017   2.292  10.611
   94    HH   TYR  10           HH       TYR  10 -19.285   2.631   7.185
   95    H    ILE  11           HN       ILE  11 -18.740  -4.498   8.922
   96    HA   ILE  11           HA       ILE  11 -19.853  -3.372   6.537
   97    HB   ILE  11           HB       ILE  11 -18.516  -6.048   7.030
   98   HG12  ILE  11          HG12      ILE  11 -17.454  -3.539   5.703
   99   HG13  ILE  11          HG11      ILE  11 -17.212  -3.901   7.412
  100   HG21  ILE  11          HG21      ILE  11 -19.429  -4.687   4.489
  101   HG22  ILE  11          HG22      ILE  11 -19.759  -6.336   5.021
  102   HG23  ILE  11          HG23      ILE  11 -18.139  -5.889   4.486
  103   HD11  ILE  11          HD11      ILE  11 -15.314  -4.618   5.881
  104   HD12  ILE  11          HD12      ILE  11 -16.421  -5.809   5.197
  105   HD13  ILE  11          HD13      ILE  11 -15.975  -5.896   6.901
  106    H    THR  12           HN       THR  12 -20.672  -6.323   8.353
  107    HA   THR  12           HA       THR  12 -22.717  -7.206   6.546
  108    HB   THR  12           HB       THR  12 -23.473  -8.591   8.484
  109    HG1  THR  12           HG1      THR  12 -21.344  -7.427   9.912
  110   HG21  THR  12          HG21      THR  12 -20.575  -8.438   7.686
  111   HG22  THR  12          HG22      THR  12 -21.771  -9.676   7.307
  112   HG23  THR  12          HG23      THR  12 -21.077  -9.588   8.921
  113    H    ASN  13           HN       ASN  13 -22.724  -4.988   9.297
  114    HA   ASN  13           HA       ASN  13 -25.571  -4.787   9.591
  115    HB2  ASN  13           HB2      ASN  13 -23.284  -2.924  10.257
  116    HB3  ASN  13           HB1      ASN  13 -24.959  -2.526  10.631
  117   HD21  ASN  13          HD21      ASN  13 -22.975  -2.935  12.687
  118   HD22  ASN  13          HD22      ASN  13 -23.408  -4.326  13.560
  119    H    LEU  14           HN       LEU  14 -23.271  -2.591   7.936
  120    HA   LEU  14           HA       LEU  14 -25.297  -0.924   6.799
  121    HB2  LEU  14           HB2      LEU  14 -22.382  -1.397   6.260
  122    HB3  LEU  14           HB1      LEU  14 -23.305  -0.419   5.124
  123    HG   LEU  14           HG       LEU  14 -22.155   0.890   6.961
  124   HD11  LEU  14          HD11      LEU  14 -24.474   1.453   5.725
  125   HD12  LEU  14          HD12      LEU  14 -23.830   2.477   7.000
  126   HD13  LEU  14          HD13      LEU  14 -25.097   1.311   7.368
  127   HD21  LEU  14          HD21      LEU  14 -22.869   0.724   9.213
  128   HD22  LEU  14          HD22      LEU  14 -22.732  -0.952   8.691
  129   HD23  LEU  14          HD23      LEU  14 -24.315  -0.184   8.781
  130    H    PHE  15           HN       PHE  15 -23.578  -3.747   5.489
  131    HA   PHE  15           HA       PHE  15 -25.169  -3.573   2.997
  132    HB2  PHE  15           HB2      PHE  15 -22.886  -5.311   3.939
  133    HB3  PHE  15           HB1      PHE  15 -23.791  -5.701   2.473
  134    HD1  PHE  15           HD1      PHE  15 -23.750  -4.174   0.535
  135    HD2  PHE  15           HD2      PHE  15 -21.431  -3.395   4.063
  136    HE1  PHE  15           HE1      PHE  15 -22.409  -2.504  -0.717
  137    HE2  PHE  15           HE2      PHE  15 -20.090  -1.725   2.814
  138    HZ   PHE  15           HZ       PHE  15 -20.579  -1.279   0.425
  139    H    ASN  16           HN       ASN  16 -25.699  -4.737   6.046
  140    HA   ASN  16           HA       ASN  16 -27.155  -6.353   6.935
  141    HB2  ASN  16           HB2      ASN  16 -28.457  -5.793   4.254
  142    HB3  ASN  16           HB1      ASN  16 -29.236  -6.664   5.575
  143   HD21  ASN  16          HD21      ASN  16 -29.602  -3.815   4.271
  144   HD22  ASN  16          HD22      ASN  16 -29.724  -2.800   5.626
  145    H    LEU  17           HN       LEU  17 -24.929  -7.608   6.013
  146    HA   LEU  17           HA       LEU  17 -25.799  -9.816   4.233
  147    HB2  LEU  17           HB2      LEU  17 -23.059  -9.313   5.397
  148    HB3  LEU  17           HB1      LEU  17 -23.469 -10.362   4.039
  149    HG   LEU  17           HG       LEU  17 -23.849  -7.360   4.113
  150   HD11  LEU  17          HD11      LEU  17 -21.983  -7.217   2.605
  151   HD12  LEU  17          HD12      LEU  17 -21.906  -8.972   2.445
  152   HD13  LEU  17          HD13      LEU  17 -21.463  -8.204   3.970
  153   HD21  LEU  17          HD21      LEU  17 -25.507  -8.153   2.645
  154   HD22  LEU  17          HD22      LEU  17 -24.505  -9.491   2.085
  155   HD23  LEU  17          HD23      LEU  17 -24.154  -7.845   1.559
  156    HA   PRO  18           HA       PRO  18 -26.752 -12.398   7.833
  157    HB2  PRO  18           HB2      PRO  18 -25.684 -14.575   6.056
  158    HB3  PRO  18           HB1      PRO  18 -27.188 -14.527   6.999
  159    HG2  PRO  18           HG2      PRO  18 -27.186 -14.148   4.356
  160    HG3  PRO  18           HG1      PRO  18 -28.293 -13.265   5.424
  161    HD2  PRO  18           HD2      PRO  18 -25.878 -12.261   3.987
  162    HD3  PRO  18           HD1      PRO  18 -27.339 -11.391   4.510
  163    H    ARG  19           HN       ARG  19 -25.532 -12.899   9.588
  164    HA   ARG  19           HA       ARG  19 -22.597 -12.954   9.345
  165    HB2  ARG  19           HB2      ARG  19 -23.963 -11.705  11.161
  166    HB3  ARG  19           HB1      ARG  19 -24.202 -13.293  11.885
  167    HG2  ARG  19           HG2      ARG  19 -22.259 -12.621  12.982
  168    HG3  ARG  19           HG1      ARG  19 -21.567 -13.481  11.611
  169    HD2  ARG  19           HD2      ARG  19 -21.305 -11.354  10.396
  170    HD3  ARG  19           HD1      ARG  19 -22.038 -10.487  11.741
  171    HE   ARG  19           HE       ARG  19 -20.026 -10.766  12.981
  172   HH11  ARG  19          HH21      ARG  19 -20.046 -12.555  10.023
  173   HH12  ARG  19          HH22      ARG  19 -18.350 -12.899  10.074
  174   HH21  ARG  19          HH11      ARG  19 -17.819 -11.212  13.052
  175   HH22  ARG  19          HH12      ARG  19 -17.093 -12.142  11.783
  176    H    ASP  20           HN       ASP  20 -25.190 -15.178   9.497
  177    HA   ASP  20           HA       ASP  20 -23.835 -17.331  10.877
  178    HB2  ASP  20           HB2      ASP  20 -26.225 -17.260   9.018
  179    HB3  ASP  20           HB1      ASP  20 -25.654 -18.737   9.794
  180    H    GLU  21           HN       GLU  21 -23.098 -15.898   8.008
  181    HA   GLU  21           HA       GLU  21 -22.257 -18.439   6.666
  182    HB2  GLU  21           HB2      GLU  21 -23.559 -16.808   5.314
  183    HB3  GLU  21           HB1      GLU  21 -22.302 -15.602   5.592
  184    HG2  GLU  21           HG2      GLU  21 -20.648 -17.012   4.477
  185    HG3  GLU  21           HG1      GLU  21 -21.841 -18.296   4.278
  186    H    LYS  22           HN       LYS  22 -20.217 -19.046   7.091
  187    HA   LYS  22           HA       LYS  22 -18.269 -17.157   8.191
  188    HB2  LYS  22           HB2      LYS  22 -17.916 -20.050   7.339
  189    HB3  LYS  22           HB1      LYS  22 -16.792 -19.113   8.322
  190    HG2  LYS  22           HG2      LYS  22 -19.661 -19.706   9.109
  191    HG3  LYS  22           HG1      LYS  22 -18.268 -20.624   9.676
  192    HD2  LYS  22           HD2      LYS  22 -17.331 -18.358  10.489
  193    HD3  LYS  22           HD1      LYS  22 -18.965 -17.739  10.248
  194    HE2  LYS  22           HE2      LYS  22 -19.875 -19.393  11.779
  195    HE3  LYS  22           HE1      LYS  22 -18.284 -20.132  11.972
  196    HZ1  LYS  22           HZ1      LYS  22 -18.371 -17.287  12.471
  197    HZ2  LYS  22           HZ2      LYS  22 -17.611 -18.525  13.353
  198    HZ3  LYS  22           HZ3      LYS  22 -19.267 -18.217  13.569
  199    H    TRP  23           HN       TRP  23 -16.504 -16.319   7.146
  200    HA   TRP  23           HA       TRP  23 -16.490 -16.568   4.171
  201    HB2  TRP  23           HB2      TRP  23 -15.005 -14.579   5.912
  202    HB3  TRP  23           HB1      TRP  23 -15.261 -14.486   4.174
  203    HD1  TRP  23           HD1      TRP  23 -18.458 -15.575   4.847
  204    HE1  TRP  23           HE1      TRP  23 -20.129 -13.717   5.442
  205    HE3  TRP  23           HE3      TRP  23 -15.211 -11.817   6.050
  206    HZ2  TRP  23           HZ2      TRP  23 -20.107 -10.996   6.303
  207    HZ3  TRP  23           HZ3      TRP  23 -16.069  -9.598   6.744
  208    HH2  TRP  23           HH2      TRP  23 -18.509  -9.183   6.873
  209    H    GLU  24           HN       GLU  24 -14.260 -16.531   3.170
  210    HA   GLU  24           HA       GLU  24 -12.437 -18.361   4.695
  211    HB2  GLU  24           HB2      GLU  24 -13.363 -19.228   2.549
  212    HB3  GLU  24           HB1      GLU  24 -12.617 -17.870   1.707
  213    HG2  GLU  24           HG2      GLU  24 -10.396 -18.597   2.425
  214    HG3  GLU  24           HG1      GLU  24 -11.106 -19.911   3.364
  215    H    CYS  25           HN       CYS  25 -10.644 -17.431   5.437
  216    HA   CYS  25           HA       CYS  25  -9.841 -14.768   4.478
  217    HB2  CYS  25           HB2      CYS  25  -8.334 -16.366   6.537
  218    HB3  CYS  25           HB1      CYS  25  -8.560 -14.619   6.431
  219    HG   CYS  25           HG       CYS  25 -10.351 -16.459   7.954
  220    H    GLU  26           HN       GLU  26  -8.070 -14.329   3.259
  221    HA   GLU  26           HA       GLU  26  -6.409 -16.648   2.330
  222    HB2  GLU  26           HB2      GLU  26  -7.060 -13.991   1.017
  223    HB3  GLU  26           HB1      GLU  26  -5.866 -15.129   0.391
  224    HG2  GLU  26           HG2      GLU  26  -7.574 -16.861   0.174
  225    HG3  GLU  26           HG1      GLU  26  -8.783 -15.791   0.884
  226    H    SER  27           HN       SER  27  -4.454 -16.698   3.239
  227    HA   SER  27           HA       SER  27  -3.295 -14.234   4.423
  228    HB2  SER  27           HB2      SER  27  -1.718 -15.765   5.505
  229    HB3  SER  27           HB1      SER  27  -3.368 -16.324   5.769
  230    HG   SER  27           HG       SER  27  -2.993 -18.013   4.544
  231    H    ILE  28           HN       ILE  28  -2.263 -13.066   2.867
  232    HA   ILE  28           HA       ILE  28  -0.011 -14.380   1.447
  233    HB   ILE  28           HB       ILE  28  -1.921 -14.450  -0.128
  234   HG12  ILE  28          HG12      ILE  28   0.073 -12.313  -0.922
  235   HG13  ILE  28          HG11      ILE  28   0.467 -14.029  -0.864
  236   HG21  ILE  28          HG21      ILE  28  -1.875 -11.429  -0.067
  237   HG22  ILE  28          HG22      ILE  28  -2.995 -12.366   0.923
  238   HG23  ILE  28          HG23      ILE  28  -3.060 -12.487  -0.835
  239   HD11  ILE  28          HD11      ILE  28  -1.478 -14.434  -2.430
  240   HD12  ILE  28          HD12      ILE  28  -0.145 -13.522  -3.136
  241   HD13  ILE  28          HD13      ILE  28  -1.607 -12.685  -2.614
  242    H    GLU  29           HN       GLU  29   1.720 -12.994   1.159
  243    HA   GLU  29           HA       GLU  29   1.457 -10.283   2.391
  244    HB2  GLU  29           HB2      GLU  29   3.072 -11.860   3.428
  245    HB3  GLU  29           HB1      GLU  29   3.928 -11.967   1.890
  246    HG2  GLU  29           HG2      GLU  29   4.400  -9.569   1.949
  247    HG3  GLU  29           HG1      GLU  29   3.481  -9.407   3.446
  248    H    GLU  30           HN       GLU  30   1.753  -8.506   1.149
  249    HA   GLU  30           HA       GLU  30   3.301  -8.704  -1.373
  250    HB2  GLU  30           HB2      GLU  30   0.382  -7.926  -1.239
  251    HB3  GLU  30           HB1      GLU  30   1.428  -7.448  -2.575
  252    HG2  GLU  30           HG2      GLU  30   1.948  -9.806  -3.034
  253    HG3  GLU  30           HG1      GLU  30   0.939 -10.300  -1.679
  254    H    VAL  31           HN       VAL  31   3.679  -6.532  -2.312
  255    HA   VAL  31           HA       VAL  31   4.593  -4.696  -0.318
  256    HB   VAL  31           HB       VAL  31   4.135  -4.127  -3.262
  257   HG11  VAL  31          HG11      VAL  31   5.855  -2.470  -2.993
  258   HG12  VAL  31          HG12      VAL  31   6.243  -3.047  -1.371
  259   HG13  VAL  31          HG13      VAL  31   4.715  -2.220  -1.671
  260   HG21  VAL  31          HG21      VAL  31   5.406  -6.215  -2.979
  261   HG22  VAL  31          HG22      VAL  31   6.496  -5.412  -1.849
  262   HG23  VAL  31          HG23      VAL  31   6.472  -4.928  -3.545
  263    H    ALA  32           HN       ALA  32   3.737  -2.772   0.405
  264    HA   ALA  32           HA       ALA  32   0.913  -2.457   0.509
  265    HB1  ALA  32           HB1      ALA  32   2.893  -0.204   0.865
  266    HB2  ALA  32           HB2      ALA  32   2.703  -1.475   2.071
  267    HB3  ALA  32           HB3      ALA  32   1.343  -0.428   1.673
  268    H    ASP  33           HN       ASP  33   3.354  -1.031  -1.627
  269    HA   ASP  33           HA       ASP  33   1.575   0.860  -2.880
  270    HB2  ASP  33           HB2      ASP  33   4.114   0.915  -2.924
  271    HB3  ASP  33           HB1      ASP  33   4.045  -0.396  -4.103
  272    H    ASP  34           HN       ASP  34   1.781  -2.531  -3.075
  273    HA   ASP  34           HA       ASP  34   0.709  -2.659  -5.843
  274    HB2  ASP  34           HB2      ASP  34   1.478  -4.790  -3.830
  275    HB3  ASP  34           HB1      ASP  34   0.774  -5.149  -5.406
  276    H    ILE  35           HN       ILE  35  -0.497  -2.192  -2.763
  277    HA   ILE  35           HA       ILE  35  -3.193  -3.248  -3.554
  278    HB   ILE  35           HB       ILE  35  -3.521  -3.680  -1.071
  279   HG12  ILE  35          HG12      ILE  35  -0.494  -3.531  -1.025
  280   HG13  ILE  35          HG11      ILE  35  -1.525  -2.234  -0.434
  281   HG21  ILE  35          HG21      ILE  35  -1.443  -5.211  -2.657
  282   HG22  ILE  35          HG22      ILE  35  -3.168  -5.557  -2.534
  283   HG23  ILE  35          HG23      ILE  35  -2.120  -5.797  -1.137
  284   HD11  ILE  35          HD11      ILE  35  -0.676  -3.994   1.276
  285   HD12  ILE  35          HD12      ILE  35  -1.895  -5.052   0.566
  286   HD13  ILE  35          HD13      ILE  35  -2.373  -3.531   1.319
  287    H    LEU  36           HN       LEU  36  -1.281  -0.800  -1.926
  288    HA   LEU  36           HA       LEU  36  -3.739   0.817  -1.422
  289    HB2  LEU  36           HB2      LEU  36  -0.962   0.870  -0.257
  290    HB3  LEU  36           HB1      LEU  36  -2.084   2.210  -0.038
  291    HG   LEU  36           HG       LEU  36  -2.988  -0.604   0.587
  292   HD11  LEU  36          HD11      LEU  36  -0.979  -0.497   1.869
  293   HD12  LEU  36          HD12      LEU  36  -2.286  -0.109   2.984
  294   HD13  LEU  36          HD13      LEU  36  -1.276   1.179   2.329
  295   HD21  LEU  36          HD21      LEU  36  -3.679   2.152   1.668
  296   HD22  LEU  36          HD22      LEU  36  -4.357   0.645   2.278
  297   HD23  LEU  36          HD23      LEU  36  -4.690   1.152   0.627
  298    HA   PRO  37           HA       PRO  37  -2.381   2.941  -5.251
  299    HB2  PRO  37           HB2      PRO  37  -4.401   4.925  -4.258
  300    HB3  PRO  37           HB1      PRO  37  -4.215   4.220  -5.878
  301    HG2  PRO  37           HG2      PRO  37  -6.145   3.414  -4.214
  302    HG3  PRO  37           HG1      PRO  37  -5.327   2.286  -5.309
  303    HD2  PRO  37           HD2      PRO  37  -5.028   2.580  -2.349
  304    HD3  PRO  37           HD1      PRO  37  -4.844   1.136  -3.374
  305    H    ASP  38           HN       ASP  38  -1.100   4.770  -5.687
  306    HA   ASP  38           HA       ASP  38   0.621   5.750  -3.727
  307    HB2  ASP  38           HB2      ASP  38  -0.307   7.009  -6.311
  308    HB3  ASP  38           HB1      ASP  38   0.986   7.693  -5.326
  309    H    GLN  39           HN       GLN  39  -2.668   6.474  -4.117
  310    HA   GLN  39           HA       GLN  39  -2.709   9.186  -3.165
  311    HB2  GLN  39           HB2      GLN  39  -4.604   8.064  -4.340
  312    HB3  GLN  39           HB1      GLN  39  -4.853   7.060  -2.913
  313    HG2  GLN  39           HG2      GLN  39  -6.400   8.938  -2.838
  314    HG3  GLN  39           HG1      GLN  39  -5.200   9.143  -1.564
  315   HE21  GLN  39          HE21      GLN  39  -5.188  11.457  -1.509
  316   HE22  GLN  39          HE22      GLN  39  -4.692  12.408  -2.824
  317    H    TYR  40           HN       TYR  40  -2.946   6.039  -1.494
  318    HA   TYR  40           HA       TYR  40  -2.943   7.475   1.133
  319    HB2  TYR  40           HB2      TYR  40  -3.559   4.597   0.416
  320    HB3  TYR  40           HB1      TYR  40  -3.569   5.246   2.057
  321    HD1  TYR  40           HD2      TYR  40  -5.229   5.343  -1.247
  322    HD2  TYR  40           HD1      TYR  40  -5.316   6.739   2.814
  323    HE1  TYR  40           HE2      TYR  40  -7.541   6.177  -1.583
  324    HE2  TYR  40           HE1      TYR  40  -7.625   7.574   2.480
  325    HH   TYR  40           HH       TYR  40  -9.347   7.710   1.084
  326    H    VAL  41           HN       VAL  41  -0.711   6.250  -0.962
  327    HA   VAL  41           HA       VAL  41   1.063   5.211   1.227
  328    HB   VAL  41           HB       VAL  41   1.375   4.867  -1.762
  329   HG11  VAL  41          HG11      VAL  41   2.892   2.990  -0.922
  330   HG12  VAL  41          HG12      VAL  41   2.785   3.758   0.662
  331   HG13  VAL  41          HG13      VAL  41   3.488   4.636  -0.699
  332   HG21  VAL  41          HG21      VAL  41   0.164   3.073   0.352
  333   HG22  VAL  41          HG22      VAL  41   0.676   2.489  -1.231
  334   HG23  VAL  41          HG23      VAL  41  -0.615   3.685  -1.107
  335    H    ARG  42           HN       ARG  42   0.481   7.883  -0.769
  336    HA   ARG  42           HA       ARG  42   3.014   8.843  -1.486
  337    HB2  ARG  42           HB2      ARG  42   0.851   9.983  -1.997
  338    HB3  ARG  42           HB1      ARG  42   0.746  10.483  -0.309
  339    HG2  ARG  42           HG2      ARG  42   2.790  11.779  -0.508
  340    HG3  ARG  42           HG1      ARG  42   3.057  11.179  -2.144
  341    HD2  ARG  42           HD2      ARG  42   2.084  13.419  -2.250
  342    HD3  ARG  42           HD1      ARG  42   0.911  12.244  -2.844
  343    HE   ARG  42           HE       ARG  42   0.521  12.667  -0.029
  344   HH11  ARG  42          HH21      ARG  42   0.174  14.137  -3.129
  345   HH12  ARG  42          HH22      ARG  42  -1.190  15.099  -2.668
  346   HH21  ARG  42          HH11      ARG  42  -1.262  13.912   0.589
  347   HH22  ARG  42          HH12      ARG  42  -2.003  14.971  -0.564
  348    H    LEU  43           HN       LEU  43   1.808   8.187   1.637
  349    HA   LEU  43           HA       LEU  43   3.131  10.089   3.258
  350    HB2  LEU  43           HB2      LEU  43   2.818   7.134   3.866
  351    HB3  LEU  43           HB1      LEU  43   2.971   8.447   5.034
  352    HG   LEU  43           HG       LEU  43   0.689   8.128   3.066
  353   HD11  LEU  43          HD11      LEU  43   0.852   7.639   6.056
  354   HD12  LEU  43          HD12      LEU  43   0.615   6.414   4.810
  355   HD13  LEU  43          HD13      LEU  43  -0.637   7.618   5.111
  356   HD21  LEU  43          HD21      LEU  43   0.843  10.438   3.499
  357   HD22  LEU  43          HD22      LEU  43   1.400  10.191   5.155
  358   HD23  LEU  43          HD23      LEU  43  -0.288   9.895   4.735
  359    H    GLY  44           HN       GLY  44   4.358   6.747   2.970
  360    HA2  GLY  44           HA2      GLY  44   6.709   6.757   1.762
  361    HA3  GLY  44           HA1      GLY  44   7.135   7.832   3.092
  362    HA   PRO  45           HA       PRO  45   7.785   4.665   6.094
  363    HB2  PRO  45           HB2      PRO  45   5.078   5.014   7.338
  364    HB3  PRO  45           HB1      PRO  45   6.680   5.053   8.102
  365    HG2  PRO  45           HG2      PRO  45   5.299   7.294   7.655
  366    HG3  PRO  45           HG1      PRO  45   7.065   7.245   7.487
  367    HD2  PRO  45           HD2      PRO  45   4.975   7.328   5.349
  368    HD3  PRO  45           HD1      PRO  45   6.616   8.006   5.347
  369    H    LEU  46           HN       LEU  46   4.438   4.517   4.881
  370    HA   LEU  46           HA       LEU  46   4.402   1.568   5.120
  371    HB2  LEU  46           HB2      LEU  46   2.333   3.490   4.000
  372    HB3  LEU  46           HB1      LEU  46   2.082   1.776   4.321
  373    HG   LEU  46           HG       LEU  46   2.810   3.846   6.418
  374   HD11  LEU  46          HD11      LEU  46   0.517   4.124   5.504
  375   HD12  LEU  46          HD12      LEU  46   0.492   3.579   7.182
  376   HD13  LEU  46          HD13      LEU  46   0.177   2.434   5.878
  377   HD21  LEU  46          HD21      LEU  46   3.607   1.824   7.289
  378   HD22  LEU  46          HD22      LEU  46   2.381   0.861   6.462
  379   HD23  LEU  46          HD23      LEU  46   1.947   1.813   7.881
  380    H    SER  47           HN       SER  47   5.480   3.854   2.918
  381    HA   SER  47           HA       SER  47   4.719   2.509   0.458
  382    HB2  SER  47           HB2      SER  47   5.917   4.193  -0.643
  383    HB3  SER  47           HB1      SER  47   5.404   4.999   0.836
  384    HG   SER  47           HG       SER  47   7.906   4.328  -0.036
  385    H    ASN  48           HN       ASN  48   6.045   1.302  -0.917
  386    HA   ASN  48           HA       ASN  48   7.542  -0.445  -1.349
  387    HB2  ASN  48           HB2      ASN  48   9.359   1.486   0.118
  388    HB3  ASN  48           HB1      ASN  48   9.912   0.124  -0.856
  389   HD21  ASN  48          HD21      ASN  48   7.656   0.551  -2.851
  390   HD22  ASN  48          HD22      ASN  48   8.131   1.905  -3.758
  391    H    LYS  49           HN       LYS  49   6.336  -0.014   1.623
  392    HA   LYS  49           HA       LYS  49   8.170  -1.859   3.042
  393    HB2  LYS  49           HB2      LYS  49   7.152   0.138   4.205
  394    HB3  LYS  49           HB1      LYS  49   5.577  -0.626   4.021
  395    HG2  LYS  49           HG2      LYS  49   6.246  -1.273   6.190
  396    HG3  LYS  49           HG1      LYS  49   6.655  -2.673   5.206
  397    HD2  LYS  49           HD2      LYS  49   8.987  -2.045   5.143
  398    HD3  LYS  49           HD1      LYS  49   8.640  -0.478   5.870
  399    HE2  LYS  49           HE2      LYS  49   9.516  -1.916   7.597
  400    HE3  LYS  49           HE1      LYS  49   7.791  -1.707   7.901
  401    HZ1  LYS  49           HZ1      LYS  49   8.987  -4.001   6.445
  402    HZ2  LYS  49           HZ2      LYS  49   7.350  -3.810   6.860
  403    HZ3  LYS  49           HZ3      LYS  49   8.518  -4.033   8.074
  404    H    ILE  50           HN       ILE  50   7.678  -3.985   3.428
  405    HA   ILE  50           HA       ILE  50   5.525  -5.174   1.849
  406    HB   ILE  50           HB       ILE  50   7.325  -6.507   3.891
  407   HG12  ILE  50          HG12      ILE  50   8.755  -5.343   2.323
  408   HG13  ILE  50          HG11      ILE  50   8.758  -7.052   1.893
  409   HG21  ILE  50          HG21      ILE  50   5.359  -7.793   3.100
  410   HG22  ILE  50          HG22      ILE  50   6.881  -8.519   2.580
  411   HG23  ILE  50          HG23      ILE  50   5.912  -7.586   1.438
  412   HD11  ILE  50          HD11      ILE  50   7.389  -4.761   0.496
  413   HD12  ILE  50          HD12      ILE  50   6.804  -6.411   0.281
  414   HD13  ILE  50          HD13      ILE  50   8.452  -5.993  -0.182
  415    H    LEU  51           HN       LEU  51   3.491  -5.429   2.573
  416    HA   LEU  51           HA       LEU  51   3.000  -5.527   5.538
  417    HB2  LEU  51           HB2      LEU  51   1.176  -4.463   3.359
  418    HB3  LEU  51           HB1      LEU  51   0.824  -4.490   5.087
  419    HG   LEU  51           HG       LEU  51   3.133  -2.998   3.803
  420   HD11  LEU  51          HD11      LEU  51   0.822  -2.090   3.334
  421   HD12  LEU  51          HD12      LEU  51   1.868  -0.986   4.227
  422   HD13  LEU  51          HD13      LEU  51   0.614  -1.892   5.075
  423   HD21  LEU  51          HD21      LEU  51   3.019  -1.907   6.208
  424   HD22  LEU  51          HD22      LEU  51   3.859  -3.437   5.990
  425   HD23  LEU  51          HD23      LEU  51   2.222  -3.418   6.648
  426    H    GLN  52           HN       GLN  52   1.784  -7.204   6.298
  427    HA   GLN  52           HA       GLN  52   1.371  -9.481   4.569
  428    HB2  GLN  52           HB2      GLN  52   0.471  -8.884   7.401
  429    HB3  GLN  52           HB1      GLN  52   0.207 -10.436   6.599
  430    HG2  GLN  52           HG2      GLN  52   2.629 -10.690   6.256
  431    HG3  GLN  52           HG1      GLN  52   2.911  -9.126   7.019
  432   HE21  GLN  52          HE21      GLN  52   2.822  -9.009   9.332
  433   HE22  GLN  52          HE22      GLN  52   2.615 -10.380  10.312
  434    H    THR  53           HN       THR  53  -0.158  -9.317   2.999
  435    HA   THR  53           HA       THR  53  -2.619  -7.788   3.442
  436    HB   THR  53           HB       THR  53  -1.600  -9.414   1.098
  437    HG1  THR  53           HG1      THR  53  -1.939  -6.655   1.632
  438   HG21  THR  53          HG21      THR  53  -3.966  -9.597   0.935
  439   HG22  THR  53          HG22      THR  53  -3.548  -8.232  -0.100
  440   HG23  THR  53          HG23      THR  53  -4.209  -7.947   1.509
  441    H    ASN  54           HN       ASN  54  -4.462  -8.602   4.177
  442    HA   ASN  54           HA       ASN  54  -4.953 -11.555   4.015
  443    HB2  ASN  54           HB2      ASN  54  -4.293 -10.660   6.348
  444    HB3  ASN  54           HB1      ASN  54  -5.849  -9.831   6.336
  445   HD21  ASN  54          HD21      ASN  54  -4.441 -13.122   5.908
  446   HD22  ASN  54          HD22      ASN  54  -5.797 -13.942   6.519
  447    H    THR  55           HN       THR  55  -6.620 -11.746   2.622
  448    HA   THR  55           HA       THR  55  -8.850  -9.723   2.766
  449    HB   THR  55           HB       THR  55  -9.254 -10.643   0.331
  450    HG1  THR  55           HG1      THR  55  -6.530 -10.898   0.152
  451   HG21  THR  55          HG21      THR  55  -7.578  -8.962  -0.543
  452   HG22  THR  55          HG22      THR  55  -7.012  -8.770   1.117
  453   HG23  THR  55          HG23      THR  55  -8.672  -8.350   0.697
  454    H    TYR  56           HN       TYR  56 -10.959 -10.500   2.688
  455    HA   TYR  56           HA       TYR  56 -11.257 -13.456   3.186
  456    HB2  TYR  56           HB2      TYR  56 -13.130 -11.254   4.109
  457    HB3  TYR  56           HB1      TYR  56 -13.166 -12.950   4.569
  458    HD1  TYR  56           HD2      TYR  56 -10.912  -9.958   4.614
  459    HD2  TYR  56           HD1      TYR  56 -12.009 -13.668   6.491
  460    HE1  TYR  56           HE2      TYR  56  -9.322  -9.499   6.450
  461    HE2  TYR  56           HE1      TYR  56 -10.416 -13.198   8.335
  462    HH   TYR  56           HH       TYR  56  -8.413 -11.872   8.740
  463    H    TYR  57           HN       TYR  57 -12.453 -14.556   1.719
  464    HA   TYR  57           HA       TYR  57 -14.174 -12.992  -0.187
  465    HB2  TYR  57           HB2      TYR  57 -12.452 -15.442  -0.629
  466    HB3  TYR  57           HB1      TYR  57 -13.677 -14.907  -1.780
  467    HD1  TYR  57           HD2      TYR  57 -10.432 -14.102  -0.223
  468    HD2  TYR  57           HD1      TYR  57 -13.426 -12.825  -3.028
  469    HE1  TYR  57           HE2      TYR  57  -8.856 -12.424  -1.145
  470    HE2  TYR  57           HE1      TYR  57 -11.849 -11.147  -3.947
  471    HH   TYR  57           HH       TYR  57  -9.772 -10.359  -3.903
  472    H    SER  58           HN       SER  58 -16.274 -13.548  -0.228
  473    HA   SER  58           HA       SER  58 -17.100 -16.246   0.768
  474    HB2  SER  58           HB2      SER  58 -18.553 -13.693   1.481
  475    HB3  SER  58           HB1      SER  58 -18.837 -15.311   2.118
  476    HG   SER  58           HG       SER  58 -17.206 -15.072   3.431
  477    H    ASP  59           HN       ASP  59 -19.309 -16.811   0.053
  478    HA   ASP  59           HA       ASP  59 -19.710 -16.340  -2.727
  479    HB2  ASP  59           HB2      ASP  59 -21.555 -17.368  -0.559
  480    HB3  ASP  59           HB1      ASP  59 -22.012 -17.325  -2.262
  481    H    THR  60           HN       THR  60 -21.347 -14.961   0.130
  482    HA   THR  60           HA       THR  60 -23.168 -13.303  -1.324
  483    HB   THR  60           HB       THR  60 -21.981 -12.684   1.392
  484    HG1  THR  60           HG1      THR  60 -24.358 -14.040   1.264
  485   HG21  THR  60          HG21      THR  60 -23.361 -10.898   0.572
  486   HG22  THR  60          HG22      THR  60 -24.328 -11.799   1.741
  487   HG23  THR  60          HG23      THR  60 -24.594 -12.029   0.014
  488    H    LEU  61           HN       LEU  61 -19.912 -12.667  -0.022
  489    HA   LEU  61           HA       LEU  61 -19.788  -9.915  -0.756
  490    HB2  LEU  61           HB2      LEU  61 -17.613 -11.997  -0.446
  491    HB3  LEU  61           HB1      LEU  61 -17.291 -10.280  -0.671
  492    HG   LEU  61           HG       LEU  61 -19.013 -11.399   1.561
  493   HD11  LEU  61          HD11      LEU  61 -16.772 -12.213   1.905
  494   HD12  LEU  61          HD12      LEU  61 -17.014 -10.853   3.002
  495   HD13  LEU  61          HD13      LEU  61 -16.082 -10.636   1.520
  496   HD21  LEU  61          HD21      LEU  61 -18.064  -8.650   0.781
  497   HD22  LEU  61          HD22      LEU  61 -18.245  -9.021   2.492
  498   HD23  LEU  61          HD23      LEU  61 -19.629  -9.158   1.414
  499    H    HIS  62           HN       HIS  62 -18.887 -12.855  -2.567
  500    HA   HIS  62           HA       HIS  62 -17.722 -11.563  -4.809
  501    HB2  HIS  62           HB2      HIS  62 -19.300 -14.140  -4.598
  502    HB3  HIS  62           HB1      HIS  62 -18.478 -13.627  -6.068
  503    HD1  HIS  62           HD1      HIS  62 -17.912 -15.583  -3.121
  504    HD2  HIS  62           HD2      HIS  62 -15.548 -13.045  -5.432
  505    HE1  HIS  62           HE1      HIS  62 -15.507 -16.138  -2.558
  506    H    LYS  63           HN       LYS  63 -21.111 -12.350  -4.085
  507    HA   LYS  63           HA       LYS  63 -22.205 -11.462  -6.575
  508    HB2  LYS  63           HB2      LYS  63 -23.395 -11.575  -3.789
  509    HB3  LYS  63           HB1      LYS  63 -24.330 -11.229  -5.245
  510    HG2  LYS  63           HG2      LYS  63 -23.685 -13.388  -6.207
  511    HG3  LYS  63           HG1      LYS  63 -22.684 -13.736  -4.797
  512    HD2  LYS  63           HD2      LYS  63 -24.708 -13.603  -3.359
  513    HD3  LYS  63           HD1      LYS  63 -25.691 -13.348  -4.800
  514    HE2  LYS  63           HE2      LYS  63 -23.905 -15.760  -4.391
  515    HE3  LYS  63           HE1      LYS  63 -25.629 -15.744  -4.019
  516    HZ1  LYS  63           HZ1      LYS  63 -25.098 -16.615  -6.255
  517    HZ2  LYS  63           HZ2      LYS  63 -24.491 -15.086  -6.681
  518    HZ3  LYS  63           HZ3      LYS  63 -26.133 -15.272  -6.289
  519    H    SER  64           HN       SER  64 -21.554  -9.759  -3.514
  520    HA   SER  64           HA       SER  64 -22.585  -7.224  -4.561
  521    HB2  SER  64           HB2      SER  64 -20.980  -7.856  -2.065
  522    HB3  SER  64           HB1      SER  64 -21.687  -6.287  -2.436
  523    HG   SER  64           HG       SER  64 -23.121  -8.732  -2.229
  524    H    ASN  65           HN       ASN  65 -19.759  -8.988  -4.988
  525    HA   ASN  65           HA       ASN  65 -17.661  -8.450  -5.872
  526    HB2  ASN  65           HB2      ASN  65 -19.277  -7.355  -7.552
  527    HB3  ASN  65           HB1      ASN  65 -18.896  -5.833  -6.745
  528   HD21  ASN  65          HD21      ASN  65 -17.630  -4.907  -8.461
  529   HD22  ASN  65          HD22      ASN  65 -16.153  -5.572  -8.968
  530    H    ILE  66           HN       ILE  66 -17.930  -7.905  -3.165
  531    HA   ILE  66           HA       ILE  66 -16.518  -5.284  -2.806
  532    HB   ILE  66           HB       ILE  66 -18.120  -6.944  -0.843
  533   HG12  ILE  66          HG12      ILE  66 -18.585  -4.146  -1.923
  534   HG13  ILE  66          HG11      ILE  66 -19.366  -5.587  -2.573
  535   HG21  ILE  66          HG21      ILE  66 -16.453  -4.439  -0.514
  536   HG22  ILE  66          HG22      ILE  66 -16.320  -5.951   0.383
  537   HG23  ILE  66          HG23      ILE  66 -17.710  -4.896   0.634
  538   HD11  ILE  66          HD11      ILE  66 -19.590  -4.543   0.262
  539   HD12  ILE  66          HD12      ILE  66 -20.288  -6.062  -0.301
  540   HD13  ILE  66          HD13      ILE  66 -20.857  -4.530  -0.964
  541    H    TYR  67           HN       TYR  67 -14.451  -5.332  -2.114
  542    HA   TYR  67           HA       TYR  67 -13.277  -7.994  -1.430
  543    HB2  TYR  67           HB2      TYR  67 -12.071  -5.469  -2.553
  544    HB3  TYR  67           HB1      TYR  67 -11.109  -6.846  -2.017
  545    HD1  TYR  67           HD1      TYR  67 -14.038  -6.021  -4.210
  546    HD2  TYR  67           HD2      TYR  67 -10.662  -8.591  -3.526
  547    HE1  TYR  67           HE1      TYR  67 -14.477  -7.168  -6.364
  548    HE2  TYR  67           HE2      TYR  67 -11.099  -9.735  -5.685
  549    HH   TYR  67           HH       TYR  67 -13.320  -8.501  -8.006
  550    HA   PRO  68           HA       PRO  68 -12.875  -5.840   2.609
  551    HB2  PRO  68           HB2      PRO  68 -12.758  -8.028   4.201
  552    HB3  PRO  68           HB1      PRO  68 -14.292  -7.467   3.501
  553    HG2  PRO  68           HG2      PRO  68 -12.504  -9.679   2.604
  554    HG3  PRO  68           HG1      PRO  68 -14.274  -9.641   2.705
  555    HD2  PRO  68           HD2      PRO  68 -12.845  -9.264   0.371
  556    HD3  PRO  68           HD1      PRO  68 -14.481  -8.614   0.635
  557    H    PHE  69           HN       PHE  69 -10.896  -5.034   3.083
  558    HA   PHE  69           HA       PHE  69  -8.496  -6.822   2.892
  559    HB2  PHE  69           HB2      PHE  69  -9.075  -4.074   1.954
  560    HB3  PHE  69           HB1      PHE  69  -7.516  -4.226   2.757
  561    HD1  PHE  69           HD1      PHE  69  -9.637  -5.782   0.086
  562    HD2  PHE  69           HD2      PHE  69  -5.682  -5.130   1.626
  563    HE1  PHE  69           HE1      PHE  69  -8.670  -6.815  -1.952
  564    HE2  PHE  69           HE2      PHE  69  -4.712  -6.154  -0.401
  565    HZ   PHE  69           HZ       PHE  69  -6.207  -7.005  -2.197
  566    H    ILE  70           HN       ILE  70  -7.084  -6.909   4.496
  567    HA   ILE  70           HA       ILE  70  -7.172  -5.012   6.759
  568    HB   ILE  70           HB       ILE  70  -7.378  -8.021   7.171
  569   HG12  ILE  70          HG12      ILE  70  -9.427  -5.801   7.502
  570   HG13  ILE  70          HG11      ILE  70  -9.515  -7.155   6.382
  571   HG21  ILE  70          HG21      ILE  70  -7.502  -5.719   9.152
  572   HG22  ILE  70          HG22      ILE  70  -6.083  -6.727   8.882
  573   HG23  ILE  70          HG23      ILE  70  -7.552  -7.437   9.538
  574   HD11  ILE  70          HD11      ILE  70  -9.296  -8.597   8.594
  575   HD12  ILE  70          HD12      ILE  70 -10.857  -7.945   8.097
  576   HD13  ILE  70          HD13      ILE  70  -9.919  -7.129   9.348
  577    H    LEU  71           HN       LEU  71  -5.062  -4.485   7.112
  578    HA   LEU  71           HA       LEU  71  -2.937  -6.371   6.138
  579    HB2  LEU  71           HB2      LEU  71  -2.684  -3.402   6.694
  580    HB3  LEU  71           HB1      LEU  71  -1.559  -4.431   5.806
  581    HG   LEU  71           HG       LEU  71  -4.402  -3.786   4.957
  582   HD11  LEU  71          HD11      LEU  71  -3.360  -2.495   3.170
  583   HD12  LEU  71          HD12      LEU  71  -1.754  -2.929   3.756
  584   HD13  LEU  71          HD13      LEU  71  -2.800  -1.896   4.733
  585   HD21  LEU  71          HD21      LEU  71  -2.233  -5.530   3.781
  586   HD22  LEU  71          HD22      LEU  71  -3.532  -4.871   2.787
  587   HD23  LEU  71          HD23      LEU  71  -3.912  -5.954   4.115
  588    H    TYR  72           HN       TYR  72  -1.218  -6.898   7.489
  589    HA   TYR  72           HA       TYR  72  -1.372  -5.935  10.317
  590    HB2  TYR  72           HB2      TYR  72  -0.933  -8.758   9.347
  591    HB3  TYR  72           HB1      TYR  72  -0.648  -8.226  11.008
  592    HD1  TYR  72           HD2      TYR  72  -2.515  -7.418  12.411
  593    HD2  TYR  72           HD1      TYR  72  -3.185  -9.053   8.495
  594    HE1  TYR  72           HE2      TYR  72  -4.918  -7.704  12.943
  595    HE2  TYR  72           HE1      TYR  72  -5.591  -9.341   9.029
  596    HH   TYR  72           HH       TYR  72  -7.078  -9.442  10.806
  597    H    TYR  73           HN       TYR  73   0.510  -5.580  11.362
  598    HA   TYR  73           HA       TYR  73   3.072  -6.444  10.298
  599    HB2  TYR  73           HB2      TYR  73   2.532  -4.546   8.766
  600    HB3  TYR  73           HB1      TYR  73   2.412  -3.484  10.170
  601    HD1  TYR  73           HD1      TYR  73   4.732  -5.806   8.387
  602    HD2  TYR  73           HD2      TYR  73   4.351  -2.511  11.116
  603    HE1  TYR  73           HE1      TYR  73   7.192  -5.497   8.358
  604    HE2  TYR  73           HE2      TYR  73   6.810  -2.201  11.087
  605    HH   TYR  73           HH       TYR  73   8.764  -3.085  10.440
  606    H    GLN  74           HN       GLN  74   3.270  -7.204  12.450
  607    HA   GLN  74           HA       GLN  74   3.864  -7.103  14.684
  608    HB2  GLN  74           HB2      GLN  74   4.792  -4.321  13.894
  609    HB3  GLN  74           HB1      GLN  74   5.221  -5.154  15.385
  610    HG2  GLN  74           HG2      GLN  74   5.816  -6.194  12.600
  611    HG3  GLN  74           HG1      GLN  74   6.982  -5.375  13.640
  612   HE21  GLN  74          HE21      GLN  74   7.713  -6.518  15.587
  613   HE22  GLN  74          HE22      GLN  74   7.473  -8.189  15.762
  614    H    LYS  75           HN       LYS  75   3.218  -6.287  16.698
  615    HA   LYS  75           HA       LYS  75   1.663  -5.447  18.221
  616    HB2  LYS  75           HB2      LYS  75   1.359  -3.230  16.181
  617    HB3  LYS  75           HB1      LYS  75   0.830  -3.170  17.856
  618    HG2  LYS  75           HG2      LYS  75   3.196  -3.549  18.567
  619    HG3  LYS  75           HG1      LYS  75   3.685  -3.447  16.877
  620    HD2  LYS  75           HD2      LYS  75   2.186  -1.254  18.343
  621    HD3  LYS  75           HD1      LYS  75   3.935  -1.279  18.132
  622    HE2  LYS  75           HE2      LYS  75   3.419  -1.517  15.597
  623    HE3  LYS  75           HE1      LYS  75   1.795  -0.983  16.026
  624    HZ1  LYS  75           HZ1      LYS  75   4.323   0.474  16.552
  625    HZ2  LYS  75           HZ2      LYS  75   2.791   0.968  17.094
  626    HZ3  LYS  75           HZ3      LYS  75   3.124   0.900  15.430
  627    H    GLN  76           HN       GLN  76  -0.058  -4.070  15.449
  628    HA   GLN  76           HA       GLN  76  -2.060  -6.266  15.553
  629    HB2  GLN  76           HB2      GLN  76  -2.767  -3.339  15.970
  630    HB3  GLN  76           HB1      GLN  76  -3.912  -4.672  15.866
  631    HG2  GLN  76           HG2      GLN  76  -1.791  -4.338  18.005
  632    HG3  GLN  76           HG1      GLN  76  -3.514  -4.050  18.206
  633   HE21  GLN  76          HE21      GLN  76  -1.543  -6.204  19.334
  634   HE22  GLN  76          HE22      GLN  76  -2.381  -7.658  19.076
  635    H    LEU  77           HN       LEU  77  -3.962  -4.476  14.124
  636    HA   LEU  77           HA       LEU  77  -2.918  -4.886  11.441
  637    HB2  LEU  77           HB2      LEU  77  -5.148  -4.051  10.723
  638    HB3  LEU  77           HB1      LEU  77  -5.225  -5.419  11.826
  639    HG   LEU  77           HG       LEU  77  -5.276  -3.331  13.625
  640   HD11  LEU  77          HD11      LEU  77  -5.401  -1.795  11.530
  641   HD12  LEU  77          HD12      LEU  77  -6.539  -1.505  12.839
  642   HD13  LEU  77          HD13      LEU  77  -7.060  -2.366  11.392
  643   HD21  LEU  77          HD21      LEU  77  -7.498  -4.809  12.206
  644   HD22  LEU  77          HD22      LEU  77  -7.851  -3.652  13.488
  645   HD23  LEU  77          HD23      LEU  77  -6.865  -5.072  13.830
  646    H    ILE  78           HN       ILE  78  -2.871  -3.175   9.812
  647    HA   ILE  78           HA       ILE  78  -2.072  -0.536  10.992
  648    HB   ILE  78           HB       ILE  78  -1.429  -1.736   8.282
  649   HG12  ILE  78          HG12      ILE  78  -0.325  -3.021  10.028
  650   HG13  ILE  78          HG11      ILE  78   0.868  -1.998   9.236
  651   HG21  ILE  78          HG21      ILE  78   0.268   0.099   8.231
  652   HG22  ILE  78          HG22      ILE  78  -0.443   0.744   9.711
  653   HG23  ILE  78          HG23      ILE  78  -1.395   0.684   8.227
  654   HD11  ILE  78          HD11      ILE  78  -0.325  -1.733  11.984
  655   HD12  ILE  78          HD12      ILE  78   0.280  -0.295  11.162
  656   HD13  ILE  78          HD13      ILE  78   1.364  -1.642  11.491
  657    H    ALA  79           HN       ALA  79  -4.305  -2.113   8.803
  658    HA   ALA  79           HA       ALA  79  -5.898   0.315   8.652
  659    HB1  ALA  79           HB1      ALA  79  -4.716  -0.697   6.059
  660    HB2  ALA  79           HB2      ALA  79  -4.094   0.703   6.933
  661    HB3  ALA  79           HB3      ALA  79  -5.735   0.724   6.287
  662    H    ILE  80           HN       ILE  80  -7.998  -0.093   7.959
  663    HA   ILE  80           HA       ILE  80  -8.645  -2.854   6.988
  664    HB   ILE  80           HB       ILE  80 -10.744  -2.638   8.455
  665   HG12  ILE  80          HG12      ILE  80  -8.999  -0.651   9.930
  666   HG13  ILE  80          HG11      ILE  80 -10.328  -0.181   8.871
  667   HG21  ILE  80          HG21      ILE  80  -9.321  -4.282   9.256
  668   HG22  ILE  80          HG22      ILE  80  -9.252  -3.163  10.608
  669   HG23  ILE  80          HG23      ILE  80  -7.953  -3.186   9.415
  670   HD11  ILE  80          HD11      ILE  80 -10.497  -1.838  11.399
  671   HD12  ILE  80          HD12      ILE  80 -11.839  -1.652  10.270
  672   HD13  ILE  80          HD13      ILE  80 -11.195  -0.248  11.112
  673    H    GLY  81           HN       GLY  81 -10.613  -2.921   5.707
  674    HA2  GLY  81           HA2      GLY  81 -12.419  -0.860   5.251
  675    HA3  GLY  81           HA1      GLY  81 -11.056  -0.469   4.208
  676    H    PHE  82           HN       PHE  82 -13.312  -0.897   2.908
  677    HA   PHE  82           HA       PHE  82 -12.878  -3.531   1.587
  678    HB2  PHE  82           HB2      PHE  82 -15.286  -3.947   1.465
  679    HB3  PHE  82           HB1      PHE  82 -14.808  -3.784   3.151
  680    HD1  PHE  82           HD2      PHE  82 -16.583  -2.189   0.337
  681    HD2  PHE  82           HD1      PHE  82 -15.462  -1.837   4.470
  682    HE1  PHE  82           HE2      PHE  82 -18.223  -0.352   0.627
  683    HE2  PHE  82           HE1      PHE  82 -17.104  -0.001   4.758
  684    HZ   PHE  82           HZ       PHE  82 -18.484   0.743   2.837
  685    H    ILE  83           HN       ILE  83 -13.369  -3.477  -0.649
  686    HA   ILE  83           HA       ILE  83 -13.620  -0.719  -1.777
  687    HB   ILE  83           HB       ILE  83 -12.731  -3.299  -3.106
  688   HG12  ILE  83          HG12      ILE  83 -11.088  -0.932  -2.153
  689   HG13  ILE  83          HG11      ILE  83 -11.203  -2.468  -1.296
  690   HG21  ILE  83          HG21      ILE  83 -12.677  -0.403  -4.002
  691   HG22  ILE  83          HG22      ILE  83 -13.659  -1.696  -4.690
  692   HG23  ILE  83          HG23      ILE  83 -11.907  -1.734  -4.866
  693   HD11  ILE  83          HD11      ILE  83 -10.053  -1.979  -4.053
  694   HD12  ILE  83          HD12      ILE  83 -10.395  -3.592  -3.424
  695   HD13  ILE  83          HD13      ILE  83  -9.204  -2.568  -2.623
  696    H    ASP  84           HN       ASP  84 -15.528  -0.159  -2.644
  697    HA   ASP  84           HA       ASP  84 -17.622  -2.205  -3.028
  698    HB2  ASP  84           HB2      ASP  84 -18.150  -0.082  -1.884
  699    HB3  ASP  84           HB1      ASP  84 -17.726   0.807  -3.347
  700    H    GLU  85           HN       GLU  85 -17.843  -3.164  -4.933
  701    HA   GLU  85           HA       GLU  85 -17.752  -3.595  -7.230
  702    HB2  GLU  85           HB2      GLU  85 -19.459  -1.678  -7.043
  703    HB3  GLU  85           HB1      GLU  85 -18.158  -0.622  -7.593
  704    HG2  GLU  85           HG2      GLU  85 -17.903  -1.939  -9.640
  705    HG3  GLU  85           HG1      GLU  85 -19.111  -3.090  -9.077
  706    H    ASN  86           HN       ASN  86 -15.249  -3.338  -6.083
  707    HA   ASN  86           HA       ASN  86 -13.006  -2.930  -6.602
  708    HB2  ASN  86           HB2      ASN  86 -14.268  -2.879  -9.357
  709    HB3  ASN  86           HB1      ASN  86 -12.526  -2.793  -9.097
  710   HD21  ASN  86          HD21      ASN  86 -13.679  -5.007 -10.473
  711   HD22  ASN  86          HD22      ASN  86 -13.508  -6.393  -9.507
  712    H    HIS  87           HN       HIS  87 -14.660  -0.624  -5.866
  713    HA   HIS  87           HA       HIS  87 -12.822   1.461  -6.785
  714    HB2  HIS  87           HB2      HIS  87 -14.471   1.436  -8.622
  715    HB3  HIS  87           HB1      HIS  87 -15.775   1.655  -7.456
  716    HD1  HIS  87           HD1      HIS  87 -15.952   3.977  -6.273
  717    HD2  HIS  87           HD2      HIS  87 -12.945   3.769  -9.153
  718    HE1  HIS  87           HE1      HIS  87 -15.207   6.359  -6.703
  719    H    ASP  88           HN       ASP  88 -13.442   3.608  -5.716
  720    HA   ASP  88           HA       ASP  88 -13.812   4.768  -3.717
  721    HB2  ASP  88           HB2      ASP  88 -16.180   4.342  -4.434
  722    HB3  ASP  88           HB1      ASP  88 -16.171   2.882  -3.444
  723    H    MET  89           HN       MET  89 -12.116   4.227  -2.386
  724    HA   MET  89           HA       MET  89 -12.122   1.627  -0.975
  725    HB2  MET  89           HB2      MET  89 -10.173   3.950  -0.984
  726    HB3  MET  89           HB1      MET  89  -9.939   2.464  -0.065
  727    HG2  MET  89           HG2      MET  89 -10.024   1.153  -2.151
  728    HG3  MET  89           HG1      MET  89 -10.270   2.632  -3.076
  729    HE1  MET  89           HE1      MET  89  -8.204   0.945  -0.412
  730    HE2  MET  89           HE2      MET  89  -6.533   1.140  -0.928
  731    HE3  MET  89           HE3      MET  89  -7.628   0.135  -1.874
  732    H    ASP  90           HN       ASP  90 -13.376   1.512   0.811
  733    HA   ASP  90           HA       ASP  90 -13.810   3.946   2.478
  734    HB2  ASP  90           HB2      ASP  90 -15.738   2.461   1.704
  735    HB3  ASP  90           HB1      ASP  90 -15.109   1.228   2.798
  736    H    PHE  91           HN       PHE  91 -12.305   4.202   4.060
  737    HA   PHE  91           HA       PHE  91 -11.059   1.778   5.283
  738    HB2  PHE  91           HB2      PHE  91 -10.295   4.705   5.247
  739    HB3  PHE  91           HB1      PHE  91  -9.502   3.530   6.296
  740    HD1  PHE  91           HD2      PHE  91  -8.303   1.573   5.303
  741    HD2  PHE  91           HD1      PHE  91  -9.858   4.766   2.888
  742    HE1  PHE  91           HE2      PHE  91  -6.885   0.830   3.410
  743    HE2  PHE  91           HE1      PHE  91  -8.439   4.023   0.994
  744    HZ   PHE  91           HZ       PHE  91  -6.954   2.055   1.255
  745    H    LEU  92           HN       LEU  92 -12.215   1.066   6.986
  746    HA   LEU  92           HA       LEU  92 -13.956   2.675   8.597
  747    HB2  LEU  92           HB2      LEU  92 -12.763  -0.072   8.781
  748    HB3  LEU  92           HB1      LEU  92 -13.513   0.592  10.221
  749    HG   LEU  92           HG       LEU  92 -15.071  -0.766   8.787
  750   HD11  LEU  92          HD11      LEU  92 -16.860   0.551   9.366
  751   HD12  LEU  92          HD12      LEU  92 -16.176   2.012   8.672
  752   HD13  LEU  92          HD13      LEU  92 -15.637   1.446  10.252
  753   HD21  LEU  92          HD21      LEU  92 -13.943   0.199   6.643
  754   HD22  LEU  92          HD22      LEU  92 -15.045   1.557   6.860
  755   HD23  LEU  92          HD23      LEU  92 -15.686  -0.067   6.622
  756    H    TYR  93           HN       TYR  93 -10.617   1.583   9.033
  757    HA   TYR  93           HA       TYR  93 -10.140   3.852  10.853
  758    HB2  TYR  93           HB2      TYR  93 -10.935   1.793  12.213
  759    HB3  TYR  93           HB1      TYR  93  -9.388   1.070  11.778
  760    HD1  TYR  93           HD1      TYR  93 -11.016   3.880  13.556
  761    HD2  TYR  93           HD2      TYR  93  -7.322   1.837  12.757
  762    HE1  TYR  93           HE1      TYR  93  -9.920   5.149  15.382
  763    HE2  TYR  93           HE2      TYR  93  -6.225   3.109  14.581
  764    HH   TYR  93           HH       TYR  93  -6.462   5.018  15.889
  765    H    LEU  94           HN       LEU  94  -8.275   4.707  10.170
  766    HA   LEU  94           HA       LEU  94  -6.249   2.929   8.859
  767    HB2  LEU  94           HB2      LEU  94  -7.283   4.636   7.372
  768    HB3  LEU  94           HB1      LEU  94  -6.734   5.900   8.469
  769    HG   LEU  94           HG       LEU  94  -4.391   5.226   8.078
  770   HD11  LEU  94          HD11      LEU  94  -5.725   3.065   6.463
  771   HD12  LEU  94          HD12      LEU  94  -4.346   2.952   7.557
  772   HD13  LEU  94          HD13      LEU  94  -4.142   3.658   5.959
  773   HD21  LEU  94          HD21      LEU  94  -6.075   5.780   5.620
  774   HD22  LEU  94          HD22      LEU  94  -4.315   5.893   5.636
  775   HD23  LEU  94          HD23      LEU  94  -5.278   6.964   6.656
  776    H    HIS  95           HN       HIS  95  -4.472   2.644  10.064
  777    HA   HIS  95           HA       HIS  95  -3.626   4.826  11.952
  778    HB2  HIS  95           HB2      HIS  95  -4.532   2.681  13.012
  779    HB3  HIS  95           HB1      HIS  95  -3.115   1.870  12.345
  780    HD1  HIS  95           HD1      HIS  95  -0.741   2.793  13.162
  781    HD2  HIS  95           HD2      HIS  95  -4.025   4.185  15.320
  782    HE1  HIS  95           HE1      HIS  95   0.178   3.801  15.296
  783    H    ASN  96           HN       ASN  96  -1.822   5.733  11.145
  784    HA   ASN  96           HA       ASN  96   0.024   4.096   9.482
  785    HB2  ASN  96           HB2      ASN  96  -0.230   7.073   9.971
  786    HB3  ASN  96           HB1      ASN  96   1.109   6.360   9.069
  787   HD21  ASN  96          HD21      ASN  96  -0.717   8.119   7.764
  788   HD22  ASN  96          HD22      ASN  96  -1.632   7.223   6.650
  789    H    THR  97           HN       THR  97   2.215   3.908   9.998
  790    HA   THR  97           HA       THR  97   3.066   3.189  12.459
  791    HB   THR  97           HB       THR  97   5.353   3.775  11.799
  792    HG1  THR  97           HG1      THR  97   4.128   5.219   9.691
  793   HG21  THR  97          HG21      THR  97   3.802   3.043   9.310
  794   HG22  THR  97          HG22      THR  97   4.040   1.916  10.645
  795   HG23  THR  97          HG23      THR  97   5.430   2.539   9.758
  796    H    VAL  98           HN       VAL  98   3.490   6.588  11.340
  797    HA   VAL  98           HA       VAL  98   3.126   7.467  14.161
  798    HB   VAL  98           HB       VAL  98   5.448   8.499  12.523
  799   HG11  VAL  98          HG11      VAL  98   4.770   9.888  14.404
  800   HG12  VAL  98          HG12      VAL  98   6.279   9.077  14.818
  801   HG13  VAL  98          HG13      VAL  98   4.753   8.490  15.478
  802   HG21  VAL  98          HG21      VAL  98   6.858   6.939  13.898
  803   HG22  VAL  98          HG22      VAL  98   5.809   6.107  12.749
  804   HG23  VAL  98          HG23      VAL  98   5.376   6.165  14.457
  805    H    MET  99           HN       MET  99   1.256   7.791  12.200
  806    HA   MET  99           HA       MET  99   0.909  10.651  12.153
  807    HB2  MET  99           HB2      MET  99   2.599  10.480  10.355
  808    HB3  MET  99           HB1      MET  99   1.558   9.351   9.492
  809    HG2  MET  99           HG2      MET  99   0.112  11.011   8.797
  810    HG3  MET  99           HG1      MET  99   0.285  11.936  10.287
  811    HE1  MET  99           HE1      MET  99   1.598  13.867  10.621
  812    HE2  MET  99           HE2      MET  99   3.177  14.190   9.910
  813    HE3  MET  99           HE3      MET  99   2.940  12.748  10.896
  814    HA   PRO 100           HA       PRO 100  -2.709   7.633  11.522
  815    HB2  PRO 100           HB2      PRO 100  -4.169   8.674  13.676
  816    HB3  PRO 100           HB1      PRO 100  -3.142   7.229  13.745
  817    HG2  PRO 100           HG2      PRO 100  -2.532  10.023  14.592
  818    HG3  PRO 100           HG1      PRO 100  -2.073   8.486  15.350
  819    HD2  PRO 100           HD2      PRO 100  -0.310   9.920  13.899
  820    HD3  PRO 100           HD1      PRO 100  -0.283   8.145  13.888
  821    H    LEU 101           HN       LEU 101  -3.903   8.395   9.858
  822    HA   LEU 101           HA       LEU 101  -4.586  11.264   9.680
  823    HB2  LEU 101           HB2      LEU 101  -5.308   9.031   7.765
  824    HB3  LEU 101           HB1      LEU 101  -5.279  10.761   7.430
  825    HG   LEU 101           HG       LEU 101  -2.863   9.064   8.129
  826   HD11  LEU 101          HD11      LEU 101  -2.258   9.189   5.836
  827   HD12  LEU 101          HD12      LEU 101  -3.460  10.435   5.501
  828   HD13  LEU 101          HD13      LEU 101  -3.973   8.779   5.822
  829   HD21  LEU 101          HD21      LEU 101  -1.703  11.233   7.283
  830   HD22  LEU 101          HD22      LEU 101  -2.381  11.244   8.909
  831   HD23  LEU 101          HD23      LEU 101  -3.257  12.012   7.583
  832    H    LEU 102           HN       LEU 102  -6.515   8.348   8.978
  833    HA   LEU 102           HA       LEU 102  -8.897   9.712  10.148
  834    HB2  LEU 102           HB2      LEU 102  -8.989   8.861   7.803
  835    HB3  LEU 102           HB1      LEU 102  -8.729   7.230   8.409
  836    HG   LEU 102           HG       LEU 102 -10.965   8.716   9.727
  837   HD11  LEU 102          HD11      LEU 102 -12.525   8.262   7.843
  838   HD12  LEU 102          HD12      LEU 102 -11.147   7.818   6.836
  839   HD13  LEU 102          HD13      LEU 102 -11.309   9.470   7.429
  840   HD21  LEU 102          HD21      LEU 102 -10.727   5.947   8.493
  841   HD22  LEU 102          HD22      LEU 102 -12.076   6.519   9.475
  842   HD23  LEU 102          HD23      LEU 102 -10.482   6.328  10.195
  843    H    ASP 103           HN       ASP 103  -9.663   9.049  12.068
  844    HA   ASP 103           HA       ASP 103  -9.403   6.237  12.909
  845    HB2  ASP 103           HB2      ASP 103  -8.318   6.818  15.056
  846    HB3  ASP 103           HB1      ASP 103  -7.284   7.229  13.690
  847    H    GLN 104           HN       GLN 104 -11.731   6.357  12.780
  848    HA   GLN 104           HA       GLN 104 -13.060   8.151  14.775
  849    HB2  GLN 104           HB2      GLN 104 -14.137   6.553  12.431
  850    HB3  GLN 104           HB1      GLN 104 -15.145   7.472  13.552
  851    HG2  GLN 104           HG2      GLN 104 -14.075   9.543  12.929
  852    HG3  GLN 104           HG1      GLN 104 -12.869   8.690  11.965
  853   HE21  GLN 104          HE21      GLN 104 -13.488   7.951   9.848
  854   HE22  GLN 104          HE22      GLN 104 -14.985   8.340   9.146
  855    H    ARG 105           HN       ARG 105 -13.324   7.181  16.717
  856    HA   ARG 105           HA       ARG 105 -13.435   4.257  16.969
  857    HB2  ARG 105           HB2      ARG 105 -13.674   6.490  19.009
  858    HB3  ARG 105           HB1      ARG 105 -13.612   4.772  19.406
  859    HG2  ARG 105           HG2      ARG 105 -11.404   4.569  18.405
  860    HG3  ARG 105           HG1      ARG 105 -11.466   6.242  17.849
  861    HD2  ARG 105           HD2      ARG 105 -10.140   6.122  19.899
  862    HD3  ARG 105           HD1      ARG 105 -11.642   6.988  20.219
  863    HE   ARG 105           HE       ARG 105 -12.374   5.168  21.564
  864   HH11  ARG 105          HH21      ARG 105  -9.488   4.460  19.799
  865   HH12  ARG 105          HH22      ARG 105  -9.152   3.010  20.684
  866   HH21  ARG 105          HH11      ARG 105 -11.949   3.281  22.713
  867   HH22  ARG 105          HH12      ARG 105 -10.543   2.342  22.330
  868    H    TYR 106           HN       TYR 106 -15.642   7.010  17.473
  869    HA   TYR 106           HA       TYR 106 -17.847   5.494  18.458
  870    HB2  TYR 106           HB2      TYR 106 -19.220   7.411  17.841
  871    HB3  TYR 106           HB1      TYR 106 -17.694   7.992  18.508
  872    HD1  TYR 106           HD1      TYR 106 -15.955   8.945  17.044
  873    HD2  TYR 106           HD2      TYR 106 -19.749   7.670  15.486
  874    HE1  TYR 106           HE1      TYR 106 -15.512  10.191  14.946
  875    HE2  TYR 106           HE2      TYR 106 -19.306   8.915  13.388
  876    HH   TYR 106           HH       TYR 106 -17.254   9.721  12.130
  877    H    LEU 107           HN       LEU 107 -16.951   6.436  15.141
  878    HA   LEU 107           HA       LEU 107 -19.190   5.226  13.852
  879    HB2  LEU 107           HB2      LEU 107 -17.655   6.803  12.714
  880    HB3  LEU 107           HB1      LEU 107 -16.357   5.619  12.832
  881    HG   LEU 107           HG       LEU 107 -17.624   4.056  11.419
  882   HD11  LEU 107          HD11      LEU 107 -19.900   4.436  11.791
  883   HD12  LEU 107          HD12      LEU 107 -19.680   5.200  10.219
  884   HD13  LEU 107          HD13      LEU 107 -19.734   6.189  11.679
  885   HD21  LEU 107          HD21      LEU 107 -16.118   5.650  10.326
  886   HD22  LEU 107          HD22      LEU 107 -17.399   6.859  10.277
  887   HD23  LEU 107          HD23      LEU 107 -17.539   5.388   9.315
  888    H    LEU 108           HN       LEU 108 -15.943   3.977  14.640
  889    HA   LEU 108           HA       LEU 108 -16.311   1.407  13.452
  890    HB2  LEU 108           HB2      LEU 108 -14.179   2.629  14.480
  891    HB3  LEU 108           HB1      LEU 108 -14.640   1.753  15.931
  892    HG   LEU 108           HG       LEU 108 -13.055   0.403  14.706
  893   HD11  LEU 108          HD11      LEU 108 -15.724  -0.836  14.073
  894   HD12  LEU 108          HD12      LEU 108 -15.175  -0.641  15.740
  895   HD13  LEU 108          HD13      LEU 108 -14.246  -1.626  14.613
  896   HD21  LEU 108          HD21      LEU 108 -13.055   0.055  12.443
  897   HD22  LEU 108          HD22      LEU 108 -13.911   1.589  12.434
  898   HD23  LEU 108          HD23      LEU 108 -14.808   0.076  12.306
  899    H    THR 109           HN       THR 109 -16.857   2.551  16.786
  900    HA   THR 109           HA       THR 109 -18.090  -0.056  17.493
  901    HB   THR 109           HB       THR 109 -17.889   2.329  19.338
  902    HG1  THR 109           HG1      THR 109 -15.823   0.552  19.442
  903   HG21  THR 109          HG21      THR 109 -19.073   0.085  19.875
  904   HG22  THR 109          HG22      THR 109 -17.918   0.706  21.053
  905   HG23  THR 109          HG23      THR 109 -17.446  -0.590  19.954
  906    H    GLY 110           HN       GLY 110 -19.354   1.837  15.573
  907    HA2  GLY 110           HA2      GLY 110 -22.049   1.624  16.465
  908    HA3  GLY 110           HA1      GLY 110 -21.495   3.271  16.772
  909    H    GLY 111           HN       GLY 111 -23.153   1.546  14.584
  910    HA2  GLY 111           HA2      GLY 111 -22.601   3.491  12.430
  911    HA3  GLY 111           HA1      GLY 111 -22.336   1.792  12.026
  912    H    GLN 112           HN       GLN 112 -24.737   2.201  14.373
  913    HA   GLN 112           HA       GLN 112 -26.847   1.598  12.358
  914    HB2  GLN 112           HB2      GLN 112 -26.751   1.319  15.376
  915    HB3  GLN 112           HB1      GLN 112 -28.176   0.962  14.397
  916    HG2  GLN 112           HG2      GLN 112 -26.910  -0.715  13.127
  917    HG3  GLN 112           HG1      GLN 112 -25.460  -0.345  14.059
  918   HE21  GLN 112          HE21      GLN 112 -25.153  -2.131  15.410
  919   HE22  GLN 112          HE22      GLN 112 -26.358  -2.815  16.392
  920    H    LEU 113           HN       LEU 113 -28.100   3.242  11.713
  921    HA   LEU 113           HA       LEU 113 -28.072   5.815  13.057
  922    HB2  LEU 113           HB2      LEU 113 -29.856   4.814  10.817
  923    HB3  LEU 113           HB1      LEU 113 -29.614   6.498  11.279
  924    HG   LEU 113           HG       LEU 113 -27.424   4.635  10.309
  925   HD11  LEU 113          HD11      LEU 113 -27.531   5.773   8.212
  926   HD12  LEU 113          HD12      LEU 113 -28.623   7.001   8.853
  927   HD13  LEU 113          HD13      LEU 113 -29.196   5.350   8.612
  928   HD21  LEU 113          HD21      LEU 113 -26.316   6.234  11.618
  929   HD22  LEU 113          HD22      LEU 113 -27.492   7.499  11.257
  930   HD23  LEU 113          HD23      LEU 113 -26.310   7.017  10.040
  931    H    GLU 114           HN       GLU 114 -29.777   6.800  14.182
  932    HA   GLU 114           HA       GLU 114 -31.414   5.057  15.778
  933    HB2  GLU 114           HB2      GLU 114 -31.551   8.057  15.340
  934    HB3  GLU 114           HB1      GLU 114 -32.452   7.186  16.581
  935    HG2  GLU 114           HG2      GLU 114 -29.428   7.171  16.330
  936    HG3  GLU 114           HG1      GLU 114 -30.332   8.191  17.448
  937    H    HIS 115           HN       HIS 115 -33.300   4.129  15.216
  938    HA   HIS 115           HA       HIS 115 -35.275   5.591  13.625
  939    HB2  HIS 115           HB2      HIS 115 -35.438   3.869  11.856
  940    HB3  HIS 115           HB1      HIS 115 -33.861   4.657  11.844
  941    HD1  HIS 115           HD1      HIS 115 -32.146   3.236  13.708
  942    HD2  HIS 115           HD2      HIS 115 -35.067   1.162  11.576
  943    HE1  HIS 115           HE1      HIS 115 -31.434   0.806  13.695
  944    H    HIS 116           HN       HIS 116 -37.352   4.502  13.637
  945    HA   HIS 116           HA       HIS 116 -37.622   2.588  15.914
  946    HB2  HIS 116           HB2      HIS 116 -38.940   4.671  16.042
  947    HB3  HIS 116           HB1      HIS 116 -39.698   4.291  14.496
  948    HD1  HIS 116           HD1      HIS 116 -39.362   2.818  17.995
  949    HD2  HIS 116           HD2      HIS 116 -41.933   2.655  14.717
  950    HE1  HIS 116           HE1      HIS 116 -41.364   1.447  18.721
  951    H    HIS 117           HN       HIS 117 -36.630   1.441  13.615
  952    HA   HIS 117           HA       HIS 117 -37.062  -0.152  11.937
  953    HB2  HIS 117           HB2      HIS 117 -37.498  -1.409  14.045
  954    HB3  HIS 117           HB1      HIS 117 -39.197  -0.952  13.939
  955    HD1  HIS 117           HD1      HIS 117 -40.635  -2.081  12.102
  956    HD2  HIS 117           HD2      HIS 117 -36.666  -3.359  12.125
  957    HE1  HIS 117           HE1      HIS 117 -40.527  -4.116  10.595
  958    H    HIS 118           HN       HIS 118 -40.314  -0.820  12.525
  959    HA   HIS 118           HA       HIS 118 -41.501   1.297  10.930
  960    HB2  HIS 118           HB2      HIS 118 -40.325   0.071   9.142
  961    HB3  HIS 118           HB1      HIS 118 -41.111  -1.425   9.646
  962    HD1  HIS 118           HD1      HIS 118 -43.779  -1.486   9.396
  963    HD2  HIS 118           HD2      HIS 118 -41.881   1.694   7.483
  964    HE1  HIS 118           HE1      HIS 118 -45.461  -0.525   7.765
  965    H    HIS 119           HN       HIS 119 -43.366   1.436  12.084
  966    HA   HIS 119           HA       HIS 119 -45.070  -0.987  12.297
  967    HB2  HIS 119           HB2      HIS 119 -44.209   0.713  14.652
  968    HB3  HIS 119           HB1      HIS 119 -45.557  -0.424  14.704
  969    HD1  HIS 119           HD1      HIS 119 -41.829  -0.256  14.648
  970    HD2  HIS 119           HD2      HIS 119 -44.787  -3.190  14.508
  971    HE1  HIS 119           HE1      HIS 119 -40.660  -2.471  15.023
  972    H    HIS 120           HN       HIS 120 -47.290  -0.502  12.390
  973    HA   HIS 120           HA       HIS 120 -48.275   2.198  12.777
  974    HB2  HIS 120           HB2      HIS 120 -47.351   2.481  10.518
  975    HB3  HIS 120           HB1      HIS 120 -48.252   1.071   9.959
  976    HD1  HIS 120           HD1      HIS 120 -48.920   4.482  11.516
  977    HD2  HIS 120           HD2      HIS 120 -50.819   1.665   9.102
  978    HE1  HIS 120           HE1      HIS 120 -51.116   5.519  10.798
  Start of MODEL   12
    1    H1   MET   1           HT1      MET   1  -7.711  -7.308  20.964
    2    H2   MET   1           HT2      MET   1  -9.301  -7.875  21.158
    3    H3   MET   1           HT3      MET   1  -9.014  -6.226  20.863
    4    HA   MET   1           HA       MET   1  -8.341  -6.615  18.659
    5    HB2  MET   1           HB2      MET   1  -8.347  -9.059  17.849
    6    HB3  MET   1           HB1      MET   1  -6.991  -8.566  18.860
    7    HG2  MET   1           HG2      MET   1  -8.065  -9.532  20.832
    8    HG3  MET   1           HG1      MET   1  -9.486  -9.951  19.879
    9    HE1  MET   1           HE1      MET   1  -5.863 -10.218  20.492
   10    HE2  MET   1           HE2      MET   1  -5.524 -10.408  18.774
   11    HE3  MET   1           HE3      MET   1  -5.320 -11.778  19.861
   12    H    THR   2           HN       THR   2 -10.720  -5.946  19.888
   13    HA   THR   2           HA       THR   2 -12.865  -7.700  18.917
   14    HB   THR   2           HB       THR   2 -13.065  -4.883  20.017
   15    HG1  THR   2           HG1      THR   2 -12.669  -5.689  21.894
   16   HG21  THR   2          HG21      THR   2 -15.312  -5.856  20.795
   17   HG22  THR   2          HG22      THR   2 -15.009  -7.166  19.656
   18   HG23  THR   2          HG23      THR   2 -15.147  -5.508  19.077
   19    H    LEU   3           HN       LEU   3 -10.814  -5.567  17.451
   20    HA   LEU   3           HA       LEU   3 -12.549  -4.011  15.778
   21    HB2  LEU   3           HB2      LEU   3  -9.728  -5.028  15.371
   22    HB3  LEU   3           HB1      LEU   3 -10.524  -3.932  14.249
   23    HG   LEU   3           HG       LEU   3 -10.177  -3.350  17.208
   24   HD11  LEU   3          HD11      LEU   3  -8.498  -2.422  14.854
   25   HD12  LEU   3          HD12      LEU   3  -7.978  -3.538  16.122
   26   HD13  LEU   3          HD13      LEU   3  -8.330  -1.857  16.517
   27   HD21  LEU   3          HD21      LEU   3 -11.887  -1.927  16.454
   28   HD22  LEU   3          HD22      LEU   3 -11.208  -1.798  14.832
   29   HD23  LEU   3          HD23      LEU   3 -10.461  -0.938  16.172
   30    H    GLU   4           HN       GLU   4 -11.119  -7.228  15.423
   31    HA   GLU   4           HA       GLU   4 -11.953  -7.719  12.747
   32    HB2  GLU   4           HB2      GLU   4 -11.650  -9.674  15.047
   33    HB3  GLU   4           HB1      GLU   4 -11.683 -10.100  13.335
   34    HG2  GLU   4           HG2      GLU   4  -9.638  -8.272  14.630
   35    HG3  GLU   4           HG1      GLU   4  -9.365  -9.967  14.226
   36    H    LEU   5           HN       LEU   5 -13.513  -8.696  15.822
   37    HA   LEU   5           HA       LEU   5 -15.880  -9.711  14.572
   38    HB2  LEU   5           HB2      LEU   5 -15.267 -10.313  16.874
   39    HB3  LEU   5           HB1      LEU   5 -15.470  -8.635  17.378
   40    HG   LEU   5           HG       LEU   5 -17.857  -8.719  16.829
   41   HD11  LEU   5          HD11      LEU   5 -18.739 -11.150  16.325
   42   HD12  LEU   5          HD12      LEU   5 -17.104 -11.414  15.720
   43   HD13  LEU   5          HD13      LEU   5 -18.119 -10.158  15.008
   44   HD21  LEU   5          HD21      LEU   5 -18.575 -10.208  18.591
   45   HD22  LEU   5          HD22      LEU   5 -17.019  -9.526  19.066
   46   HD23  LEU   5          HD23      LEU   5 -17.106 -11.173  18.441
   47    H    GLN   6           HN       GLN   6 -15.121  -6.543  16.002
   48    HA   GLN   6           HA       GLN   6 -17.733  -5.429  15.615
   49    HB2  GLN   6           HB2      GLN   6 -15.957  -4.495  17.128
   50    HB3  GLN   6           HB1      GLN   6 -15.084  -3.960  15.693
   51    HG2  GLN   6           HG2      GLN   6 -16.395  -2.099  16.530
   52    HG3  GLN   6           HG1      GLN   6 -17.115  -2.648  15.017
   53   HE21  GLN   6          HE21      GLN   6 -19.318  -2.126  15.452
   54   HE22  GLN   6          HE22      GLN   6 -20.202  -2.814  16.728
   55    H    LEU   7           HN       LEU   7 -14.859  -5.601  13.570
   56    HA   LEU   7           HA       LEU   7 -15.727  -3.777  11.561
   57    HB2  LEU   7           HB2      LEU   7 -13.416  -4.598  11.663
   58    HB3  LEU   7           HB1      LEU   7 -13.966  -6.237  11.322
   59    HG   LEU   7           HG       LEU   7 -14.771  -5.544   9.114
   60   HD11  LEU   7          HD11      LEU   7 -14.035  -2.811  10.146
   61   HD12  LEU   7          HD12      LEU   7 -15.500  -3.328   9.307
   62   HD13  LEU   7          HD13      LEU   7 -14.000  -3.138   8.418
   63   HD21  LEU   7          HD21      LEU   7 -12.414  -6.236   9.343
   64   HD22  LEU   7          HD22      LEU   7 -11.953  -4.567   9.665
   65   HD23  LEU   7          HD23      LEU   7 -12.594  -5.015   8.083
   66    H    LYS   8           HN       LYS   8 -16.197  -7.284  11.910
   67    HA   LYS   8           HA       LYS   8 -17.565  -7.697   9.437
   68    HB2  LYS   8           HB2      LYS   8 -17.735  -9.152  12.088
   69    HB3  LYS   8           HB1      LYS   8 -18.502  -9.727  10.609
   70    HG2  LYS   8           HG2      LYS   8 -16.293  -9.786   9.495
   71    HG3  LYS   8           HG1      LYS   8 -15.533  -9.229  10.987
   72    HD2  LYS   8           HD2      LYS   8 -16.312 -11.232  12.166
   73    HD3  LYS   8           HD1      LYS   8 -17.148 -11.782  10.713
   74    HE2  LYS   8           HE2      LYS   8 -15.000 -12.934  10.904
   75    HE3  LYS   8           HE1      LYS   8 -14.967 -11.846   9.515
   76    HZ1  LYS   8           HZ1      LYS   8 -13.897 -11.203  12.211
   77    HZ2  LYS   8           HZ2      LYS   8 -13.812 -10.212  10.833
   78    HZ3  LYS   8           HZ3      LYS   8 -12.960 -11.680  10.880
   79    H    HIS   9           HN       HIS   9 -18.717  -6.809  12.671
   80    HA   HIS   9           HA       HIS   9 -21.508  -6.956  12.156
   81    HB2  HIS   9           HB2      HIS   9 -20.532  -6.670  14.410
   82    HB3  HIS   9           HB1      HIS   9 -20.028  -5.039  13.973
   83    HD1  HIS   9           HD1      HIS   9 -23.262  -7.070  14.103
   84    HD2  HIS   9           HD2      HIS   9 -21.951  -3.136  14.527
   85    HE1  HIS   9           HE1      HIS   9 -25.286  -5.710  14.786
   86    H    TYR  10           HN       TYR  10 -19.203  -4.273  11.720
   87    HA   TYR  10           HA       TYR  10 -21.117  -2.319  10.895
   88    HB2  TYR  10           HB2      TYR  10 -18.755  -1.804  11.516
   89    HB3  TYR  10           HB1      TYR  10 -18.225  -2.578  10.020
   90    HD1  TYR  10           HD1      TYR  10 -20.213   0.224  11.413
   91    HD2  TYR  10           HD2      TYR  10 -18.415  -1.466   7.902
   92    HE1  TYR  10           HE1      TYR  10 -20.661   2.323  10.176
   93    HE2  TYR  10           HE2      TYR  10 -18.860   0.636   6.660
   94    HH   TYR  10           HH       TYR  10 -20.914   3.098   7.907
   95    H    ILE  11           HN       ILE  11 -19.052  -4.498   8.958
   96    HA   ILE  11           HA       ILE  11 -20.108  -3.681   6.422
   97    HB   ILE  11           HB       ILE  11 -18.738  -6.218   7.333
   98   HG12  ILE  11          HG12      ILE  11 -17.406  -4.140   7.441
   99   HG13  ILE  11          HG11      ILE  11 -16.786  -5.245   6.219
  100   HG21  ILE  11          HG21      ILE  11 -18.294  -6.483   4.814
  101   HG22  ILE  11          HG22      ILE  11 -19.636  -5.363   4.583
  102   HG23  ILE  11          HG23      ILE  11 -19.905  -6.907   5.394
  103   HD11  ILE  11          HD11      ILE  11 -18.489  -3.757   4.684
  104   HD12  ILE  11          HD12      ILE  11 -16.803  -3.370   4.919
  105   HD13  ILE  11          HD13      ILE  11 -18.030  -2.569   5.892
  106    H    THR  12           HN       THR  12 -20.960  -6.370   8.588
  107    HA   THR  12           HA       THR  12 -22.935  -7.499   6.862
  108    HB   THR  12           HB       THR  12 -23.780  -8.561   8.975
  109    HG1  THR  12           HG1      THR  12 -22.210  -8.024  10.770
  110   HG21  THR  12          HG21      THR  12 -20.877  -8.583   8.183
  111   HG22  THR  12          HG22      THR  12 -22.080  -9.866   8.050
  112   HG23  THR  12          HG23      THR  12 -21.375  -9.473   9.619
  113    H    ASN  13           HN       ASN  13 -23.221  -5.172   9.551
  114    HA   ASN  13           HA       ASN  13 -26.064  -4.821   9.298
  115    HB2  ASN  13           HB2      ASN  13 -24.818  -4.184  11.325
  116    HB3  ASN  13           HB1      ASN  13 -23.960  -2.944  10.409
  117   HD21  ASN  13          HD21      ASN  13 -24.845  -1.094  11.482
  118   HD22  ASN  13          HD22      ASN  13 -26.495  -0.698  11.427
  119    H    LEU  14           HN       LEU  14 -23.275  -3.089   7.937
  120    HA   LEU  14           HA       LEU  14 -24.756  -0.990   6.694
  121    HB2  LEU  14           HB2      LEU  14 -22.316  -0.893   6.994
  122    HB3  LEU  14           HB1      LEU  14 -22.115  -2.238   5.874
  123    HG   LEU  14           HG       LEU  14 -23.062  -0.892   4.048
  124   HD11  LEU  14          HD11      LEU  14 -24.627   0.573   4.998
  125   HD12  LEU  14          HD12      LEU  14 -23.293   1.659   4.631
  126   HD13  LEU  14          HD13      LEU  14 -23.526   1.079   6.280
  127   HD21  LEU  14          HD21      LEU  14 -20.952   0.707   5.525
  128   HD22  LEU  14          HD22      LEU  14 -21.216   0.649   3.782
  129   HD23  LEU  14          HD23      LEU  14 -20.608  -0.773   4.631
  130    H    PHE  15           HN       PHE  15 -23.721  -4.174   5.459
  131    HA   PHE  15           HA       PHE  15 -25.328  -3.711   2.985
  132    HB2  PHE  15           HB2      PHE  15 -23.140  -5.652   3.741
  133    HB3  PHE  15           HB1      PHE  15 -24.171  -5.938   2.332
  134    HD1  PHE  15           HD2      PHE  15 -24.300  -4.164   0.534
  135    HD2  PHE  15           HD1      PHE  15 -21.369  -4.070   3.670
  136    HE1  PHE  15           HE2      PHE  15 -22.935  -2.575  -0.791
  137    HE2  PHE  15           HE1      PHE  15 -20.002  -2.480   2.346
  138    HZ   PHE  15           HZ       PHE  15 -20.786  -1.733   0.114
  139    H    ASN  16           HN       ASN  16 -25.866  -4.799   6.002
  140    HA   ASN  16           HA       ASN  16 -27.441  -6.233   6.966
  141    HB2  ASN  16           HB2      ASN  16 -28.873  -4.832   5.416
  142    HB3  ASN  16           HB1      ASN  16 -28.761  -6.143   4.241
  143   HD21  ASN  16          HD21      ASN  16 -30.265  -5.125   7.237
  144   HD22  ASN  16          HD22      ASN  16 -31.236  -6.502   7.449
  145    H    LEU  17           HN       LEU  17 -25.161  -7.549   6.014
  146    HA   LEU  17           HA       LEU  17 -26.148  -9.976   4.604
  147    HB2  LEU  17           HB2      LEU  17 -23.322  -9.320   5.485
  148    HB3  LEU  17           HB1      LEU  17 -23.806 -10.550   4.330
  149    HG   LEU  17           HG       LEU  17 -24.304  -7.599   3.951
  150   HD11  LEU  17          HD11      LEU  17 -21.891  -8.093   3.948
  151   HD12  LEU  17          HD12      LEU  17 -22.449  -7.693   2.324
  152   HD13  LEU  17          HD13      LEU  17 -22.155  -9.374   2.765
  153   HD21  LEU  17          HD21      LEU  17 -24.561  -8.435   1.528
  154   HD22  LEU  17          HD22      LEU  17 -25.871  -8.812   2.640
  155   HD23  LEU  17          HD23      LEU  17 -24.684 -10.047   2.226
  156    HA   PRO  18           HA       PRO  18 -26.435 -12.211   8.431
  157    HB2  PRO  18           HB2      PRO  18 -25.906 -14.772   7.582
  158    HB3  PRO  18           HB1      PRO  18 -27.435 -13.934   7.247
  159    HG2  PRO  18           HG2      PRO  18 -25.046 -14.275   5.481
  160    HG3  PRO  18           HG1      PRO  18 -26.770 -14.439   5.087
  161    HD2  PRO  18           HD2      PRO  18 -25.378 -12.199   4.472
  162    HD3  PRO  18           HD1      PRO  18 -27.090 -12.132   4.930
  163    H    ARG  19           HN       ARG  19 -24.870 -11.885   9.937
  164    HA   ARG  19           HA       ARG  19 -22.043 -12.255   9.399
  165    HB2  ARG  19           HB2      ARG  19 -21.747 -11.614  11.741
  166    HB3  ARG  19           HB1      ARG  19 -22.921 -10.545  10.976
  167    HG2  ARG  19           HG2      ARG  19 -24.760 -11.950  11.896
  168    HG3  ARG  19           HG1      ARG  19 -23.560 -12.928  12.741
  169    HD2  ARG  19           HD2      ARG  19 -24.406 -11.267  14.290
  170    HD3  ARG  19           HD1      ARG  19 -22.745 -10.852  13.874
  171    HE   ARG  19           HE       ARG  19 -23.538  -8.950  12.692
  172   HH11  ARG  19          HH21      ARG  19 -26.084 -11.046  13.728
  173   HH12  ARG  19          HH22      ARG  19 -27.340  -9.919  13.343
  174   HH21  ARG  19          HH11      ARG  19 -25.169  -7.480  12.184
  175   HH22  ARG  19          HH12      ARG  19 -26.824  -7.904  12.467
  176    H    ASP  20           HN       ASP  20 -24.500 -14.424  10.088
  177    HA   ASP  20           HA       ASP  20 -23.015 -16.220  11.839
  178    HB2  ASP  20           HB2      ASP  20 -25.501 -16.588  10.145
  179    HB3  ASP  20           HB1      ASP  20 -24.850 -17.838  11.203
  180    H    GLU  21           HN       GLU  21 -22.575 -15.371   8.664
  181    HA   GLU  21           HA       GLU  21 -21.790 -18.107   7.769
  182    HB2  GLU  21           HB2      GLU  21 -23.176 -16.749   6.234
  183    HB3  GLU  21           HB1      GLU  21 -21.928 -15.504   6.215
  184    HG2  GLU  21           HG2      GLU  21 -20.323 -17.091   5.258
  185    HG3  GLU  21           HG1      GLU  21 -21.522 -18.382   5.341
  186    H    LYS  22           HN       LYS  22 -19.735 -18.673   8.163
  187    HA   LYS  22           HA       LYS  22 -17.726 -16.685   8.834
  188    HB2  LYS  22           HB2      LYS  22 -17.715 -18.852   9.959
  189    HB3  LYS  22           HB1      LYS  22 -17.521 -19.681   8.417
  190    HG2  LYS  22           HG2      LYS  22 -15.367 -19.512   9.594
  191    HG3  LYS  22           HG1      LYS  22 -15.321 -18.577   8.106
  192    HD2  LYS  22           HD2      LYS  22 -15.495 -16.513   9.252
  193    HD3  LYS  22           HD1      LYS  22 -16.084 -17.287  10.726
  194    HE2  LYS  22           HE2      LYS  22 -13.306 -17.646   9.569
  195    HE3  LYS  22           HE1      LYS  22 -13.709 -16.566  10.904
  196    HZ1  LYS  22           HZ1      LYS  22 -13.926 -19.518  10.825
  197    HZ2  LYS  22           HZ2      LYS  22 -14.667 -18.574  12.029
  198    HZ3  LYS  22           HZ3      LYS  22 -12.976 -18.571  11.863
  199    H    TRP  23           HN       TRP  23 -16.029 -15.983   7.561
  200    HA   TRP  23           HA       TRP  23 -16.182 -16.684   4.658
  201    HB2  TRP  23           HB2      TRP  23 -14.671 -14.390   5.923
  202    HB3  TRP  23           HB1      TRP  23 -15.167 -14.567   4.240
  203    HD1  TRP  23           HD1      TRP  23 -18.176 -15.654   5.227
  204    HE1  TRP  23           HE1      TRP  23 -19.879 -13.851   5.901
  205    HE3  TRP  23           HE3      TRP  23 -15.015 -11.733   6.110
  206    HZ2  TRP  23           HZ2      TRP  23 -19.911 -11.109   6.698
  207    HZ3  TRP  23           HZ3      TRP  23 -15.915  -9.536   6.821
  208    HH2  TRP  23           HH2      TRP  23 -18.357  -9.220   7.117
  209    H    GLU  24           HN       GLU  24 -13.948 -16.557   3.549
  210    HA   GLU  24           HA       GLU  24 -11.973 -18.101   5.193
  211    HB2  GLU  24           HB2      GLU  24 -12.946 -19.230   3.165
  212    HB3  GLU  24           HB1      GLU  24 -12.224 -17.961   2.176
  213    HG2  GLU  24           HG2      GLU  24 -10.705 -19.835   2.173
  214    HG3  GLU  24           HG1      GLU  24  -9.983 -18.574   3.171
  215    H    CYS  25           HN       CYS  25 -10.153 -17.027   5.709
  216    HA   CYS  25           HA       CYS  25  -9.511 -14.505   4.265
  217    HB2  CYS  25           HB2      CYS  25  -8.085 -15.475   6.734
  218    HB3  CYS  25           HB1      CYS  25  -8.381 -13.821   6.195
  219    HG   CYS  25           HG       CYS  25 -10.238 -15.440   7.937
  220    H    GLU  26           HN       GLU  26  -7.634 -14.245   3.143
  221    HA   GLU  26           HA       GLU  26  -5.711 -16.543   3.054
  222    HB2  GLU  26           HB2      GLU  26  -7.204 -16.378   1.024
  223    HB3  GLU  26           HB1      GLU  26  -6.524 -14.778   0.725
  224    HG2  GLU  26           HG2      GLU  26  -5.272 -16.337  -0.611
  225    HG3  GLU  26           HG1      GLU  26  -4.234 -15.860   0.732
  226    H    SER  27           HN       SER  27  -3.772 -15.852   3.791
  227    HA   SER  27           HA       SER  27  -3.181 -12.954   3.844
  228    HB2  SER  27           HB2      SER  27  -2.716 -14.223   5.866
  229    HB3  SER  27           HB1      SER  27  -1.730 -15.366   4.963
  230    HG   SER  27           HG       SER  27  -0.834 -13.314   6.156
  231    H    ILE  28           HN       ILE  28  -2.313 -12.139   2.016
  232    HA   ILE  28           HA       ILE  28  -0.216 -13.740   0.586
  233    HB   ILE  28           HB       ILE  28  -2.179 -11.735  -0.560
  234   HG12  ILE  28          HG12      ILE  28  -3.282 -13.835   0.026
  235   HG13  ILE  28          HG11      ILE  28  -3.117 -13.721  -1.721
  236   HG21  ILE  28          HG21      ILE  28   0.026 -13.398  -1.796
  237   HG22  ILE  28          HG22      ILE  28  -0.133 -11.641  -1.809
  238   HG23  ILE  28          HG23      ILE  28  -1.252 -12.637  -2.742
  239   HD11  ILE  28          HD11      ILE  28  -0.856 -15.057  -1.267
  240   HD12  ILE  28          HD12      ILE  28  -2.391 -15.901  -1.375
  241   HD13  ILE  28          HD13      ILE  28  -1.701 -15.533   0.199
  242    H    GLU  29           HN       GLU  29   1.697 -12.774   0.304
  243    HA   GLU  29           HA       GLU  29   2.178 -10.218   1.625
  244    HB2  GLU  29           HB2      GLU  29   3.966 -12.137   0.106
  245    HB3  GLU  29           HB1      GLU  29   4.553 -10.666   0.888
  246    HG2  GLU  29           HG2      GLU  29   3.749 -11.454   3.057
  247    HG3  GLU  29           HG1      GLU  29   3.046 -12.885   2.304
  248    H    GLU  30           HN       GLU  30   2.056  -8.265   0.613
  249    HA   GLU  30           HA       GLU  30   2.845  -8.049  -2.223
  250    HB2  GLU  30           HB2      GLU  30   0.427  -8.625  -2.315
  251    HB3  GLU  30           HB1      GLU  30   0.073  -7.225  -1.300
  252    HG2  GLU  30           HG2      GLU  30   0.999  -5.720  -2.995
  253    HG3  GLU  30           HG1      GLU  30   1.458  -7.096  -3.997
  254    H    VAL  31           HN       VAL  31   3.239  -5.871  -2.859
  255    HA   VAL  31           HA       VAL  31   4.245  -4.179  -0.779
  256    HB   VAL  31           HB       VAL  31   3.689  -3.649  -3.703
  257   HG11  VAL  31          HG11      VAL  31   5.100  -2.004  -1.588
  258   HG12  VAL  31          HG12      VAL  31   3.761  -1.509  -2.625
  259   HG13  VAL  31          HG13      VAL  31   5.363  -1.766  -3.315
  260   HG21  VAL  31          HG21      VAL  31   5.372  -5.420  -3.107
  261   HG22  VAL  31          HG22      VAL  31   6.277  -4.195  -2.217
  262   HG23  VAL  31          HG23      VAL  31   6.073  -4.048  -3.963
  263    H    ALA  32           HN       ALA  32   3.295  -2.537   0.313
  264    HA   ALA  32           HA       ALA  32   0.464  -2.227   0.387
  265    HB1  ALA  32           HB1      ALA  32   1.708  -1.578   2.306
  266    HB2  ALA  32           HB2      ALA  32   1.089  -0.069   1.640
  267    HB3  ALA  32           HB3      ALA  32   2.767  -0.535   1.358
  268    H    ASP  33           HN       ASP  33   2.977  -0.393  -1.316
  269    HA   ASP  33           HA       ASP  33   1.340   1.763  -2.210
  270    HB2  ASP  33           HB2      ASP  33   3.885   1.545  -2.313
  271    HB3  ASP  33           HB1      ASP  33   3.640   0.576  -3.766
  272    H    ASP  34           HN       ASP  34   1.853  -1.478  -3.530
  273    HA   ASP  34           HA       ASP  34   0.568  -0.964  -6.058
  274    HB2  ASP  34           HB2      ASP  34   1.097  -3.510  -4.512
  275    HB3  ASP  34           HB1      ASP  34   0.362  -3.494  -6.115
  276    H    ILE  35           HN       ILE  35  -0.699  -1.120  -2.930
  277    HA   ILE  35           HA       ILE  35  -3.449  -1.630  -4.017
  278    HB   ILE  35           HB       ILE  35  -4.012  -2.693  -1.840
  279   HG12  ILE  35          HG12      ILE  35  -1.016  -2.727  -1.370
  280   HG13  ILE  35          HG11      ILE  35  -2.095  -1.572  -0.593
  281   HG21  ILE  35          HG21      ILE  35  -2.984  -4.819  -2.351
  282   HG22  ILE  35          HG22      ILE  35  -1.656  -4.028  -3.200
  283   HG23  ILE  35          HG23      ILE  35  -3.285  -3.990  -3.878
  284   HD11  ILE  35          HD11      ILE  35  -2.135  -4.586  -0.329
  285   HD12  ILE  35          HD12      ILE  35  -3.438  -3.548   0.255
  286   HD13  ILE  35          HD13      ILE  35  -1.819  -3.401   0.939
  287    H    LEU  36           HN       LEU  36  -1.362   0.268  -2.003
  288    HA   LEU  36           HA       LEU  36  -3.693   1.924  -1.121
  289    HB2  LEU  36           HB2      LEU  36  -0.979   1.468   0.096
  290    HB3  LEU  36           HB1      LEU  36  -1.971   2.847   0.546
  291    HG   LEU  36           HG       LEU  36  -3.212   0.102   0.581
  292   HD11  LEU  36          HD11      LEU  36  -1.279   1.234   2.606
  293   HD12  LEU  36          HD12      LEU  36  -1.280  -0.368   1.867
  294   HD13  LEU  36          HD13      LEU  36  -2.509   0.054   3.059
  295   HD21  LEU  36          HD21      LEU  36  -3.565   2.589   2.294
  296   HD22  LEU  36          HD22      LEU  36  -4.527   1.117   2.412
  297   HD23  LEU  36          HD23      LEU  36  -4.617   2.113   0.964
  298    HA   PRO  37           HA       PRO  37  -1.936   4.565  -4.438
  299    HB2  PRO  37           HB2      PRO  37  -4.023   6.339  -3.184
  300    HB3  PRO  37           HB1      PRO  37  -3.658   6.076  -4.903
  301    HG2  PRO  37           HG2      PRO  37  -5.748   4.898  -3.816
  302    HG3  PRO  37           HG1      PRO  37  -4.702   3.998  -4.934
  303    HD2  PRO  37           HD2      PRO  37  -4.864   3.803  -1.944
  304    HD3  PRO  37           HD1      PRO  37  -4.575   2.526  -3.152
  305    H    ASP  38           HN       ASP  38  -0.583   6.410  -4.414
  306    HA   ASP  38           HA       ASP  38   1.010   6.905  -2.167
  307    HB2  ASP  38           HB2      ASP  38   0.343   8.685  -4.523
  308    HB3  ASP  38           HB1      ASP  38   1.589   9.079  -3.339
  309    H    GLN  39           HN       GLN  39  -2.214   7.794  -2.607
  310    HA   GLN  39           HA       GLN  39  -2.331  10.327  -1.295
  311    HB2  GLN  39           HB2      GLN  39  -4.359   8.079  -1.426
  312    HB3  GLN  39           HB1      GLN  39  -4.714   9.719  -0.883
  313    HG2  GLN  39           HG2      GLN  39  -3.598   9.023  -3.616
  314    HG3  GLN  39           HG1      GLN  39  -5.303   9.338  -3.283
  315   HE21  GLN  39          HE21      GLN  39  -2.758  10.867  -4.608
  316   HE22  GLN  39          HE22      GLN  39  -3.043  12.461  -4.097
  317    H    TYR  40           HN       TYR  40  -2.457   7.003  -0.013
  318    HA   TYR  40           HA       TYR  40  -2.403   8.129   2.768
  319    HB2  TYR  40           HB2      TYR  40  -3.237   5.416   1.711
  320    HB3  TYR  40           HB1      TYR  40  -3.124   5.818   3.426
  321    HD1  TYR  40           HD2      TYR  40  -4.664   7.418   4.453
  322    HD2  TYR  40           HD1      TYR  40  -4.982   6.378   0.298
  323    HE1  TYR  40           HE2      TYR  40  -6.920   8.441   4.372
  324    HE2  TYR  40           HE1      TYR  40  -7.241   7.403   0.216
  325    HH   TYR  40           HH       TYR  40  -9.100   7.893   1.934
  326    H    VAL  41           HN       VAL  41  -0.314   6.940   0.461
  327    HA   VAL  41           HA       VAL  41   1.446   5.623   2.504
  328    HB   VAL  41           HB       VAL  41   1.712   5.448  -0.498
  329   HG11  VAL  41          HG11      VAL  41   2.729   3.722   1.778
  330   HG12  VAL  41          HG12      VAL  41   3.696   4.890   0.877
  331   HG13  VAL  41          HG13      VAL  41   3.047   3.465   0.063
  332   HG21  VAL  41          HG21      VAL  41   0.652   3.154  -0.132
  333   HG22  VAL  41          HG22      VAL  41  -0.447   4.529  -0.017
  334   HG23  VAL  41          HG23      VAL  41   0.142   3.744   1.449
  335    H    ARG  42           HN       ARG  42   2.580   7.337   3.333
  336    HA   ARG  42           HA       ARG  42   4.720   8.446   1.765
  337    HB2  ARG  42           HB2      ARG  42   4.055  10.802   1.764
  338    HB3  ARG  42           HB1      ARG  42   2.837   9.860   0.907
  339    HG2  ARG  42           HG2      ARG  42   1.492   9.783   3.024
  340    HG3  ARG  42           HG1      ARG  42   2.676  10.864   3.761
  341    HD2  ARG  42           HD2      ARG  42   1.155  11.521   1.227
  342    HD3  ARG  42           HD1      ARG  42   0.670  12.061   2.834
  343    HE   ARG  42           HE       ARG  42   3.374  12.813   2.480
  344   HH11  ARG  42          HH21      ARG  42   0.261  13.416   1.118
  345   HH12  ARG  42          HH22      ARG  42   0.630  15.048   0.670
  346   HH21  ARG  42          HH11      ARG  42   3.865  14.936   1.907
  347   HH22  ARG  42          HH12      ARG  42   2.670  15.910   1.117
  348    H    LEU  43           HN       LEU  43   3.164   7.695   4.601
  349    HA   LEU  43           HA       LEU  43   4.337   9.510   6.480
  350    HB2  LEU  43           HB2      LEU  43   3.241   6.705   6.661
  351    HB3  LEU  43           HB1      LEU  43   3.983   7.465   8.065
  352    HG   LEU  43           HG       LEU  43   1.488   7.762   7.938
  353   HD11  LEU  43          HD11      LEU  43   1.577   9.851   8.906
  354   HD12  LEU  43          HD12      LEU  43   2.609  10.525   7.648
  355   HD13  LEU  43          HD13      LEU  43   3.301   9.506   8.904
  356   HD21  LEU  43          HD21      LEU  43   0.516   9.135   6.241
  357   HD22  LEU  43          HD22      LEU  43   1.553   7.990   5.396
  358   HD23  LEU  43          HD23      LEU  43   2.094   9.648   5.653
  359    H    GLY  44           HN       GLY  44   5.455   6.392   5.169
  360    HA2  GLY  44           HA2      GLY  44   7.992   6.438   4.766
  361    HA3  GLY  44           HA1      GLY  44   8.121   6.853   6.466
  362    HA   PRO  45           HA       PRO  45   7.971   2.688   7.936
  363    HB2  PRO  45           HB2      PRO  45   5.159   2.965   8.936
  364    HB3  PRO  45           HB1      PRO  45   6.621   2.463   9.807
  365    HG2  PRO  45           HG2      PRO  45   5.552   4.886  10.147
  366    HG3  PRO  45           HG1      PRO  45   7.309   4.635  10.170
  367    HD2  PRO  45           HD2      PRO  45   5.612   5.845   8.026
  368    HD3  PRO  45           HD1      PRO  45   7.285   6.216   8.484
  369    H    LEU  46           HN       LEU  46   4.852   3.552   6.426
  370    HA   LEU  46           HA       LEU  46   4.450   0.767   5.520
  371    HB2  LEU  46           HB2      LEU  46   2.797   3.212   4.839
  372    HB3  LEU  46           HB1      LEU  46   2.298   1.523   4.768
  373    HG   LEU  46           HG       LEU  46   3.016   3.060   7.284
  374   HD11  LEU  46          HD11      LEU  46   0.356   1.972   6.310
  375   HD12  LEU  46          HD12      LEU  46   0.826   3.672   6.290
  376   HD13  LEU  46          HD13      LEU  46   0.634   2.829   7.827
  377   HD21  LEU  46          HD21      LEU  46   3.640   0.814   7.705
  378   HD22  LEU  46          HD22      LEU  46   2.292   0.171   6.767
  379   HD23  LEU  46          HD23      LEU  46   2.000   0.919   8.337
  380    H    SER  47           HN       SER  47   6.216   3.382   4.495
  381    HA   SER  47           HA       SER  47   5.672   3.274   1.650
  382    HB2  SER  47           HB2      SER  47   8.162   4.339   2.979
  383    HB3  SER  47           HB1      SER  47   7.489   4.804   1.419
  384    HG   SER  47           HG       SER  47   5.580   5.449   2.692
  385    H    ASN  48           HN       ASN  48   6.735   2.175   0.066
  386    HA   ASN  48           HA       ASN  48   7.834   0.314  -0.839
  387    HB2  ASN  48           HB2      ASN  48  10.318   0.440  -0.454
  388    HB3  ASN  48           HB1      ASN  48   9.586   1.959  -0.963
  389   HD21  ASN  48          HD21      ASN  48  10.116   3.738   0.304
  390   HD22  ASN  48          HD22      ASN  48  10.683   3.663   1.903
  391    H    LYS  49           HN       LYS  49   6.453  -0.360   1.613
  392    HA   LYS  49           HA       LYS  49   8.267  -2.510   2.648
  393    HB2  LYS  49           HB2      LYS  49   7.538  -0.641   4.264
  394    HB3  LYS  49           HB1      LYS  49   5.932  -1.362   4.171
  395    HG2  LYS  49           HG2      LYS  49   6.779  -3.491   4.978
  396    HG3  LYS  49           HG1      LYS  49   8.437  -2.906   4.910
  397    HD2  LYS  49           HD2      LYS  49   7.818  -2.715   7.191
  398    HD3  LYS  49           HD1      LYS  49   7.710  -1.080   6.545
  399    HE2  LYS  49           HE2      LYS  49   5.328  -1.191   6.406
  400    HE3  LYS  49           HE1      LYS  49   5.319  -2.933   6.678
  401    HZ1  LYS  49           HZ1      LYS  49   5.111  -2.492   8.822
  402    HZ2  LYS  49           HZ2      LYS  49   5.328  -0.826   8.570
  403    HZ3  LYS  49           HZ3      LYS  49   6.674  -1.836   8.811
  404    H    ILE  50           HN       ILE  50   7.399  -4.580   2.829
  405    HA   ILE  50           HA       ILE  50   5.037  -5.085   1.149
  406    HB   ILE  50           HB       ILE  50   6.971  -6.941   2.552
  407   HG12  ILE  50          HG12      ILE  50   6.596  -6.361  -0.400
  408   HG13  ILE  50          HG11      ILE  50   7.791  -5.538   0.604
  409   HG21  ILE  50          HG21      ILE  50   4.918  -8.141   2.361
  410   HG22  ILE  50          HG22      ILE  50   5.880  -8.640   0.972
  411   HG23  ILE  50          HG23      ILE  50   4.583  -7.462   0.768
  412   HD11  ILE  50          HD11      ILE  50   8.904  -7.626   1.106
  413   HD12  ILE  50          HD12      ILE  50   8.705  -7.525  -0.643
  414   HD13  ILE  50          HD13      ILE  50   7.630  -8.550   0.309
  415    H    LEU  51           HN       LEU  51   3.088  -4.928   2.094
  416    HA   LEU  51           HA       LEU  51   2.790  -5.631   4.968
  417    HB2  LEU  51           HB2      LEU  51   1.180  -4.029   2.991
  418    HB3  LEU  51           HB1      LEU  51   0.406  -4.646   4.448
  419    HG   LEU  51           HG       LEU  51   1.339  -2.310   4.682
  420   HD11  LEU  51          HD11      LEU  51   2.966  -3.968   6.566
  421   HD12  LEU  51          HD12      LEU  51   1.222  -4.228   6.567
  422   HD13  LEU  51          HD13      LEU  51   1.872  -2.629   6.897
  423   HD21  LEU  51          HD21      LEU  51   3.676  -1.911   4.626
  424   HD22  LEU  51          HD22      LEU  51   3.380  -2.932   3.221
  425   HD23  LEU  51          HD23      LEU  51   4.056  -3.630   4.693
  426    H    GLN  52           HN       GLN  52   1.467  -7.291   5.644
  427    HA   GLN  52           HA       GLN  52   0.948  -9.400   3.724
  428    HB2  GLN  52           HB2      GLN  52   0.244  -9.059   6.654
  429    HB3  GLN  52           HB1      GLN  52  -0.090 -10.529   5.737
  430    HG2  GLN  52           HG2      GLN  52   2.290 -10.793   5.229
  431    HG3  GLN  52           HG1      GLN  52   2.656  -9.276   6.049
  432   HE21  GLN  52          HE21      GLN  52   2.636 -12.603   6.522
  433   HE22  GLN  52          HE22      GLN  52   2.530 -12.628   8.216
  434    H    THR  53           HN       THR  53  -0.775  -9.371   2.384
  435    HA   THR  53           HA       THR  53  -3.122  -7.698   3.034
  436    HB   THR  53           HB       THR  53  -3.798  -8.239   0.707
  437    HG1  THR  53           HG1      THR  53  -2.968  -9.951  -0.135
  438   HG21  THR  53          HG21      THR  53  -0.878  -7.459   0.836
  439   HG22  THR  53          HG22      THR  53  -2.181  -6.372   1.306
  440   HG23  THR  53          HG23      THR  53  -2.073  -6.951  -0.357
  441    H    ASN  54           HN       ASN  54  -4.786  -8.587   4.118
  442    HA   ASN  54           HA       ASN  54  -5.288 -11.528   3.873
  443    HB2  ASN  54           HB2      ASN  54  -5.943  -9.493   6.010
  444    HB3  ASN  54           HB1      ASN  54  -6.728 -11.075   5.952
  445   HD21  ASN  54          HD21      ASN  54  -5.265 -10.781   8.197
  446   HD22  ASN  54          HD22      ASN  54  -3.766 -11.573   8.098
  447    H    THR  55           HN       THR  55  -6.642 -11.706   2.134
  448    HA   THR  55           HA       THR  55  -8.928  -9.817   1.885
  449    HB   THR  55           HB       THR  55  -7.882 -11.947  -0.003
  450    HG1  THR  55           HG1      THR  55  -7.243  -9.352   0.511
  451   HG21  THR  55          HG21      THR  55 -10.116  -9.921  -0.194
  452   HG22  THR  55          HG22      THR  55 -10.198 -11.662  -0.470
  453   HG23  THR  55          HG23      THR  55  -9.362 -10.625  -1.626
  454    H    TYR  56           HN       TYR  56 -11.008 -10.472   2.256
  455    HA   TYR  56           HA       TYR  56 -11.381 -13.255   3.267
  456    HB2  TYR  56           HB2      TYR  56 -13.109 -10.769   3.426
  457    HB3  TYR  56           HB1      TYR  56 -13.544 -12.336   4.113
  458    HD1  TYR  56           HD1      TYR  56 -10.907  -9.696   4.166
  459    HD2  TYR  56           HD2      TYR  56 -12.714 -12.998   6.234
  460    HE1  TYR  56           HE1      TYR  56  -9.548  -9.181   6.174
  461    HE2  TYR  56           HE2      TYR  56 -11.352 -12.485   8.241
  462    HH   TYR  56           HH       TYR  56  -9.513 -11.324   8.965
  463    H    TYR  57           HN       TYR  57 -12.365 -14.731   1.991
  464    HA   TYR  57           HA       TYR  57 -13.940 -13.767  -0.377
  465    HB2  TYR  57           HB2      TYR  57 -12.282 -16.267   0.042
  466    HB3  TYR  57           HB1      TYR  57 -13.342 -16.013  -1.346
  467    HD1  TYR  57           HD2      TYR  57 -12.981 -13.916  -2.773
  468    HD2  TYR  57           HD1      TYR  57 -10.098 -15.342   0.075
  469    HE1  TYR  57           HE2      TYR  57 -11.216 -12.583  -3.892
  470    HE2  TYR  57           HE1      TYR  57  -8.333 -14.005  -1.045
  471    HH   TYR  57           HH       TYR  57  -7.827 -12.815  -2.896
  472    H    SER  58           HN       SER  58 -16.073 -14.082  -0.101
  473    HA   SER  58           HA       SER  58 -16.998 -16.581   1.251
  474    HB2  SER  58           HB2      SER  58 -17.056 -14.594   2.827
  475    HB3  SER  58           HB1      SER  58 -18.226 -13.855   1.738
  476    HG   SER  58           HG       SER  58 -18.443 -16.254   3.225
  477    H    ASP  59           HN       ASP  59 -19.105 -17.262   0.573
  478    HA   ASP  59           HA       ASP  59 -19.705 -16.863  -2.189
  479    HB2  ASP  59           HB2      ASP  59 -21.336 -17.926   0.129
  480    HB3  ASP  59           HB1      ASP  59 -21.926 -17.936  -1.531
  481    H    THR  60           HN       THR  60 -21.182 -15.501   0.760
  482    HA   THR  60           HA       THR  60 -23.201 -13.963  -0.567
  483    HB   THR  60           HB       THR  60 -21.814 -13.478   2.085
  484    HG1  THR  60           HG1      THR  60 -22.866 -15.262   2.461
  485   HG21  THR  60          HG21      THR  60 -23.991 -12.270   2.584
  486   HG22  THR  60          HG22      THR  60 -24.323 -12.328   0.853
  487   HG23  THR  60          HG23      THR  60 -22.914 -11.452   1.453
  488    H    LEU  61           HN       LEU  61 -19.917 -13.102   0.531
  489    HA   LEU  61           HA       LEU  61 -20.012 -10.371  -0.325
  490    HB2  LEU  61           HB2      LEU  61 -17.685 -12.277   0.029
  491    HB3  LEU  61           HB1      LEU  61 -17.491 -10.561  -0.311
  492    HG   LEU  61           HG       LEU  61 -19.008 -11.677   2.070
  493   HD11  LEU  61          HD11      LEU  61 -17.009 -10.831   3.362
  494   HD12  LEU  61          HD12      LEU  61 -16.179 -10.612   1.821
  495   HD13  LEU  61          HD13      LEU  61 -16.671 -12.225   2.336
  496   HD21  LEU  61          HD21      LEU  61 -18.464  -9.182   2.814
  497   HD22  LEU  61          HD22      LEU  61 -19.863  -9.521   1.806
  498   HD23  LEU  61          HD23      LEU  61 -18.382  -8.904   1.075
  499    H    HIS  62           HN       HIS  62 -19.047 -13.355  -1.971
  500    HA   HIS  62           HA       HIS  62 -17.974 -12.237  -4.337
  501    HB2  HIS  62           HB2      HIS  62 -17.904 -14.649  -3.787
  502    HB3  HIS  62           HB1      HIS  62 -19.647 -14.748  -4.033
  503    HD1  HIS  62           HD1      HIS  62 -16.603 -13.583  -6.031
  504    HD2  HIS  62           HD2      HIS  62 -20.284 -15.451  -6.617
  505    HE1  HIS  62           HE1      HIS  62 -16.730 -14.159  -8.493
  506    H    LYS  63           HN       LYS  63 -21.349 -12.982  -3.490
  507    HA   LYS  63           HA       LYS  63 -22.495 -12.256  -6.009
  508    HB2  LYS  63           HB2      LYS  63 -23.631 -12.236  -3.203
  509    HB3  LYS  63           HB1      LYS  63 -24.598 -11.967  -4.653
  510    HG2  LYS  63           HG2      LYS  63 -23.948 -14.176  -5.515
  511    HG3  LYS  63           HG1      LYS  63 -22.939 -14.443  -4.092
  512    HD2  LYS  63           HD2      LYS  63 -24.939 -14.253  -2.645
  513    HD3  LYS  63           HD1      LYS  63 -25.944 -14.024  -4.077
  514    HE2  LYS  63           HE2      LYS  63 -24.204 -16.460  -3.600
  515    HE3  LYS  63           HE1      LYS  63 -25.929 -16.390  -3.234
  516    HZ1  LYS  63           HZ1      LYS  63 -25.246 -15.494  -5.886
  517    HZ2  LYS  63           HZ2      LYS  63 -26.472 -16.555  -5.378
  518    HZ3  LYS  63           HZ3      LYS  63 -24.889 -17.127  -5.604
  519    H    SER  64           HN       SER  64 -21.841 -10.379  -3.061
  520    HA   SER  64           HA       SER  64 -22.993  -7.937  -4.155
  521    HB2  SER  64           HB2      SER  64 -22.908  -8.365  -1.723
  522    HB3  SER  64           HB1      SER  64 -21.148  -8.351  -1.781
  523    HG   SER  64           HG       SER  64 -22.694  -6.310  -1.411
  524    H    ASN  65           HN       ASN  65 -20.199  -9.604  -4.826
  525    HA   ASN  65           HA       ASN  65 -18.223  -9.052  -5.930
  526    HB2  ASN  65           HB2      ASN  65 -19.928  -6.666  -6.674
  527    HB3  ASN  65           HB1      ASN  65 -18.317  -6.944  -7.330
  528   HD21  ASN  65          HD21      ASN  65 -20.618  -6.962  -9.028
  529   HD22  ASN  65          HD22      ASN  65 -20.850  -8.545  -9.596
  530    H    ILE  66           HN       ILE  66 -18.411  -8.376  -3.133
  531    HA   ILE  66           HA       ILE  66 -16.603  -5.981  -3.022
  532    HB   ILE  66           HB       ILE  66 -18.545  -7.046  -0.950
  533   HG12  ILE  66          HG12      ILE  66 -18.324  -4.331  -2.285
  534   HG13  ILE  66          HG11      ILE  66 -19.414  -5.603  -2.826
  535   HG21  ILE  66          HG21      ILE  66 -17.689  -4.990   0.349
  536   HG22  ILE  66          HG22      ILE  66 -16.316  -5.009  -0.756
  537   HG23  ILE  66          HG23      ILE  66 -16.621  -6.391   0.294
  538   HD11  ILE  66          HD11      ILE  66 -20.359  -5.629  -0.461
  539   HD12  ILE  66          HD12      ILE  66 -20.706  -4.180  -1.405
  540   HD13  ILE  66          HD13      ILE  66 -19.440  -4.150  -0.177
  541    H    TYR  67           HN       TYR  67 -14.577  -6.377  -2.334
  542    HA   TYR  67           HA       TYR  67 -13.988  -9.032  -1.064
  543    HB2  TYR  67           HB2      TYR  67 -12.101  -7.308  -2.679
  544    HB3  TYR  67           HB1      TYR  67 -11.831  -8.959  -2.118
  545    HD1  TYR  67           HD1      TYR  67 -13.625 -10.732  -2.862
  546    HD2  TYR  67           HD2      TYR  67 -12.981  -6.967  -4.828
  547    HE1  TYR  67           HE1      TYR  67 -14.705 -11.618  -4.912
  548    HE2  TYR  67           HE2      TYR  67 -14.061  -7.853  -6.877
  549    HH   TYR  67           HH       TYR  67 -15.440 -11.138  -6.956
  550    HA   PRO  68           HA       PRO  68 -13.211  -5.904   2.273
  551    HB2  PRO  68           HB2      PRO  68 -12.852  -8.468   3.773
  552    HB3  PRO  68           HB1      PRO  68 -13.795  -7.032   4.209
  553    HG2  PRO  68           HG2      PRO  68 -14.966  -9.278   3.343
  554    HG3  PRO  68           HG1      PRO  68 -15.606  -7.673   2.937
  555    HD2  PRO  68           HD2      PRO  68 -14.107  -9.594   1.199
  556    HD3  PRO  68           HD1      PRO  68 -15.360  -8.409   0.758
  557    H    PHE  69           HN       PHE  69 -11.185  -5.113   2.832
  558    HA   PHE  69           HA       PHE  69  -8.845  -6.962   2.517
  559    HB2  PHE  69           HB2      PHE  69  -9.486  -4.742   0.908
  560    HB3  PHE  69           HB1      PHE  69  -8.225  -4.136   1.977
  561    HD1  PHE  69           HD1      PHE  69  -9.089  -6.906  -0.351
  562    HD2  PHE  69           HD2      PHE  69  -5.960  -4.760   1.655
  563    HE1  PHE  69           HE1      PHE  69  -7.397  -8.141  -1.676
  564    HE2  PHE  69           HE2      PHE  69  -4.267  -5.986   0.330
  565    HZ   PHE  69           HZ       PHE  69  -4.983  -7.684  -1.333
  566    H    ILE  70           HN       ILE  70  -7.544  -7.075   4.209
  567    HA   ILE  70           HA       ILE  70  -7.404  -4.801   6.136
  568    HB   ILE  70           HB       ILE  70  -7.710  -7.729   6.892
  569   HG12  ILE  70          HG12      ILE  70  -9.574  -5.360   7.272
  570   HG13  ILE  70          HG11      ILE  70  -9.813  -6.661   6.110
  571   HG21  ILE  70          HG21      ILE  70  -6.226  -6.444   8.411
  572   HG22  ILE  70          HG22      ILE  70  -7.742  -6.854   9.205
  573   HG23  ILE  70          HG23      ILE  70  -7.482  -5.221   8.596
  574   HD11  ILE  70          HD11      ILE  70 -10.102  -6.700   9.086
  575   HD12  ILE  70          HD12      ILE  70  -9.549  -8.179   8.296
  576   HD13  ILE  70          HD13      ILE  70 -11.098  -7.470   7.851
  577    H    LEU  71           HN       LEU  71  -5.284  -4.380   6.689
  578    HA   LEU  71           HA       LEU  71  -3.216  -6.264   5.617
  579    HB2  LEU  71           HB2      LEU  71  -2.898  -3.379   6.470
  580    HB3  LEU  71           HB1      LEU  71  -1.736  -4.358   5.574
  581    HG   LEU  71           HG       LEU  71  -4.492  -3.538   4.616
  582   HD11  LEU  71          HD11      LEU  71  -2.708  -1.761   4.645
  583   HD12  LEU  71          HD12      LEU  71  -3.329  -2.136   3.037
  584   HD13  LEU  71          HD13      LEU  71  -1.765  -2.770   3.548
  585   HD21  LEU  71          HD21      LEU  71  -3.482  -4.519   2.410
  586   HD22  LEU  71          HD22      LEU  71  -4.134  -5.632   3.604
  587   HD23  LEU  71          HD23      LEU  71  -2.388  -5.386   3.487
  588    H    TYR  72           HN       TYR  72  -1.662  -7.110   6.907
  589    HA   TYR  72           HA       TYR  72  -1.730  -6.440   9.825
  590    HB2  TYR  72           HB2      TYR  72  -1.517  -9.127   8.463
  591    HB3  TYR  72           HB1      TYR  72  -1.107  -8.876  10.160
  592    HD1  TYR  72           HD2      TYR  72  -3.850  -8.743   7.665
  593    HD2  TYR  72           HD1      TYR  72  -2.802  -8.563  11.825
  594    HE1  TYR  72           HE2      TYR  72  -6.244  -8.953   8.278
  595    HE2  TYR  72           HE1      TYR  72  -5.194  -8.775  12.439
  596    HH   TYR  72           HH       TYR  72  -7.272  -9.647  11.444
  597    H    TYR  73           HN       TYR  73   0.266  -6.489  10.894
  598    HA   TYR  73           HA       TYR  73   2.679  -7.344   9.543
  599    HB2  TYR  73           HB2      TYR  73   2.252  -5.179   8.397
  600    HB3  TYR  73           HB1      TYR  73   2.326  -4.362   9.956
  601    HD1  TYR  73           HD2      TYR  73   4.267  -6.509   7.606
  602    HD2  TYR  73           HD1      TYR  73   4.415  -3.835  10.965
  603    HE1  TYR  73           HE2      TYR  73   6.742  -6.467   7.463
  604    HE2  TYR  73           HE1      TYR  73   6.890  -3.795  10.822
  605    HH   TYR  73           HH       TYR  73   8.668  -4.359   9.568
  606    H    GLN  74           HN       GLN  74   2.780  -8.489  11.544
  607    HA   GLN  74           HA       GLN  74   3.539  -8.839  13.722
  608    HB2  GLN  74           HB2      GLN  74   5.503  -7.582  12.848
  609    HB3  GLN  74           HB1      GLN  74   4.758  -6.082  13.396
  610    HG2  GLN  74           HG2      GLN  74   4.806  -6.814  15.698
  611    HG3  GLN  74           HG1      GLN  74   5.368  -8.418  15.219
  612   HE21  GLN  74          HE21      GLN  74   6.896  -6.779  17.015
  613   HE22  GLN  74          HE22      GLN  74   8.334  -6.330  16.231
  614    H    LYS  75           HN       LYS  75   2.883  -5.309  13.730
  615    HA   LYS  75           HA       LYS  75   1.557  -5.533  16.311
  616    HB2  LYS  75           HB2      LYS  75   1.939  -3.253  14.366
  617    HB3  LYS  75           HB1      LYS  75   1.102  -3.076  15.908
  618    HG2  LYS  75           HG2      LYS  75   3.097  -3.825  17.115
  619    HG3  LYS  75           HG1      LYS  75   3.932  -4.119  15.593
  620    HD2  LYS  75           HD2      LYS  75   4.729  -2.000  16.275
  621    HD3  LYS  75           HD1      LYS  75   3.496  -1.629  15.073
  622    HE2  LYS  75           HE2      LYS  75   1.886  -1.079  16.778
  623    HE3  LYS  75           HE1      LYS  75   2.926  -1.714  18.051
  624    HZ1  LYS  75           HZ1      LYS  75   2.890   0.790  17.687
  625    HZ2  LYS  75           HZ2      LYS  75   3.814   0.488  16.293
  626    HZ3  LYS  75           HZ3      LYS  75   4.408   0.044  17.822
  627    H    GLN  76           HN       GLN  76  -0.087  -7.115  15.485
  628    HA   GLN  76           HA       GLN  76  -2.199  -7.666  14.607
  629    HB2  GLN  76           HB2      GLN  76  -2.753  -4.913  15.758
  630    HB3  GLN  76           HB1      GLN  76  -3.962  -6.156  15.438
  631    HG2  GLN  76           HG2      GLN  76  -1.623  -6.458  17.339
  632    HG3  GLN  76           HG1      GLN  76  -3.287  -6.128  17.820
  633   HE21  GLN  76          HE21      GLN  76  -1.211  -8.630  17.782
  634   HE22  GLN  76          HE22      GLN  76  -2.262  -9.914  17.423
  635    H    LEU  77           HN       LEU  77  -4.209  -5.715  13.744
  636    HA   LEU  77           HA       LEU  77  -3.489  -5.600  10.960
  637    HB2  LEU  77           HB2      LEU  77  -5.694  -4.455  10.713
  638    HB3  LEU  77           HB1      LEU  77  -5.774  -6.003  11.544
  639    HG   LEU  77           HG       LEU  77  -5.387  -4.288  13.682
  640   HD11  LEU  77          HD11      LEU  77  -7.361  -2.828  11.930
  641   HD12  LEU  77          HD12      LEU  77  -5.656  -2.386  11.944
  642   HD13  LEU  77          HD13      LEU  77  -6.601  -2.288  13.429
  643   HD21  LEU  77          HD21      LEU  77  -7.068  -6.014  13.680
  644   HD22  LEU  77          HD22      LEU  77  -7.970  -5.213  12.393
  645   HD23  LEU  77          HD23      LEU  77  -7.889  -4.490  13.995
  646    H    ILE  78           HN       ILE  78  -3.137  -3.752   9.674
  647    HA   ILE  78           HA       ILE  78  -2.185  -1.348  11.185
  648    HB   ILE  78           HB       ILE  78  -1.608  -2.232   8.345
  649   HG12  ILE  78          HG12      ILE  78  -0.712  -3.872   9.907
  650   HG13  ILE  78          HG11      ILE  78   0.611  -2.909   9.259
  651   HG21  ILE  78          HG21      ILE  78   0.234  -0.605   8.497
  652   HG22  ILE  78          HG22      ILE  78  -0.299  -0.153  10.117
  653   HG23  ILE  78          HG23      ILE  78  -1.330   0.177   8.725
  654   HD11  ILE  78          HD11      ILE  78   1.102  -2.936  11.546
  655   HD12  ILE  78          HD12      ILE  78  -0.595  -2.854  12.013
  656   HD13  ILE  78          HD13      ILE  78   0.220  -1.421  11.394
  657    H    ALA  79           HN       ALA  79  -4.099  -2.349   8.328
  658    HA   ALA  79           HA       ALA  79  -5.691   0.131   8.644
  659    HB1  ALA  79           HB1      ALA  79  -3.956   0.815   7.070
  660    HB2  ALA  79           HB2      ALA  79  -5.493   0.653   6.219
  661    HB3  ALA  79           HB3      ALA  79  -4.264  -0.605   6.071
  662    H    ILE  80           HN       ILE  80  -7.706   0.045   7.486
  663    HA   ILE  80           HA       ILE  80  -8.525  -2.695   6.592
  664    HB   ILE  80           HB       ILE  80  -9.986  -0.760   8.407
  665   HG12  ILE  80          HG12      ILE  80  -9.223  -3.658   8.836
  666   HG13  ILE  80          HG11      ILE  80  -8.195  -2.319   9.333
  667   HG21  ILE  80          HG21      ILE  80 -11.738  -2.603   8.409
  668   HG22  ILE  80          HG22      ILE  80 -10.930  -3.260   6.988
  669   HG23  ILE  80          HG23      ILE  80 -11.647  -1.649   6.931
  670   HD11  ILE  80          HD11      ILE  80  -9.618  -1.682  11.034
  671   HD12  ILE  80          HD12      ILE  80  -9.982  -3.404  10.996
  672   HD13  ILE  80          HD13      ILE  80 -11.063  -2.263  10.203
  673    H    GLY  81           HN       GLY  81  -9.759  -2.724   4.730
  674    HA2  GLY  81           HA2      GLY  81 -11.218  -0.399   3.806
  675    HA3  GLY  81           HA1      GLY  81  -9.718  -0.628   2.906
  676    H    PHE  82           HN       PHE  82 -12.725  -1.021   2.305
  677    HA   PHE  82           HA       PHE  82 -12.627  -3.868   1.390
  678    HB2  PHE  82           HB2      PHE  82 -15.153  -2.268   1.183
  679    HB3  PHE  82           HB1      PHE  82 -14.926  -3.952   1.653
  680    HD1  PHE  82           HD2      PHE  82 -13.158  -4.008   3.843
  681    HD2  PHE  82           HD1      PHE  82 -16.089  -1.008   2.911
  682    HE1  PHE  82           HE2      PHE  82 -13.246  -3.348   6.230
  683    HE2  PHE  82           HE1      PHE  82 -16.173  -0.344   5.299
  684    HZ   PHE  82           HZ       PHE  82 -14.751  -1.514   6.954
  685    H    ILE  83           HN       ILE  83 -13.103  -4.343  -0.810
  686    HA   ILE  83           HA       ILE  83 -12.672  -2.029  -2.656
  687    HB   ILE  83           HB       ILE  83 -12.402  -5.010  -3.127
  688   HG12  ILE  83          HG12      ILE  83 -10.292  -2.845  -2.882
  689   HG13  ILE  83          HG11      ILE  83 -10.725  -3.947  -1.578
  690   HG21  ILE  83          HG21      ILE  83 -11.264  -4.225  -5.226
  691   HG22  ILE  83          HG22      ILE  83 -11.810  -2.590  -4.856
  692   HG23  ILE  83          HG23      ILE  83 -12.988  -3.861  -5.185
  693   HD11  ILE  83          HD11      ILE  83  -9.765  -4.853  -4.306
  694   HD12  ILE  83          HD12      ILE  83 -10.024  -5.863  -2.882
  695   HD13  ILE  83          HD13      ILE  83  -8.716  -4.680  -2.899
  696    H    ASP  84           HN       ASP  84 -14.480  -1.219  -3.512
  697    HA   ASP  84           HA       ASP  84 -16.963  -2.796  -3.622
  698    HB2  ASP  84           HB2      ASP  84 -16.249   0.071  -4.279
  699    HB3  ASP  84           HB1      ASP  84 -17.856  -0.595  -4.571
  700    H    GLU  85           HN       GLU  85 -18.275  -2.187  -5.788
  701    HA   GLU  85           HA       GLU  85 -17.055  -3.649  -7.935
  702    HB2  GLU  85           HB2      GLU  85 -19.486  -1.843  -7.820
  703    HB3  GLU  85           HB1      GLU  85 -19.053  -2.801  -9.236
  704    HG2  GLU  85           HG2      GLU  85 -19.197  -4.857  -7.931
  705    HG3  GLU  85           HG1      GLU  85 -19.532  -3.936  -6.465
  706    H    ASN  86           HN       ASN  86 -17.310  -0.195  -7.224
  707    HA   ASN  86           HA       ASN  86 -16.284   0.600  -9.845
  708    HB2  ASN  86           HB2      ASN  86 -17.814   2.021  -8.428
  709    HB3  ASN  86           HB1      ASN  86 -16.468   2.257  -7.313
  710   HD21  ASN  86          HD21      ASN  86 -16.076   4.496  -7.740
  711   HD22  ASN  86          HD22      ASN  86 -15.585   5.075  -9.257
  712    H    HIS  87           HN       HIS  87 -14.773  -1.179  -7.786
  713    HA   HIS  87           HA       HIS  87 -12.552  -1.514  -7.140
  714    HB2  HIS  87           HB2      HIS  87 -12.146  -1.222  -9.559
  715    HB3  HIS  87           HB1      HIS  87 -12.025   0.522  -9.331
  716    HD1  HIS  87           HD1      HIS  87 -10.337  -2.650  -8.056
  717    HD2  HIS  87           HD2      HIS  87  -9.475   1.375  -8.715
  718    HE1  HIS  87           HE1      HIS  87  -7.871  -2.355  -7.559
  719    H    ASP  88           HN       ASP  88 -14.207   1.141  -6.400
  720    HA   ASP  88           HA       ASP  88 -12.074   2.893  -5.468
  721    HB2  ASP  88           HB2      ASP  88 -14.283   3.775  -6.100
  722    HB3  ASP  88           HB1      ASP  88 -15.031   2.846  -4.803
  723    H    MET  89           HN       MET  89 -10.879   2.470  -3.694
  724    HA   MET  89           HA       MET  89 -11.676   0.414  -1.786
  725    HB2  MET  89           HB2      MET  89  -9.324   2.321  -1.912
  726    HB3  MET  89           HB1      MET  89  -9.511   1.082  -0.668
  727    HG2  MET  89           HG2      MET  89  -9.608  -0.657  -2.426
  728    HG3  MET  89           HG1      MET  89  -9.396   0.584  -3.659
  729    HE1  MET  89           HE1      MET  89  -7.486  -1.815  -3.707
  730    HE2  MET  89           HE2      MET  89  -5.969  -0.962  -3.978
  731    HE3  MET  89           HE3      MET  89  -7.445  -0.387  -4.749
  732    H    ASP  90           HN       ASP  90 -13.003   0.814  -0.095
  733    HA   ASP  90           HA       ASP  90 -13.349   3.614   0.854
  734    HB2  ASP  90           HB2      ASP  90 -14.956   1.077   1.223
  735    HB3  ASP  90           HB1      ASP  90 -15.282   2.546   2.147
  736    H    PHE  91           HN       PHE  91 -12.057   4.191   2.497
  737    HA   PHE  91           HA       PHE  91 -10.903   2.169   4.290
  738    HB2  PHE  91           HB2      PHE  91 -10.661   5.193   4.276
  739    HB3  PHE  91           HB1      PHE  91  -9.680   4.085   5.239
  740    HD1  PHE  91           HD2      PHE  91  -8.180   2.439   4.100
  741    HD2  PHE  91           HD1      PHE  91 -10.211   5.552   1.949
  742    HE1  PHE  91           HE2      PHE  91  -6.647   2.110   2.181
  743    HE2  PHE  91           HE1      PHE  91  -8.678   5.223   0.026
  744    HZ   PHE  91           HZ       PHE  91  -6.896   3.501   0.143
  745    H    LEU  92           HN       LEU  92 -11.776   1.631   6.213
  746    HA   LEU  92           HA       LEU  92 -13.975   3.338   7.317
  747    HB2  LEU  92           HB2      LEU  92 -14.509   0.954   6.699
  748    HB3  LEU  92           HB1      LEU  92 -13.333   0.432   7.900
  749    HG   LEU  92           HG       LEU  92 -14.618   1.720   9.634
  750   HD11  LEU  92          HD11      LEU  92 -17.108   2.099   8.839
  751   HD12  LEU  92          HD12      LEU  92 -16.375   2.231   7.243
  752   HD13  LEU  92          HD13      LEU  92 -15.894   3.331   8.529
  753   HD21  LEU  92          HD21      LEU  92 -14.902  -0.756   9.157
  754   HD22  LEU  92          HD22      LEU  92 -16.322  -0.332   8.199
  755   HD23  LEU  92          HD23      LEU  92 -16.287   0.016   9.926
  756    H    TYR  93           HN       TYR  93 -10.931   1.723   8.025
  757    HA   TYR  93           HA       TYR  93 -10.610   3.450  10.399
  758    HB2  TYR  93           HB2      TYR  93 -11.652   1.460  11.355
  759    HB3  TYR  93           HB1      TYR  93 -10.488   0.422  10.543
  760    HD1  TYR  93           HD1      TYR  93 -10.950   2.956  13.196
  761    HD2  TYR  93           HD2      TYR  93  -8.214   0.210  11.348
  762    HE1  TYR  93           HE1      TYR  93  -9.374   3.257  15.086
  763    HE2  TYR  93           HE2      TYR  93  -6.637   0.508  13.239
  764    HH   TYR  93           HH       TYR  93  -7.518   2.428  16.078
  765    H    LEU  94           HN       LEU  94  -8.631   4.305  10.152
  766    HA   LEU  94           HA       LEU  94  -6.489   2.609   8.910
  767    HB2  LEU  94           HB2      LEU  94  -7.155   4.401   7.385
  768    HB3  LEU  94           HB1      LEU  94  -6.944   5.597   8.661
  769    HG   LEU  94           HG       LEU  94  -4.546   5.116   8.771
  770   HD11  LEU  94          HD11      LEU  94  -5.306   2.892   6.889
  771   HD12  LEU  94          HD12      LEU  94  -4.252   2.845   8.302
  772   HD13  LEU  94          HD13      LEU  94  -3.684   3.581   6.806
  773   HD21  LEU  94          HD21      LEU  94  -5.332   6.769   7.116
  774   HD22  LEU  94          HD22      LEU  94  -5.498   5.489   5.914
  775   HD23  LEU  94          HD23      LEU  94  -3.902   5.920   6.530
  776    H    HIS  95           HN       HIS  95  -4.743   2.303  10.161
  777    HA   HIS  95           HA       HIS  95  -4.050   4.331  12.221
  778    HB2  HIS  95           HB2      HIS  95  -5.444   2.544  13.309
  779    HB3  HIS  95           HB1      HIS  95  -4.219   1.366  12.832
  780    HD1  HIS  95           HD1      HIS  95  -1.927   1.464  14.030
  781    HD2  HIS  95           HD2      HIS  95  -4.624   4.346  15.368
  782    HE1  HIS  95           HE1      HIS  95  -0.924   2.463  16.129
  783    H    ASN  96           HN       ASN  96  -1.922   4.743  12.116
  784    HA   ASN  96           HA       ASN  96  -0.209   3.014  10.447
  785    HB2  ASN  96           HB2      ASN  96  -0.258   5.546  10.275
  786    HB3  ASN  96           HB1      ASN  96   0.544   5.589  11.846
  787   HD21  ASN  96          HD21      ASN  96   2.577   6.401  11.023
  788   HD22  ASN  96          HD22      ASN  96   3.584   5.468  10.025
  789    H    THR  97           HN       THR  97   2.208   3.016  11.397
  790    HA   THR  97           HA       THR  97   2.204   1.230  13.633
  791    HB   THR  97           HB       THR  97   4.693   1.584  13.555
  792    HG1  THR  97           HG1      THR  97   4.656   3.759  12.932
  793   HG21  THR  97          HG21      THR  97   4.971   0.568  11.384
  794   HG22  THR  97          HG22      THR  97   3.448   1.251  10.815
  795   HG23  THR  97          HG23      THR  97   3.442  -0.011  12.046
  796    H    VAL  98           HN       VAL  98   2.634   4.725  13.381
  797    HA   VAL  98           HA       VAL  98   2.165   5.011  16.229
  798    HB   VAL  98           HB       VAL  98   4.615   4.398  16.089
  799   HG11  VAL  98          HG11      VAL  98   4.813   5.780  13.867
  800   HG12  VAL  98          HG12      VAL  98   6.174   5.748  14.986
  801   HG13  VAL  98          HG13      VAL  98   5.100   7.144  14.948
  802   HG21  VAL  98          HG21      VAL  98   4.408   7.258  17.023
  803   HG22  VAL  98          HG22      VAL  98   5.233   5.900  17.778
  804   HG23  VAL  98          HG23      VAL  98   3.479   6.004  17.839
  805    H    MET  99           HN       MET  99   0.929   5.918  13.813
  806    HA   MET  99           HA       MET  99   0.759   8.753  14.430
  807    HB2  MET  99           HB2      MET  99   2.749   8.795  12.980
  808    HB3  MET  99           HB1      MET  99   1.874   7.907  11.733
  809    HG2  MET  99           HG2      MET  99   0.473   9.726  11.236
  810    HG3  MET  99           HG1      MET  99   0.775  10.509  12.787
  811    HE1  MET  99           HE1      MET  99   2.131  12.568  12.893
  812    HE2  MET  99           HE2      MET  99   3.843  12.490  12.484
  813    HE3  MET  99           HE3      MET  99   3.138  11.262  13.532
  814    HA   PRO 100           HA       PRO 100  -3.045   6.618  12.777
  815    HB2  PRO 100           HB2      PRO 100  -4.332   8.348  14.830
  816    HB3  PRO 100           HB1      PRO 100  -4.505   6.603  14.563
  817    HG2  PRO 100           HG2      PRO 100  -3.145   7.608  16.657
  818    HG3  PRO 100           HG1      PRO 100  -2.685   6.087  15.870
  819    HD2  PRO 100           HD2      PRO 100  -1.405   8.791  15.633
  820    HD3  PRO 100           HD1      PRO 100  -0.650   7.180  15.624
  821    H    LEU 101           HN       LEU 101  -4.502   7.526  11.300
  822    HA   LEU 101           HA       LEU 101  -4.401  10.509  10.939
  823    HB2  LEU 101           HB2      LEU 101  -4.604   8.377   8.791
  824    HB3  LEU 101           HB1      LEU 101  -4.511  10.117   8.529
  825    HG   LEU 101           HG       LEU 101  -2.372   8.433   9.865
  826   HD11  LEU 101          HD11      LEU 101  -2.751   8.102   7.364
  827   HD12  LEU 101          HD12      LEU 101  -1.130   8.621   7.829
  828   HD13  LEU 101          HD13      LEU 101  -2.271   9.787   7.159
  829   HD21  LEU 101          HD21      LEU 101  -2.079  10.586  10.752
  830   HD22  LEU 101          HD22      LEU 101  -2.673  11.381   9.296
  831   HD23  LEU 101          HD23      LEU 101  -1.066  10.658   9.315
  832    H    LEU 102           HN       LEU 102  -6.283   7.989   9.288
  833    HA   LEU 102           HA       LEU 102  -8.742   9.519   9.873
  834    HB2  LEU 102           HB2      LEU 102  -7.924   8.185   7.639
  835    HB3  LEU 102           HB1      LEU 102  -8.887   6.922   8.392
  836    HG   LEU 102           HG       LEU 102  -9.855   9.745   7.831
  837   HD11  LEU 102          HD11      LEU 102  -9.503   8.414   5.773
  838   HD12  LEU 102          HD12      LEU 102 -11.218   8.689   6.076
  839   HD13  LEU 102          HD13      LEU 102 -10.499   7.123   6.446
  840   HD21  LEU 102          HD21      LEU 102 -12.070   8.768   8.411
  841   HD22  LEU 102          HD22      LEU 102 -10.948   8.723   9.771
  842   HD23  LEU 102          HD23      LEU 102 -11.269   7.258   8.841
  843    H    ASP 103           HN       ASP 103  -7.426   8.254  12.091
  844    HA   ASP 103           HA       ASP 103  -8.930   5.808  12.696
  845    HB2  ASP 103           HB2      ASP 103  -6.600   6.116  13.461
  846    HB3  ASP 103           HB1      ASP 103  -7.106   7.503  14.425
  847    H    GLN 104           HN       GLN 104 -11.118   6.373  12.846
  848    HA   GLN 104           HA       GLN 104 -11.833   8.329  15.008
  849    HB2  GLN 104           HB2      GLN 104 -13.227   7.747  12.380
  850    HB3  GLN 104           HB1      GLN 104 -13.983   8.640  13.702
  851    HG2  GLN 104           HG2      GLN 104 -12.171  10.295  13.651
  852    HG3  GLN 104           HG1      GLN 104 -11.366   9.393  12.365
  853   HE21  GLN 104          HE21      GLN 104 -11.811  11.816  11.464
  854   HE22  GLN 104          HE22      GLN 104 -13.223  11.958  10.532
  855    H    ARG 105           HN       ARG 105 -12.557   7.255  16.710
  856    HA   ARG 105           HA       ARG 105 -13.441   4.519  16.681
  857    HB2  ARG 105           HB2      ARG 105 -13.680   6.736  18.729
  858    HB3  ARG 105           HB1      ARG 105 -14.173   5.073  19.043
  859    HG2  ARG 105           HG2      ARG 105 -11.901   4.282  18.611
  860    HG3  ARG 105           HG1      ARG 105 -11.390   5.911  18.170
  861    HD2  ARG 105           HD2      ARG 105 -10.720   5.451  20.476
  862    HD3  ARG 105           HD1      ARG 105 -11.982   6.683  20.469
  863    HE   ARG 105           HE       ARG 105 -13.179   4.092  20.722
  864   HH11  ARG 105          HH21      ARG 105 -11.252   6.398  22.422
  865   HH12  ARG 105          HH22      ARG 105 -11.858   5.946  23.981
  866   HH21  ARG 105          HH11      ARG 105 -13.973   3.495  22.741
  867   HH22  ARG 105          HH12      ARG 105 -13.398   4.303  24.162
  868    H    TYR 106           HN       TYR 106 -15.132   7.626  16.612
  869    HA   TYR 106           HA       TYR 106 -17.761   6.687  17.133
  870    HB2  TYR 106           HB2      TYR 106 -16.951   8.926  15.256
  871    HB3  TYR 106           HB1      TYR 106 -18.515   8.736  16.049
  872    HD1  TYR 106           HD1      TYR 106 -18.655   8.862  18.564
  873    HD2  TYR 106           HD2      TYR 106 -15.092   9.889  16.396
  874    HE1  TYR 106           HE1      TYR 106 -17.786  10.050  20.558
  875    HE2  TYR 106           HE2      TYR 106 -14.222  11.079  18.388
  876    HH   TYR 106           HH       TYR 106 -15.637  12.237  20.605
  877    H    LEU 107           HN       LEU 107 -16.025   7.051  14.035
  878    HA   LEU 107           HA       LEU 107 -18.179   6.111  12.408
  879    HB2  LEU 107           HB2      LEU 107 -16.208   7.297  11.487
  880    HB3  LEU 107           HB1      LEU 107 -15.187   5.929  11.922
  881    HG   LEU 107           HG       LEU 107 -16.495   4.469  10.425
  882   HD11  LEU 107          HD11      LEU 107 -18.148   6.957  10.141
  883   HD12  LEU 107          HD12      LEU 107 -18.664   5.277  10.282
  884   HD13  LEU 107          HD13      LEU 107 -18.014   5.871   8.758
  885   HD21  LEU 107          HD21      LEU 107 -14.565   5.432   9.408
  886   HD22  LEU 107          HD22      LEU 107 -15.339   7.011   9.259
  887   HD23  LEU 107          HD23      LEU 107 -15.867   5.670   8.242
  888    H    LEU 108           HN       LEU 108 -15.426   4.422  13.913
  889    HA   LEU 108           HA       LEU 108 -16.175   1.858  12.810
  890    HB2  LEU 108           HB2      LEU 108 -13.875   2.725  13.819
  891    HB3  LEU 108           HB1      LEU 108 -14.532   2.092  15.322
  892    HG   LEU 108           HG       LEU 108 -13.227   0.345  14.271
  893   HD11  LEU 108          HD11      LEU 108 -14.840  -1.403  14.282
  894   HD12  LEU 108          HD12      LEU 108 -16.117  -0.336  13.707
  895   HD13  LEU 108          HD13      LEU 108 -15.491  -0.162  15.349
  896   HD21  LEU 108          HD21      LEU 108 -14.959   0.075  11.859
  897   HD22  LEU 108          HD22      LEU 108 -13.219  -0.136  12.028
  898   HD23  LEU 108          HD23      LEU 108 -13.896   1.480  11.860
  899    H    THR 109           HN       THR 109 -16.111   2.828  16.251
  900    HA   THR 109           HA       THR 109 -18.034   0.743  16.903
  901    HB   THR 109           HB       THR 109 -17.322   2.993  18.777
  902    HG1  THR 109           HG1      THR 109 -15.644   0.839  18.006
  903   HG21  THR 109          HG21      THR 109 -17.504  -0.002  19.191
  904   HG22  THR 109          HG22      THR 109 -18.862   1.100  19.414
  905   HG23  THR 109          HG23      THR 109 -17.432   1.244  20.437
  906    H    GLY 110           HN       GLY 110 -18.753   2.996  15.042
  907    HA2  GLY 110           HA2      GLY 110 -20.562   4.795  16.282
  908    HA3  GLY 110           HA1      GLY 110 -20.598   4.342  14.583
  909    H    GLY 111           HN       GLY 111 -22.829   4.798  16.435
  910    HA2  GLY 111           HA2      GLY 111 -25.015   3.883  16.437
  911    HA3  GLY 111           HA1      GLY 111 -24.361   2.370  15.819
  912    H    GLN 112           HN       GLN 112 -24.878   4.291  18.732
  913    HA   GLN 112           HA       GLN 112 -23.731   2.427  20.585
  914    HB2  GLN 112           HB2      GLN 112 -25.843   4.572  20.899
  915    HB3  GLN 112           HB1      GLN 112 -25.218   3.633  22.257
  916    HG2  GLN 112           HG2      GLN 112 -22.928   4.381  21.731
  917    HG3  GLN 112           HG1      GLN 112 -23.543   5.311  20.365
  918   HE21  GLN 112          HE21      GLN 112 -23.350   7.474  21.017
  919   HE22  GLN 112          HE22      GLN 112 -23.944   8.091  22.483
  920    H    LEU 113           HN       LEU 113 -24.590   0.429  19.590
  921    HA   LEU 113           HA       LEU 113 -27.380  -0.203  19.573
  922    HB2  LEU 113           HB2      LEU 113 -25.747  -1.541  18.326
  923    HB3  LEU 113           HB1      LEU 113 -24.945  -1.999  19.827
  924    HG   LEU 113           HG       LEU 113 -26.938  -3.204  20.573
  925   HD11  LEU 113          HD11      LEU 113 -28.137  -1.964  18.102
  926   HD12  LEU 113          HD12      LEU 113 -28.794  -2.041  19.738
  927   HD13  LEU 113          HD13      LEU 113 -28.779  -3.482  18.728
  928   HD21  LEU 113          HD21      LEU 113 -26.191  -3.885  17.710
  929   HD22  LEU 113          HD22      LEU 113 -26.967  -4.982  18.852
  930   HD23  LEU 113          HD23      LEU 113 -25.326  -4.412  19.153
  931    H    GLU 114           HN       GLU 114 -24.828  -0.663  21.991
  932    HA   GLU 114           HA       GLU 114 -24.943  -1.407  24.214
  933    HB2  GLU 114           HB2      GLU 114 -27.338   0.431  23.991
  934    HB3  GLU 114           HB1      GLU 114 -26.725  -0.196  25.525
  935    HG2  GLU 114           HG2      GLU 114 -24.536   0.806  25.096
  936    HG3  GLU 114           HG1      GLU 114 -25.086   1.379  23.522
  937    H    HIS 115           HN       HIS 115 -25.343  -3.634  23.847
  938    HA   HIS 115           HA       HIS 115 -28.204  -4.509  23.940
  939    HB2  HIS 115           HB2      HIS 115 -26.730  -5.331  22.070
  940    HB3  HIS 115           HB1      HIS 115 -25.750  -6.158  23.282
  941    HD1  HIS 115           HD1      HIS 115 -26.807  -8.188  24.504
  942    HD2  HIS 115           HD2      HIS 115 -29.301  -6.478  21.637
  943    HE1  HIS 115           HE1      HIS 115 -28.725  -9.806  24.168
  944    H    HIS 116           HN       HIS 116 -28.802  -4.766  26.037
  945    HA   HIS 116           HA       HIS 116 -27.529  -6.793  27.645
  946    HB2  HIS 116           HB2      HIS 116 -25.899  -5.038  28.105
  947    HB3  HIS 116           HB1      HIS 116 -27.188  -3.900  28.500
  948    HD1  HIS 116           HD1      HIS 116 -25.816  -7.242  29.716
  949    HD2  HIS 116           HD2      HIS 116 -27.974  -3.981  31.160
  950    HE1  HIS 116           HE1      HIS 116 -26.113  -7.624  32.202
  951    H    HIS 117           HN       HIS 117 -29.268  -7.717  28.541
  952    HA   HIS 117           HA       HIS 117 -31.132  -6.273  30.201
  953    HB2  HIS 117           HB2      HIS 117 -33.146  -7.064  28.683
  954    HB3  HIS 117           HB1      HIS 117 -32.330  -5.546  28.318
  955    HD1  HIS 117           HD1      HIS 117 -31.620  -9.204  27.430
  956    HD2  HIS 117           HD2      HIS 117 -31.834  -5.454  25.622
  957    HE1  HIS 117           HE1      HIS 117 -31.084  -9.558  24.978
  958    H    HIS 118           HN       HIS 118 -30.421  -9.159  28.283
  959    HA   HIS 118           HA       HIS 118 -32.052 -10.941  29.855
  960    HB2  HIS 118           HB2      HIS 118 -30.827 -12.736  28.704
  961    HB3  HIS 118           HB1      HIS 118 -31.345 -11.495  27.565
  962    HD1  HIS 118           HD1      HIS 118 -29.458  -9.737  26.817
  963    HD2  HIS 118           HD2      HIS 118 -28.064 -13.129  28.801
  964    HE1  HIS 118           HE1      HIS 118 -26.971  -9.865  26.356
  965    H    HIS 119           HN       HIS 119 -31.441 -12.351  31.527
  966    HA   HIS 119           HA       HIS 119 -28.676 -12.186  32.579
  967    HB2  HIS 119           HB2      HIS 119 -29.551 -11.701  34.877
  968    HB3  HIS 119           HB1      HIS 119 -29.796 -10.366  33.751
  969    HD1  HIS 119           HD1      HIS 119 -31.583 -12.419  36.124
  970    HD2  HIS 119           HD2      HIS 119 -32.580 -10.486  32.568
  971    HE1  HIS 119           HE1      HIS 119 -34.109 -12.236  36.093
  972    H    HIS 120           HN       HIS 120 -28.053 -14.156  33.320
  973    HA   HIS 120           HA       HIS 120 -29.953 -16.374  33.233
  974    HB2  HIS 120           HB2      HIS 120 -27.981 -17.758  33.731
  975    HB3  HIS 120           HB1      HIS 120 -27.625 -16.620  32.432
  976    HD1  HIS 120           HD1      HIS 120 -25.962 -14.701  32.934
  977    HD2  HIS 120           HD2      HIS 120 -26.645 -17.197  36.204
  978    HE1  HIS 120           HE1      HIS 120 -24.194 -14.128  34.657
  Start of MODEL   13
    1    H1   MET   1           HT1      MET   1  -9.933  -2.941  22.515
    2    H2   MET   1           HT2      MET   1  -8.895  -4.148  21.923
    3    H3   MET   1           HT3      MET   1 -10.572  -4.415  21.974
    4    HA   MET   1           HA       MET   1 -10.311  -2.123  20.500
    5    HB2  MET   1           HB2      MET   1  -8.186  -4.172  19.813
    6    HB3  MET   1           HB1      MET   1  -8.722  -2.911  18.705
    7    HG2  MET   1           HG2      MET   1  -8.070  -1.187  20.347
    8    HG3  MET   1           HG1      MET   1  -7.524  -2.449  21.453
    9    HE1  MET   1           HE1      MET   1  -5.250  -1.640  21.759
   10    HE2  MET   1           HE2      MET   1  -5.531  -0.210  20.769
   11    HE3  MET   1           HE3      MET   1  -4.094  -1.192  20.498
   12    H    THR   2           HN       THR   2 -10.055  -5.670  20.158
   13    HA   THR   2           HA       THR   2 -11.251  -7.135  18.746
   14    HB   THR   2           HB       THR   2 -13.726  -6.895  19.086
   15    HG1  THR   2           HG1      THR   2 -13.305  -4.943  20.978
   16   HG21  THR   2          HG21      THR   2 -12.515  -8.215  20.668
   17   HG22  THR   2          HG22      THR   2 -13.548  -7.146  21.618
   18   HG23  THR   2          HG23      THR   2 -11.831  -6.783  21.436
   19    H    LEU   3           HN       LEU   3 -10.242  -4.795  17.412
   20    HA   LEU   3           HA       LEU   3 -12.154  -3.584  15.673
   21    HB2  LEU   3           HB2      LEU   3  -9.173  -4.005  15.570
   22    HB3  LEU   3           HB1      LEU   3 -10.003  -3.319  14.177
   23    HG   LEU   3           HG       LEU   3 -10.490  -2.164  16.928
   24   HD11  LEU   3          HD11      LEU   3  -8.645  -0.607  16.627
   25   HD12  LEU   3          HD12      LEU   3  -8.233  -1.338  15.078
   26   HD13  LEU   3          HD13      LEU   3  -8.013  -2.251  16.572
   27   HD21  LEU   3          HD21      LEU   3 -10.745  -0.077  15.509
   28   HD22  LEU   3          HD22      LEU   3 -11.934  -1.333  15.173
   29   HD23  LEU   3          HD23      LEU   3 -10.568  -1.097  14.084
   30    H    GLU   4           HN       GLU   4 -10.194  -6.532  15.341
   31    HA   GLU   4           HA       GLU   4 -10.843  -7.108  12.636
   32    HB2  GLU   4           HB2      GLU   4  -9.107  -8.306  13.967
   33    HB3  GLU   4           HB1      GLU   4 -10.390  -9.090  14.888
   34    HG2  GLU   4           HG2      GLU   4 -11.261 -10.120  12.837
   35    HG3  GLU   4           HG1      GLU   4 -10.019  -9.303  11.886
   36    H    LEU   5           HN       LEU   5 -12.409  -8.368  15.606
   37    HA   LEU   5           HA       LEU   5 -14.547  -9.672  14.213
   38    HB2  LEU   5           HB2      LEU   5 -14.357  -8.611  17.046
   39    HB3  LEU   5           HB1      LEU   5 -15.693  -9.598  16.460
   40    HG   LEU   5           HG       LEU   5 -12.791 -10.460  16.316
   41   HD11  LEU   5          HD11      LEU   5 -13.256 -10.275  18.640
   42   HD12  LEU   5          HD12      LEU   5 -13.511 -11.977  18.256
   43   HD13  LEU   5          HD13      LEU   5 -14.894 -10.899  18.443
   44   HD21  LEU   5          HD21      LEU   5 -13.954 -11.813  14.792
   45   HD22  LEU   5          HD22      LEU   5 -15.448 -11.768  15.727
   46   HD23  LEU   5          HD23      LEU   5 -14.097 -12.761  16.269
   47    H    GLN   6           HN       GLN   6 -14.261  -6.441  15.651
   48    HA   GLN   6           HA       GLN   6 -16.964  -5.637  15.153
   49    HB2  GLN   6           HB2      GLN   6 -15.337  -4.469  16.684
   50    HB3  GLN   6           HB1      GLN   6 -14.505  -3.861  15.253
   51    HG2  GLN   6           HG2      GLN   6 -16.047  -2.153  16.001
   52    HG3  GLN   6           HG1      GLN   6 -16.686  -2.843  14.510
   53   HE21  GLN   6          HE21      GLN   6 -18.941  -2.636  14.897
   54   HE22  GLN   6          HE22      GLN   6 -19.737  -3.357  16.212
   55    H    LEU   7           HN       LEU   7 -14.040  -5.579  13.177
   56    HA   LEU   7           HA       LEU   7 -14.993  -3.893  11.085
   57    HB2  LEU   7           HB2      LEU   7 -12.632  -4.558  11.292
   58    HB3  LEU   7           HB1      LEU   7 -13.065  -6.233  10.962
   59    HG   LEU   7           HG       LEU   7 -13.858  -5.607   8.717
   60   HD11  LEU   7          HD11      LEU   7 -14.668  -3.419   8.831
   61   HD12  LEU   7          HD12      LEU   7 -13.129  -3.173   8.012
   62   HD13  LEU   7          HD13      LEU   7 -13.272  -2.836   9.735
   63   HD21  LEU   7          HD21      LEU   7 -11.558  -4.687   7.879
   64   HD22  LEU   7          HD22      LEU   7 -11.608  -6.261   8.669
   65   HD23  LEU   7          HD23      LEU   7 -11.069  -4.842   9.567
   66    H    LYS   8           HN       LYS   8 -15.154  -7.433  11.487
   67    HA   LYS   8           HA       LYS   8 -16.454  -7.973   9.004
   68    HB2  LYS   8           HB2      LYS   8 -16.551  -9.434  11.661
   69    HB3  LYS   8           HB1      LYS   8 -17.232 -10.072  10.164
   70    HG2  LYS   8           HG2      LYS   8 -15.022  -9.953   9.091
   71    HG3  LYS   8           HG1      LYS   8 -14.333  -9.287  10.572
   72    HD2  LYS   8           HD2      LYS   8 -14.892 -11.327  11.793
   73    HD3  LYS   8           HD1      LYS   8 -15.685 -11.992  10.364
   74    HE2  LYS   8           HE2      LYS   8 -13.413 -12.907  10.593
   75    HE3  LYS   8           HE1      LYS   8 -13.535 -11.913   9.142
   76    HZ1  LYS   8           HZ1      LYS   8 -11.696 -11.631  11.137
   77    HZ2  LYS   8           HZ2      LYS   8 -12.812 -10.388  11.447
   78    HZ3  LYS   8           HZ3      LYS   8 -12.046 -10.488   9.934
   79    H    HIS   9           HN       HIS   9 -17.702  -7.168  12.215
   80    HA   HIS   9           HA       HIS   9 -20.478  -7.473  11.553
   81    HB2  HIS   9           HB2      HIS   9 -19.078  -5.837  13.683
   82    HB3  HIS   9           HB1      HIS   9 -20.829  -6.033  13.590
   83    HD1  HIS   9           HD1      HIS   9 -19.955  -7.188  16.076
   84    HD2  HIS   9           HD2      HIS   9 -19.501  -9.357  12.546
   85    HE1  HIS   9           HE1      HIS   9 -19.698  -9.614  16.754
   86    H    TYR  10           HN       TYR  10 -18.226  -4.749  11.314
   87    HA   TYR  10           HA       TYR  10 -20.121  -2.695  10.809
   88    HB2  TYR  10           HB2      TYR  10 -17.761  -2.196  11.229
   89    HB3  TYR  10           HB1      TYR  10 -17.300  -3.013   9.734
   90    HD1  TYR  10           HD2      TYR  10 -19.441  -0.238  11.034
   91    HD2  TYR  10           HD1      TYR  10 -17.229  -1.804   7.703
   92    HE1  TYR  10           HE2      TYR  10 -19.844   1.862   9.779
   93    HE2  TYR  10           HE1      TYR  10 -17.633   0.293   6.446
   94    HH   TYR  10           HH       TYR  10 -18.244   2.968   7.489
   95    H    ILE  11           HN       ILE  11 -18.406  -4.821   8.502
   96    HA   ILE  11           HA       ILE  11 -19.624  -3.724   6.153
   97    HB   ILE  11           HB       ILE  11 -18.339  -6.398   6.797
   98   HG12  ILE  11          HG12      ILE  11 -16.776  -5.448   4.909
   99   HG13  ILE  11          HG11      ILE  11 -17.549  -3.908   5.264
  100   HG21  ILE  11          HG21      ILE  11 -18.418  -6.701   4.209
  101   HG22  ILE  11          HG22      ILE  11 -19.767  -5.564   4.273
  102   HG23  ILE  11          HG23      ILE  11 -19.861  -7.094   5.145
  103   HD11  ILE  11          HD11      ILE  11 -16.876  -4.108   7.628
  104   HD12  ILE  11          HD12      ILE  11 -15.471  -4.207   6.572
  105   HD13  ILE  11          HD13      ILE  11 -16.139  -5.672   7.289
  106    H    THR  12           HN       THR  12 -20.535  -6.502   8.199
  107    HA   THR  12           HA       THR  12 -22.772  -7.359   6.681
  108    HB   THR  12           HB       THR  12 -23.588  -8.296   8.868
  109    HG1  THR  12           HG1      THR  12 -22.634  -6.446  10.037
  110   HG21  THR  12          HG21      THR  12 -20.701  -8.634   8.045
  111   HG22  THR  12          HG22      THR  12 -22.076  -9.655   7.622
  112   HG23  THR  12          HG23      THR  12 -21.456  -9.647   9.273
  113    H    ASN  13           HN       ASN  13 -22.614  -5.035   9.376
  114    HA   ASN  13           HA       ASN  13 -25.403  -4.384   9.338
  115    HB2  ASN  13           HB2      ASN  13 -22.973  -2.869  10.321
  116    HB3  ASN  13           HB1      ASN  13 -24.624  -2.301  10.553
  117   HD21  ASN  13          HD21      ASN  13 -25.813  -4.946  10.987
  118   HD22  ASN  13          HD22      ASN  13 -25.257  -5.499  12.491
  119    H    LEU  14           HN       LEU  14 -22.598  -3.016   7.656
  120    HA   LEU  14           HA       LEU  14 -23.863  -0.698   6.606
  121    HB2  LEU  14           HB2      LEU  14 -21.344  -1.602   6.525
  122    HB3  LEU  14           HB1      LEU  14 -21.841  -2.198   4.949
  123    HG   LEU  14           HG       LEU  14 -20.892  -0.003   4.637
  124   HD11  LEU  14          HD11      LEU  14 -23.083  -0.656   3.456
  125   HD12  LEU  14          HD12      LEU  14 -22.658   1.054   3.461
  126   HD13  LEU  14          HD13      LEU  14 -23.879   0.450   4.577
  127   HD21  LEU  14          HD21      LEU  14 -21.664   0.565   7.193
  128   HD22  LEU  14          HD22      LEU  14 -22.924   1.420   6.306
  129   HD23  LEU  14          HD23      LEU  14 -21.228   1.802   6.019
  130    H    PHE  15           HN       PHE  15 -23.509  -3.950   5.181
  131    HA   PHE  15           HA       PHE  15 -25.502  -3.225   3.076
  132    HB2  PHE  15           HB2      PHE  15 -23.512  -5.495   3.337
  133    HB3  PHE  15           HB1      PHE  15 -24.729  -5.414   2.060
  134    HD1  PHE  15           HD2      PHE  15 -24.710  -3.521   0.434
  135    HD2  PHE  15           HD1      PHE  15 -21.568  -4.096   3.305
  136    HE1  PHE  15           HE2      PHE  15 -23.251  -1.985  -0.856
  137    HE2  PHE  15           HE1      PHE  15 -20.109  -2.560   2.016
  138    HZ   PHE  15           HZ       PHE  15 -20.951  -1.504  -0.064
  139    H    ASN  16           HN       ASN  16 -25.603  -4.316   6.106
  140    HA   ASN  16           HA       ASN  16 -27.079  -5.643   7.345
  141    HB2  ASN  16           HB2      ASN  16 -28.720  -5.098   4.860
  142    HB3  ASN  16           HB1      ASN  16 -29.366  -5.927   6.275
  143   HD21  ASN  16          HD21      ASN  16 -30.337  -3.344   5.372
  144   HD22  ASN  16          HD22      ASN  16 -29.967  -2.208   6.579
  145    H    LEU  17           HN       LEU  17 -25.104  -7.024   5.745
  146    HA   LEU  17           HA       LEU  17 -26.493  -9.366   4.619
  147    HB2  LEU  17           HB2      LEU  17 -23.544  -8.758   4.980
  148    HB3  LEU  17           HB1      LEU  17 -24.180 -10.147   4.111
  149    HG   LEU  17           HG       LEU  17 -24.948  -7.313   3.395
  150   HD11  LEU  17          HD11      LEU  17 -23.218  -7.359   1.670
  151   HD12  LEU  17          HD12      LEU  17 -22.722  -8.974   2.175
  152   HD13  LEU  17          HD13      LEU  17 -22.472  -7.598   3.251
  153   HD21  LEU  17          HD21      LEU  17 -25.183 -10.016   2.060
  154   HD22  LEU  17          HD22      LEU  17 -25.261  -8.527   1.122
  155   HD23  LEU  17          HD23      LEU  17 -26.452  -8.836   2.380
  156    HA   PRO  18           HA       PRO  18 -26.413 -11.668   8.399
  157    HB2  PRO  18           HB2      PRO  18 -26.134 -14.248   7.456
  158    HB3  PRO  18           HB1      PRO  18 -27.651 -13.331   7.383
  159    HG2  PRO  18           HG2      PRO  18 -25.608 -13.775   5.249
  160    HG3  PRO  18           HG1      PRO  18 -27.379 -13.798   5.138
  161    HD2  PRO  18           HD2      PRO  18 -25.919 -11.653   4.335
  162    HD3  PRO  18           HD1      PRO  18 -27.538 -11.472   5.043
  163    H    ARG  19           HN       ARG  19 -24.922 -12.340   9.894
  164    HA   ARG  19           HA       ARG  19 -22.088 -12.540   9.017
  165    HB2  ARG  19           HB2      ARG  19 -21.595 -12.325  11.441
  166    HB3  ARG  19           HB1      ARG  19 -22.589 -10.991  10.859
  167    HG2  ARG  19           HG2      ARG  19 -24.615 -12.163  11.682
  168    HG3  ARG  19           HG1      ARG  19 -23.597 -13.455  12.314
  169    HD2  ARG  19           HD2      ARG  19 -22.424 -11.803  13.748
  170    HD3  ARG  19           HD1      ARG  19 -23.504 -10.542  13.151
  171    HE   ARG  19           HE       ARG  19 -24.195 -12.624  15.089
  172   HH11  ARG  19          HH21      ARG  19 -25.265 -10.402  12.679
  173   HH12  ARG  19          HH22      ARG  19 -26.875 -10.287  13.306
  174   HH21  ARG  19          HH11      ARG  19 -26.294 -12.478  15.929
  175   HH22  ARG  19          HH12      ARG  19 -27.458 -11.462  15.146
  176    H    ASP  20           HN       ASP  20 -24.604 -14.585   9.369
  177    HA   ASP  20           HA       ASP  20 -23.285 -16.730  10.866
  178    HB2  ASP  20           HB2      ASP  20 -25.284 -18.056  10.159
  179    HB3  ASP  20           HB1      ASP  20 -25.719 -16.547  10.961
  180    H    GLU  21           HN       GLU  21 -22.767 -15.471   7.879
  181    HA   GLU  21           HA       GLU  21 -22.470 -18.017   6.418
  182    HB2  GLU  21           HB2      GLU  21 -21.890 -15.132   5.693
  183    HB3  GLU  21           HB1      GLU  21 -21.572 -16.490   4.610
  184    HG2  GLU  21           HG2      GLU  21 -23.925 -17.127   4.649
  185    HG3  GLU  21           HG1      GLU  21 -24.276 -15.867   5.831
  186    H    LYS  22           HN       LYS  22 -20.504 -19.001   5.985
  187    HA   LYS  22           HA       LYS  22 -18.281 -18.296   7.747
  188    HB2  LYS  22           HB2      LYS  22 -18.644 -20.455   5.652
  189    HB3  LYS  22           HB1      LYS  22 -17.195 -20.291   6.648
  190    HG2  LYS  22           HG2      LYS  22 -18.561 -20.508   8.686
  191    HG3  LYS  22           HG1      LYS  22 -20.015 -20.659   7.700
  192    HD2  LYS  22           HD2      LYS  22 -19.158 -22.711   6.686
  193    HD3  LYS  22           HD1      LYS  22 -17.644 -22.544   7.576
  194    HE2  LYS  22           HE2      LYS  22 -18.917 -24.086   8.853
  195    HE3  LYS  22           HE1      LYS  22 -19.096 -22.553   9.705
  196    HZ1  LYS  22           HZ1      LYS  22 -21.148 -22.277   8.202
  197    HZ2  LYS  22           HZ2      LYS  22 -21.252 -23.312   9.546
  198    HZ3  LYS  22           HZ3      LYS  22 -21.035 -23.956   7.988
  199    H    TRP  23           HN       TRP  23 -16.351 -17.355   7.154
  200    HA   TRP  23           HA       TRP  23 -16.195 -16.261   4.377
  201    HB2  TRP  23           HB2      TRP  23 -15.137 -15.342   7.045
  202    HB3  TRP  23           HB1      TRP  23 -14.361 -14.797   5.558
  203    HD1  TRP  23           HD1      TRP  23 -16.479 -14.067   3.635
  204    HE1  TRP  23           HE1      TRP  23 -18.317 -12.324   4.101
  205    HE3  TRP  23           HE3      TRP  23 -16.402 -14.047   8.741
  206    HZ2  TRP  23           HZ2      TRP  23 -19.587 -11.081   6.340
  207    HZ3  TRP  23           HZ3      TRP  23 -17.935 -12.573  10.014
  208    HH2  TRP  23           HH2      TRP  23 -19.526 -11.089   8.819
  209    H    GLU  24           HN       GLU  24 -14.179 -16.307   3.273
  210    HA   GLU  24           HA       GLU  24 -12.426 -18.604   4.070
  211    HB2  GLU  24           HB2      GLU  24 -12.998 -17.352   1.363
  212    HB3  GLU  24           HB1      GLU  24 -11.821 -18.637   1.635
  213    HG2  GLU  24           HG2      GLU  24 -14.768 -18.840   2.326
  214    HG3  GLU  24           HG1      GLU  24 -14.044 -19.495   0.856
  215    H    CYS  25           HN       CYS  25 -10.541 -17.951   4.917
  216    HA   CYS  25           HA       CYS  25  -9.579 -15.211   4.546
  217    HB2  CYS  25           HB2      CYS  25  -7.922 -15.772   6.189
  218    HB3  CYS  25           HB1      CYS  25  -9.426 -16.535   6.710
  219    HG   CYS  25           HG       CYS  25  -6.966 -18.057   6.282
  220    H    GLU  26           HN       GLU  26  -7.732 -14.596   3.443
  221    HA   GLU  26           HA       GLU  26  -6.260 -16.678   1.870
  222    HB2  GLU  26           HB2      GLU  26  -7.941 -15.573   0.409
  223    HB3  GLU  26           HB1      GLU  26  -7.254 -14.004   0.828
  224    HG2  GLU  26           HG2      GLU  26  -5.108 -14.646  -0.158
  225    HG3  GLU  26           HG1      GLU  26  -5.734 -16.257  -0.519
  226    H    SER  27           HN       SER  27  -4.303 -16.540   2.925
  227    HA   SER  27           HA       SER  27  -3.254 -13.889   3.729
  228    HB2  SER  27           HB2      SER  27  -2.943 -15.620   5.361
  229    HB3  SER  27           HB1      SER  27  -2.287 -16.726   4.156
  230    HG   SER  27           HG       SER  27  -1.045 -14.811   5.607
  231    H    ILE  28           HN       ILE  28  -2.352 -12.776   2.057
  232    HA   ILE  28           HA       ILE  28  -0.246 -14.163   0.447
  233    HB   ILE  28           HB       ILE  28  -0.994 -12.742  -1.511
  234   HG12  ILE  28          HG12      ILE  28  -3.528 -12.454   0.128
  235   HG13  ILE  28          HG11      ILE  28  -2.338 -11.166  -0.055
  236   HG21  ILE  28          HG21      ILE  28  -2.793 -14.870  -0.335
  237   HG22  ILE  28          HG22      ILE  28  -1.534 -15.071  -1.551
  238   HG23  ILE  28          HG23      ILE  28  -3.026 -14.227  -1.961
  239   HD11  ILE  28          HD11      ILE  28  -4.137 -10.890  -1.702
  240   HD12  ILE  28          HD12      ILE  28  -3.852 -12.522  -2.307
  241   HD13  ILE  28          HD13      ILE  28  -2.622 -11.276  -2.518
  242    H    GLU  29           HN       GLU  29   1.433 -12.733  -0.293
  243    HA   GLU  29           HA       GLU  29   1.811 -10.407   1.513
  244    HB2  GLU  29           HB2      GLU  29   3.676 -11.899  -0.353
  245    HB3  GLU  29           HB1      GLU  29   4.156 -10.484   0.585
  246    HG2  GLU  29           HG2      GLU  29   3.595 -11.639   2.669
  247    HG3  GLU  29           HG1      GLU  29   3.025 -13.039   1.761
  248    H    GLU  30           HN       GLU  30   1.564  -8.340   0.776
  249    HA   GLU  30           HA       GLU  30   1.896  -7.804  -2.134
  250    HB2  GLU  30           HB2      GLU  30  -0.539  -8.254  -1.701
  251    HB3  GLU  30           HB1      GLU  30  -0.547  -6.899  -0.575
  252    HG2  GLU  30           HG2      GLU  30  -1.338  -6.075  -2.700
  253    HG3  GLU  30           HG1      GLU  30   0.287  -5.434  -2.464
  254    H    VAL  31           HN       VAL  31   2.610  -5.741  -2.567
  255    HA   VAL  31           HA       VAL  31   3.843  -4.304  -0.362
  256    HB   VAL  31           HB       VAL  31   3.598  -3.449  -3.256
  257   HG11  VAL  31          HG11      VAL  31   5.748  -2.873  -1.199
  258   HG12  VAL  31          HG12      VAL  31   4.404  -1.782  -1.531
  259   HG13  VAL  31          HG13      VAL  31   5.576  -2.146  -2.796
  260   HG21  VAL  31          HG21      VAL  31   4.514  -5.693  -3.217
  261   HG22  VAL  31          HG22      VAL  31   5.591  -5.275  -1.884
  262   HG23  VAL  31          HG23      VAL  31   5.847  -4.568  -3.478
  263    H    ALA  32           HN       ALA  32   3.161  -2.422   0.578
  264    HA   ALA  32           HA       ALA  32   0.469  -1.682   0.670
  265    HB1  ALA  32           HB1      ALA  32   1.292   0.525   1.539
  266    HB2  ALA  32           HB2      ALA  32   2.926   0.055   1.067
  267    HB3  ALA  32           HB3      ALA  32   2.071  -0.856   2.311
  268    H    ASP  33           HN       ASP  33   2.838  -0.933  -1.756
  269    HA   ASP  33           HA       ASP  33   1.692   1.399  -2.903
  270    HB2  ASP  33           HB2      ASP  33   3.916   0.527  -3.529
  271    HB3  ASP  33           HB1      ASP  33   3.153  -0.875  -4.280
  272    H    ASP  34           HN       ASP  34   1.178  -2.031  -3.764
  273    HA   ASP  34           HA       ASP  34  -0.885  -1.431  -5.699
  274    HB2  ASP  34           HB2      ASP  34   0.551  -3.546  -5.562
  275    HB3  ASP  34           HB1      ASP  34  -0.521  -4.063  -4.260
  276    H    ILE  35           HN       ILE  35  -0.899  -2.247  -2.262
  277    HA   ILE  35           HA       ILE  35  -3.748  -2.663  -2.094
  278    HB   ILE  35           HB       ILE  35  -1.899  -1.821   0.152
  279   HG12  ILE  35          HG12      ILE  35  -2.430  -4.624  -0.894
  280   HG13  ILE  35          HG11      ILE  35  -0.926  -3.733  -1.126
  281   HG21  ILE  35          HG21      ILE  35  -4.476  -1.974   0.397
  282   HG22  ILE  35          HG22      ILE  35  -3.486  -2.828   1.575
  283   HG23  ILE  35          HG23      ILE  35  -4.246  -3.716   0.256
  284   HD11  ILE  35          HD11      ILE  35  -0.438  -5.008   0.774
  285   HD12  ILE  35          HD12      ILE  35  -2.075  -4.868   1.408
  286   HD13  ILE  35          HD13      ILE  35  -0.976  -3.493   1.495
  287    H    LEU  36           HN       LEU  36  -1.982  -0.120  -0.341
  288    HA   LEU  36           HA       LEU  36  -4.280   1.619  -0.357
  289    HB2  LEU  36           HB2      LEU  36  -1.437   2.454   0.245
  290    HB3  LEU  36           HB1      LEU  36  -2.923   3.112   0.923
  291    HG   LEU  36           HG       LEU  36  -1.816   0.330   1.403
  292   HD11  LEU  36          HD11      LEU  36  -2.121   2.774   3.171
  293   HD12  LEU  36          HD12      LEU  36  -0.609   2.030   2.651
  294   HD13  LEU  36          HD13      LEU  36  -1.678   1.172   3.761
  295   HD21  LEU  36          HD21      LEU  36  -4.405   1.676   2.202
  296   HD22  LEU  36          HD22      LEU  36  -3.743   0.322   3.118
  297   HD23  LEU  36          HD23      LEU  36  -4.185   0.109   1.426
  298    HA   PRO  37           HA       PRO  37  -3.624   3.656  -4.256
  299    HB2  PRO  37           HB2      PRO  37  -4.605   6.177  -3.708
  300    HB3  PRO  37           HB1      PRO  37  -5.641   4.760  -3.971
  301    HG2  PRO  37           HG2      PRO  37  -4.750   5.993  -1.401
  302    HG3  PRO  37           HG1      PRO  37  -6.353   5.392  -1.861
  303    HD2  PRO  37           HD2      PRO  37  -4.692   3.929  -0.310
  304    HD3  PRO  37           HD1      PRO  37  -5.767   3.158  -1.495
  305    H    ASP  38           HN       ASP  38  -2.163   5.095  -5.290
  306    HA   ASP  38           HA       ASP  38   0.309   5.573  -4.075
  307    HB2  ASP  38           HB2      ASP  38  -1.040   7.001  -6.376
  308    HB3  ASP  38           HB1      ASP  38   0.638   7.294  -5.913
  309    H    GLN  39           HN       GLN  39  -2.613   7.173  -3.477
  310    HA   GLN  39           HA       GLN  39  -1.442   9.750  -2.715
  311    HB2  GLN  39           HB2      GLN  39  -4.191   8.540  -2.333
  312    HB3  GLN  39           HB1      GLN  39  -3.757  10.164  -1.795
  313    HG2  GLN  39           HG2      GLN  39  -3.149  10.774  -4.102
  314    HG3  GLN  39           HG1      GLN  39  -3.562   9.148  -4.645
  315   HE21  GLN  39          HE21      GLN  39  -5.495   9.399  -5.801
  316   HE22  GLN  39          HE22      GLN  39  -6.866  10.214  -5.218
  317    H    TYR  40           HN       TYR  40  -2.399   6.757  -1.112
  318    HA   TYR  40           HA       TYR  40  -1.623   7.914   1.539
  319    HB2  TYR  40           HB2      TYR  40  -3.347   5.592   0.685
  320    HB3  TYR  40           HB1      TYR  40  -2.665   5.633   2.311
  321    HD1  TYR  40           HD1      TYR  40  -4.459   7.897  -0.097
  322    HD2  TYR  40           HD2      TYR  40  -3.901   6.698   3.990
  323    HE1  TYR  40           HE1      TYR  40  -6.245   9.466   0.607
  324    HE2  TYR  40           HE2      TYR  40  -5.685   8.269   4.693
  325    HH   TYR  40           HH       TYR  40  -6.667  10.698   3.252
  326    H    VAL  41           HN       VAL  41  -0.031   6.540  -0.884
  327    HA   VAL  41           HA       VAL  41   1.436   4.498   0.717
  328    HB   VAL  41           HB       VAL  41   1.613   5.324  -2.193
  329   HG11  VAL  41          HG11      VAL  41   3.049   3.204  -2.322
  330   HG12  VAL  41          HG12      VAL  41   3.183   3.325  -0.570
  331   HG13  VAL  41          HG13      VAL  41   3.804   4.620  -1.591
  332   HG21  VAL  41          HG21      VAL  41  -0.384   3.927  -1.235
  333   HG22  VAL  41          HG22      VAL  41   0.796   2.624  -1.119
  334   HG23  VAL  41          HG23      VAL  41   0.432   3.348  -2.686
  335    H    ARG  42           HN       ARG  42   2.313   7.216  -1.442
  336    HA   ARG  42           HA       ARG  42   4.965   7.471  -0.386
  337    HB2  ARG  42           HB2      ARG  42   3.185   9.402  -1.898
  338    HB3  ARG  42           HB1      ARG  42   4.860   9.761  -1.479
  339    HG2  ARG  42           HG2      ARG  42   5.614   7.773  -2.709
  340    HG3  ARG  42           HG1      ARG  42   3.942   7.371  -3.103
  341    HD2  ARG  42           HD2      ARG  42   3.709   9.496  -4.328
  342    HD3  ARG  42           HD1      ARG  42   5.372   9.915  -3.924
  343    HE   ARG  42           HE       ARG  42   6.139   8.316  -5.517
  344   HH11  ARG  42          HH21      ARG  42   2.722   8.188  -5.009
  345   HH12  ARG  42          HH22      ARG  42   2.425   7.191  -6.391
  346   HH21  ARG  42          HH11      ARG  42   5.757   7.011  -7.319
  347   HH22  ARG  42          HH12      ARG  42   4.138   6.524  -7.696
  348    H    LEU  43           HN       LEU  43   1.909   9.134   0.368
  349    HA   LEU  43           HA       LEU  43   3.016  10.985   2.252
  350    HB2  LEU  43           HB2      LEU  43   0.748  11.195   1.272
  351    HB3  LEU  43           HB1      LEU  43   0.227   9.783   2.183
  352    HG   LEU  43           HG       LEU  43   1.450  12.183   3.567
  353   HD11  LEU  43          HD11      LEU  43  -0.802  13.075   3.927
  354   HD12  LEU  43          HD12      LEU  43  -1.496  11.761   2.978
  355   HD13  LEU  43          HD13      LEU  43  -0.466  12.963   2.199
  356   HD21  LEU  43          HD21      LEU  43  -0.460  11.113   5.256
  357   HD22  LEU  43          HD22      LEU  43   1.242  10.687   5.288
  358   HD23  LEU  43          HD23      LEU  43   0.102   9.667   4.422
  359    H    GLY  44           HN       GLY  44   1.610   7.733   2.673
  360    HA2  GLY  44           HA2      GLY  44   2.072   7.763   5.540
  361    HA3  GLY  44           HA1      GLY  44   1.558   6.365   4.600
  362    HA   PRO  45           HA       PRO  45   6.301   6.418   5.563
  363    HB2  PRO  45           HB2      PRO  45   6.354   4.876   7.847
  364    HB3  PRO  45           HB1      PRO  45   6.278   6.649   7.872
  365    HG2  PRO  45           HG2      PRO  45   4.066   4.662   8.191
  366    HG3  PRO  45           HG1      PRO  45   4.377   6.155   9.098
  367    HD2  PRO  45           HD2      PRO  45   2.521   6.046   7.120
  368    HD3  PRO  45           HD1      PRO  45   3.472   7.516   7.434
  369    H    LEU  46           HN       LEU  46   3.701   4.236   5.307
  370    HA   LEU  46           HA       LEU  46   5.050   1.721   5.233
  371    HB2  LEU  46           HB2      LEU  46   2.573   2.658   3.745
  372    HB3  LEU  46           HB1      LEU  46   3.063   0.975   3.939
  373    HG   LEU  46           HG       LEU  46   2.461   2.876   6.224
  374   HD11  LEU  46          HD11      LEU  46   0.821   0.679   4.934
  375   HD12  LEU  46          HD12      LEU  46   0.416   2.393   5.039
  376   HD13  LEU  46          HD13      LEU  46   0.432   1.401   6.497
  377   HD21  LEU  46          HD21      LEU  46   3.866   1.289   7.189
  378   HD22  LEU  46          HD22      LEU  46   3.404   0.024   6.053
  379   HD23  LEU  46          HD23      LEU  46   2.317   0.470   7.367
  380    H    SER  47           HN       SER  47   4.389   4.152   2.714
  381    HA   SER  47           HA       SER  47   5.106   4.245   0.468
  382    HB2  SER  47           HB2      SER  47   7.576   3.410   1.998
  383    HB3  SER  47           HB1      SER  47   7.616   3.885   0.302
  384    HG   SER  47           HG       SER  47   7.259   5.398   2.580
  385    H    ASN  48           HN       ASN  48   7.606   2.096   0.301
  386    HA   ASN  48           HA       ASN  48   5.926   0.102  -1.135
  387    HB2  ASN  48           HB2      ASN  48   8.925   0.550  -1.066
  388    HB3  ASN  48           HB1      ASN  48   8.112  -0.675  -2.039
  389   HD21  ASN  48          HD21      ASN  48   5.795   1.361  -2.416
  390   HD22  ASN  48          HD22      ASN  48   6.370   2.395  -3.630
  391    H    LYS  49           HN       LYS  49   6.003   0.149   1.803
  392    HA   LYS  49           HA       LYS  49   7.783  -1.950   2.678
  393    HB2  LYS  49           HB2      LYS  49   6.914  -0.233   4.236
  394    HB3  LYS  49           HB1      LYS  49   5.283  -0.850   3.999
  395    HG2  LYS  49           HG2      LYS  49   6.180  -1.758   6.075
  396    HG3  LYS  49           HG1      LYS  49   6.035  -3.065   4.905
  397    HD2  LYS  49           HD2      LYS  49   8.377  -3.108   4.497
  398    HD3  LYS  49           HD1      LYS  49   8.617  -1.528   5.243
  399    HE2  LYS  49           HE2      LYS  49   8.003  -2.493   7.433
  400    HE3  LYS  49           HE1      LYS  49   7.769  -4.063   6.666
  401    HZ1  LYS  49           HZ1      LYS  49  10.285  -3.027   5.940
  402    HZ2  LYS  49           HZ2      LYS  49   9.929  -4.450   6.796
  403    HZ3  LYS  49           HZ3      LYS  49  10.141  -2.985   7.630
  404    H    ILE  50           HN       ILE  50   7.355  -4.132   2.941
  405    HA   ILE  50           HA       ILE  50   5.088  -5.213   1.411
  406    HB   ILE  50           HB       ILE  50   7.399  -6.504   2.893
  407   HG12  ILE  50          HG12      ILE  50   8.111  -7.094   0.574
  408   HG13  ILE  50          HG11      ILE  50   6.749  -6.170  -0.055
  409   HG21  ILE  50          HG21      ILE  50   5.646  -8.104   3.002
  410   HG22  ILE  50          HG22      ILE  50   6.603  -8.572   1.597
  411   HG23  ILE  50          HG23      ILE  50   5.079  -7.712   1.380
  412   HD11  ILE  50          HD11      ILE  50   7.686  -4.128   0.524
  413   HD12  ILE  50          HD12      ILE  50   9.144  -5.054   0.178
  414   HD13  ILE  50          HD13      ILE  50   8.632  -4.810   1.847
  415    H    LEU  51           HN       LEU  51   3.166  -5.579   2.384
  416    HA   LEU  51           HA       LEU  51   3.119  -6.153   5.334
  417    HB2  LEU  51           HB2      LEU  51   1.013  -4.748   3.664
  418    HB3  LEU  51           HB1      LEU  51   0.961  -5.015   5.407
  419    HG   LEU  51           HG       LEU  51   3.065  -3.392   3.945
  420   HD11  LEU  51          HD11      LEU  51   0.780  -2.366   4.032
  421   HD12  LEU  51          HD12      LEU  51   1.993  -1.449   4.921
  422   HD13  LEU  51          HD13      LEU  51   0.847  -2.466   5.792
  423   HD21  LEU  51          HD21      LEU  51   2.687  -4.219   6.821
  424   HD22  LEU  51          HD22      LEU  51   3.447  -2.669   6.460
  425   HD23  LEU  51          HD23      LEU  51   4.167  -4.162   5.864
  426    H    GLN  52           HN       GLN  52   1.938  -7.893   6.003
  427    HA   GLN  52           HA       GLN  52   1.195  -9.878   4.031
  428    HB2  GLN  52           HB2      GLN  52   1.993 -10.410   6.353
  429    HB3  GLN  52           HB1      GLN  52   0.483  -9.751   6.980
  430    HG2  GLN  52           HG2      GLN  52   0.257 -12.161   6.812
  431    HG3  GLN  52           HG1      GLN  52  -0.761 -11.418   5.578
  432   HE21  GLN  52          HE21      GLN  52  -0.648 -13.082   3.988
  433   HE22  GLN  52          HE22      GLN  52   0.798 -13.557   3.240
  434    H    THR  53           HN       THR  53  -0.637  -9.673   2.821
  435    HA   THR  53           HA       THR  53  -2.917  -8.093   3.910
  436    HB   THR  53           HB       THR  53  -2.354  -9.140   1.119
  437    HG1  THR  53           HG1      THR  53  -1.484  -7.032   2.463
  438   HG21  THR  53          HG21      THR  53  -4.611  -7.478   2.259
  439   HG22  THR  53          HG22      THR  53  -4.730  -8.998   1.371
  440   HG23  THR  53          HG23      THR  53  -4.234  -7.526   0.537
  441    H    ASN  54           HN       ASN  54  -4.452  -9.228   4.926
  442    HA   ASN  54           HA       ASN  54  -4.996 -12.052   4.081
  443    HB2  ASN  54           HB2      ASN  54  -5.366 -10.584   6.699
  444    HB3  ASN  54           HB1      ASN  54  -6.166 -12.120   6.366
  445   HD21  ASN  54          HD21      ASN  54  -4.705 -14.009   5.864
  446   HD22  ASN  54          HD22      ASN  54  -3.128 -14.024   6.490
  447    H    THR  55           HN       THR  55  -6.539 -11.794   2.496
  448    HA   THR  55           HA       THR  55  -8.788  -9.914   2.968
  449    HB   THR  55           HB       THR  55  -8.093 -11.568   0.528
  450    HG1  THR  55           HG1      THR  55  -7.580  -9.347  -0.205
  451   HG21  THR  55          HG21      THR  55 -10.447 -11.055   0.541
  452   HG22  THR  55          HG22      THR  55  -9.673  -9.926  -0.568
  453   HG23  THR  55          HG23      THR  55 -10.138  -9.396   1.049
  454    H    TYR  56           HN       TYR  56 -10.736 -10.606   3.608
  455    HA   TYR  56           HA       TYR  56 -11.297 -13.552   3.603
  456    HB2  TYR  56           HB2      TYR  56 -12.528 -11.374   5.324
  457    HB3  TYR  56           HB1      TYR  56 -12.743 -13.117   5.507
  458    HD1  TYR  56           HD1      TYR  56 -10.322 -10.334   5.754
  459    HD2  TYR  56           HD2      TYR  56 -11.047 -14.493   6.548
  460    HE1  TYR  56           HE1      TYR  56  -8.267 -10.427   7.133
  461    HE2  TYR  56           HE2      TYR  56  -8.988 -14.584   7.932
  462    HH   TYR  56           HH       TYR  56  -7.490 -13.193   9.093
  463    H    TYR  57           HN       TYR  57 -12.745 -14.095   2.015
  464    HA   TYR  57           HA       TYR  57 -15.009 -12.223   1.465
  465    HB2  TYR  57           HB2      TYR  57 -14.698 -12.470  -0.952
  466    HB3  TYR  57           HB1      TYR  57 -13.241 -11.790  -0.231
  467    HD1  TYR  57           HD1      TYR  57 -11.230 -13.212   0.123
  468    HD2  TYR  57           HD2      TYR  57 -14.706 -14.668  -1.936
  469    HE1  TYR  57           HE1      TYR  57  -9.898 -15.093  -0.792
  470    HE2  TYR  57           HE2      TYR  57 -13.375 -16.551  -2.849
  471    HH   TYR  57           HH       TYR  57 -10.635 -17.605  -1.673
  472    H    SER  58           HN       SER  58 -16.847 -13.257   0.565
  473    HA   SER  58           HA       SER  58 -16.821 -16.238   0.499
  474    HB2  SER  58           HB2      SER  58 -17.680 -15.873   2.664
  475    HB3  SER  58           HB1      SER  58 -18.577 -14.445   2.170
  476    HG   SER  58           HG       SER  58 -20.067 -15.705   1.215
  477    H    ASP  59           HN       ASP  59 -19.277 -16.842  -0.179
  478    HA   ASP  59           HA       ASP  59 -19.568 -15.937  -2.873
  479    HB2  ASP  59           HB2      ASP  59 -20.401 -18.123  -1.916
  480    HB3  ASP  59           HB1      ASP  59 -21.703 -17.220  -1.144
  481    H    THR  60           HN       THR  60 -21.367 -15.109   0.095
  482    HA   THR  60           HA       THR  60 -23.228 -13.323  -1.155
  483    HB   THR  60           HB       THR  60 -22.183 -13.127   1.686
  484    HG1  THR  60           HG1      THR  60 -22.885 -15.274   0.945
  485   HG21  THR  60          HG21      THR  60 -24.388 -12.227   2.161
  486   HG22  THR  60          HG22      THR  60 -24.912 -12.540   0.505
  487   HG23  THR  60          HG23      THR  60 -23.686 -11.314   0.825
  488    H    LEU  61           HN       LEU  61 -20.103 -12.690   0.470
  489    HA   LEU  61           HA       LEU  61 -20.146  -9.854   0.115
  490    HB2  LEU  61           HB2      LEU  61 -17.979 -11.899   0.539
  491    HB3  LEU  61           HB1      LEU  61 -17.533 -10.235   0.177
  492    HG   LEU  61           HG       LEU  61 -18.800  -9.437   2.105
  493   HD11  LEU  61          HD11      LEU  61 -19.712 -11.233   3.690
  494   HD12  LEU  61          HD12      LEU  61 -19.581 -12.348   2.331
  495   HD13  LEU  61          HD13      LEU  61 -20.642 -10.945   2.221
  496   HD21  LEU  61          HD21      LEU  61 -16.494 -10.109   2.520
  497   HD22  LEU  61          HD22      LEU  61 -16.987 -11.790   2.724
  498   HD23  LEU  61          HD23      LEU  61 -17.482 -10.576   3.904
  499    H    HIS  62           HN       HIS  62 -18.884 -12.469  -1.944
  500    HA   HIS  62           HA       HIS  62 -17.724 -10.812  -3.949
  501    HB2  HIS  62           HB2      HIS  62 -17.384 -13.276  -3.799
  502    HB3  HIS  62           HB1      HIS  62 -19.058 -13.517  -4.302
  503    HD1  HIS  62           HD1      HIS  62 -15.930 -11.748  -5.593
  504    HD2  HIS  62           HD2      HIS  62 -19.340 -13.657  -7.044
  505    HE1  HIS  62           HE1      HIS  62 -15.695 -11.816  -8.113
  506    H    LYS  63           HN       LYS  63 -21.017 -12.067  -3.546
  507    HA   LYS  63           HA       LYS  63 -22.096 -11.069  -5.994
  508    HB2  LYS  63           HB2      LYS  63 -23.237 -12.703  -4.477
  509    HB3  LYS  63           HB1      LYS  63 -23.517 -11.391  -3.332
  510    HG2  LYS  63           HG2      LYS  63 -24.824 -10.174  -4.987
  511    HG3  LYS  63           HG1      LYS  63 -24.481 -11.404  -6.203
  512    HD2  LYS  63           HD2      LYS  63 -25.633 -13.091  -4.805
  513    HD3  LYS  63           HD1      LYS  63 -26.006 -11.839  -3.620
  514    HE2  LYS  63           HE2      LYS  63 -26.856 -11.720  -6.526
  515    HE3  LYS  63           HE1      LYS  63 -27.890 -12.303  -5.221
  516    HZ1  LYS  63           HZ1      LYS  63 -28.153 -10.239  -4.375
  517    HZ2  LYS  63           HZ2      LYS  63 -27.853  -9.782  -5.983
  518    HZ3  LYS  63           HZ3      LYS  63 -26.605  -9.717  -4.832
  519    H    SER  64           HN       SER  64 -21.870  -9.627  -2.752
  520    HA   SER  64           HA       SER  64 -23.111  -7.127  -3.586
  521    HB2  SER  64           HB2      SER  64 -21.476  -7.806  -1.123
  522    HB3  SER  64           HB1      SER  64 -22.388  -6.316  -1.355
  523    HG   SER  64           HG       SER  64 -24.270  -7.533  -1.446
  524    H    ASN  65           HN       ASN  65 -20.246  -8.492  -4.366
  525    HA   ASN  65           HA       ASN  65 -18.230  -7.695  -5.226
  526    HB2  ASN  65           HB2      ASN  65 -19.913  -5.189  -5.497
  527    HB3  ASN  65           HB1      ASN  65 -18.274  -5.332  -6.122
  528   HD21  ASN  65          HD21      ASN  65 -20.583  -4.955  -7.828
  529   HD22  ASN  65          HD22      ASN  65 -20.750  -6.349  -8.781
  530    H    ILE  66           HN       ILE  66 -18.574  -7.690  -2.379
  531    HA   ILE  66           HA       ILE  66 -16.922  -5.315  -1.567
  532    HB   ILE  66           HB       ILE  66 -18.582  -7.141   0.195
  533   HG12  ILE  66          HG12      ILE  66 -20.095  -5.936  -1.252
  534   HG13  ILE  66          HG11      ILE  66 -20.132  -5.158   0.326
  535   HG21  ILE  66          HG21      ILE  66 -17.091  -4.548   0.651
  536   HG22  ILE  66          HG22      ILE  66 -16.842  -6.096   1.459
  537   HG23  ILE  66          HG23      ILE  66 -18.303  -5.164   1.774
  538   HD11  ILE  66          HD11      ILE  66 -19.949  -3.338  -1.143
  539   HD12  ILE  66          HD12      ILE  66 -18.866  -4.200  -2.229
  540   HD13  ILE  66          HD13      ILE  66 -18.271  -3.610  -0.678
  541    H    TYR  67           HN       TYR  67 -14.872  -5.744  -0.997
  542    HA   TYR  67           HA       TYR  67 -14.113  -8.555  -0.271
  543    HB2  TYR  67           HB2      TYR  67 -12.536  -6.598  -1.966
  544    HB3  TYR  67           HB1      TYR  67 -12.039  -8.235  -1.536
  545    HD1  TYR  67           HD1      TYR  67 -14.558  -6.244  -3.411
  546    HD2  TYR  67           HD2      TYR  67 -12.916 -10.148  -2.684
  547    HE1  TYR  67           HE1      TYR  67 -15.826  -7.139  -5.345
  548    HE2  TYR  67           HE2      TYR  67 -14.185 -11.041  -4.619
  549    HH   TYR  67           HH       TYR  67 -16.616 -10.016  -5.853
  550    HA   PRO  68           HA       PRO  68 -12.596  -5.640   2.962
  551    HB2  PRO  68           HB2      PRO  68 -13.249  -7.104   5.152
  552    HB3  PRO  68           HB1      PRO  68 -14.433  -6.096   4.295
  553    HG2  PRO  68           HG2      PRO  68 -14.052  -9.047   4.214
  554    HG3  PRO  68           HG1      PRO  68 -15.545  -8.099   4.131
  555    HD2  PRO  68           HD2      PRO  68 -14.230  -9.213   1.922
  556    HD3  PRO  68           HD1      PRO  68 -15.422  -7.901   1.834
  557    H    PHE  69           HN       PHE  69 -10.595  -5.681   4.029
  558    HA   PHE  69           HA       PHE  69  -9.238  -8.250   4.485
  559    HB2  PHE  69           HB2      PHE  69  -7.317  -7.730   3.063
  560    HB3  PHE  69           HB1      PHE  69  -8.784  -7.742   2.083
  561    HD1  PHE  69           HD1      PHE  69  -9.771  -5.662   1.251
  562    HD2  PHE  69           HD2      PHE  69  -6.153  -5.645   3.567
  563    HE1  PHE  69           HE1      PHE  69  -9.344  -3.318   0.565
  564    HE2  PHE  69           HE2      PHE  69  -5.725  -3.300   2.881
  565    HZ   PHE  69           HZ       PHE  69  -7.321  -2.136   1.380
  566    H    ILE  70           HN       ILE  70  -7.138  -7.937   5.566
  567    HA   ILE  70           HA       ILE  70  -6.863  -5.293   6.935
  568    HB   ILE  70           HB       ILE  70  -6.869  -8.038   8.223
  569   HG12  ILE  70          HG12      ILE  70  -8.597  -5.610   8.782
  570   HG13  ILE  70          HG11      ILE  70  -9.087  -6.922   7.712
  571   HG21  ILE  70          HG21      ILE  70  -6.591  -6.537  10.334
  572   HG22  ILE  70          HG22      ILE  70  -5.982  -5.329   9.206
  573   HG23  ILE  70          HG23      ILE  70  -5.163  -6.879   9.361
  574   HD11  ILE  70          HD11      ILE  70  -8.291  -7.282  10.614
  575   HD12  ILE  70          HD12      ILE  70  -8.908  -8.532   9.534
  576   HD13  ILE  70          HD13      ILE  70  -9.955  -7.204  10.036
  577    H    LEU  71           HN       LEU  71  -4.718  -4.804   7.568
  578    HA   LEU  71           HA       LEU  71  -2.626  -6.438   6.184
  579    HB2  LEU  71           HB2      LEU  71  -2.405  -3.616   7.265
  580    HB3  LEU  71           HB1      LEU  71  -1.291  -4.430   6.169
  581    HG   LEU  71           HG       LEU  71  -4.137  -3.576   5.583
  582   HD11  LEU  71          HD11      LEU  71  -3.152  -2.069   4.019
  583   HD12  LEU  71          HD12      LEU  71  -1.577  -2.850   4.148
  584   HD13  LEU  71          HD13      LEU  71  -2.204  -1.903   5.497
  585   HD21  LEU  71          HD21      LEU  71  -2.243  -5.391   4.082
  586   HD22  LEU  71          HD22      LEU  71  -3.474  -4.460   3.230
  587   HD23  LEU  71          HD23      LEU  71  -3.951  -5.641   4.445
  588    H    TYR  72           HN       TYR  72  -1.146  -7.502   7.392
  589    HA   TYR  72           HA       TYR  72  -0.918  -6.827  10.306
  590    HB2  TYR  72           HB2      TYR  72  -0.971  -9.534   8.959
  591    HB3  TYR  72           HB1      TYR  72  -0.475  -9.285  10.632
  592    HD1  TYR  72           HD2      TYR  72  -2.125  -7.962  12.154
  593    HD2  TYR  72           HD1      TYR  72  -3.255  -9.841   8.462
  594    HE1  TYR  72           HE2      TYR  72  -4.496  -7.947  12.874
  595    HE2  TYR  72           HE1      TYR  72  -5.629  -9.827   9.182
  596    HH   TYR  72           HH       TYR  72  -6.554  -8.966  12.432
  597    H    TYR  73           HN       TYR  73   1.113  -6.384  10.956
  598    HA   TYR  73           HA       TYR  73   3.429  -7.759   9.899
  599    HB2  TYR  73           HB2      TYR  73   3.136  -6.278   7.996
  600    HB3  TYR  73           HB1      TYR  73   2.989  -4.880   9.055
  601    HD1  TYR  73           HD2      TYR  73   5.336  -7.631   8.104
  602    HD2  TYR  73           HD1      TYR  73   4.900  -3.679   9.732
  603    HE1  TYR  73           HE2      TYR  73   7.802  -7.355   8.100
  604    HE2  TYR  73           HE1      TYR  73   7.363  -3.404   9.726
  605    HH   TYR  73           HH       TYR  73   9.340  -4.577   8.224
  606    H    GLN  74           HN       GLN  74   4.560  -7.969  11.766
  607    HA   GLN  74           HA       GLN  74   5.494  -7.458  13.858
  608    HB2  GLN  74           HB2      GLN  74   5.621  -4.753  12.492
  609    HB3  GLN  74           HB1      GLN  74   6.389  -5.101  14.040
  610    HG2  GLN  74           HG2      GLN  74   7.699  -6.905  12.998
  611    HG3  GLN  74           HG1      GLN  74   6.920  -6.582  11.449
  612   HE21  GLN  74          HE21      GLN  74   6.977  -3.571  12.243
  613   HE22  GLN  74          HE22      GLN  74   8.566  -3.099  11.876
  614    H    LYS  75           HN       LYS  75   4.004  -4.285  13.428
  615    HA   LYS  75           HA       LYS  75   2.788  -4.347  16.035
  616    HB2  LYS  75           HB2      LYS  75   2.025  -2.550  13.719
  617    HB3  LYS  75           HB1      LYS  75   1.829  -2.220  15.439
  618    HG2  LYS  75           HG2      LYS  75   4.502  -2.586  14.049
  619    HG3  LYS  75           HG1      LYS  75   3.789  -1.027  14.451
  620    HD2  LYS  75           HD2      LYS  75   3.745  -1.760  16.869
  621    HD3  LYS  75           HD1      LYS  75   4.659  -3.188  16.390
  622    HE2  LYS  75           HE2      LYS  75   6.495  -1.841  15.592
  623    HE3  LYS  75           HE1      LYS  75   5.581  -0.358  15.869
  624    HZ1  LYS  75           HZ1      LYS  75   7.275  -1.253  17.634
  625    HZ2  LYS  75           HZ2      LYS  75   5.951  -2.205  18.112
  626    HZ3  LYS  75           HZ3      LYS  75   5.827  -0.510  18.113
  627    H    GLN  76           HN       GLN  76   2.036  -6.326  13.699
  628    HA   GLN  76           HA       GLN  76   0.138  -7.511  13.061
  629    HB2  GLN  76           HB2      GLN  76  -0.838  -6.403  15.711
  630    HB3  GLN  76           HB1      GLN  76  -1.657  -7.663  14.789
  631    HG2  GLN  76           HG2      GLN  76   0.357  -9.072  14.918
  632    HG3  GLN  76           HG1      GLN  76   1.174  -7.815  15.850
  633   HE21  GLN  76          HE21      GLN  76   1.128  -9.954  17.362
  634   HE22  GLN  76          HE22      GLN  76  -0.165 -10.001  18.461
  635    H    LEU  77           HN       LEU  77  -2.396  -5.970  14.474
  636    HA   LEU  77           HA       LEU  77  -3.580  -5.100  12.092
  637    HB2  LEU  77           HB2      LEU  77  -4.750  -5.481  14.276
  638    HB3  LEU  77           HB1      LEU  77  -4.071  -3.961  14.854
  639    HG   LEU  77           HG       LEU  77  -5.188  -2.781  12.952
  640   HD11  LEU  77          HD11      LEU  77  -6.076  -5.592  12.364
  641   HD12  LEU  77          HD12      LEU  77  -5.560  -4.326  11.250
  642   HD13  LEU  77          HD13      LEU  77  -7.161  -4.258  11.974
  643   HD21  LEU  77          HD21      LEU  77  -6.334  -2.699  15.028
  644   HD22  LEU  77          HD22      LEU  77  -6.826  -4.390  14.919
  645   HD23  LEU  77          HD23      LEU  77  -7.559  -3.188  13.856
  646    H    ILE  78           HN       ILE  78  -2.762  -3.593  10.753
  647    HA   ILE  78           HA       ILE  78  -1.603  -1.082  11.921
  648    HB   ILE  78           HB       ILE  78  -1.041  -2.579   9.365
  649   HG12  ILE  78          HG12      ILE  78   0.841  -1.497  11.471
  650   HG13  ILE  78          HG11      ILE  78   0.102  -3.093  11.605
  651   HG21  ILE  78          HG21      ILE  78   0.572  -0.612   8.951
  652   HG22  ILE  78          HG22      ILE  78  -0.410   0.287  10.109
  653   HG23  ILE  78          HG23      ILE  78  -1.134  -0.317   8.619
  654   HD11  ILE  78          HD11      ILE  78   1.811  -2.111   9.320
  655   HD12  ILE  78          HD12      ILE  78   1.032  -3.692   9.409
  656   HD13  ILE  78          HD13      ILE  78   2.296  -3.263  10.564
  657    H    ALA  79           HN       ALA  79  -3.587  -2.365   9.259
  658    HA   ALA  79           HA       ALA  79  -5.300   0.026   9.398
  659    HB1  ALA  79           HB1      ALA  79  -3.811  -0.707   6.858
  660    HB2  ALA  79           HB2      ALA  79  -3.454   0.690   7.871
  661    HB3  ALA  79           HB3      ALA  79  -4.999   0.584   7.027
  662    H    ILE  80           HN       ILE  80  -7.301  -0.297   8.291
  663    HA   ILE  80           HA       ILE  80  -7.789  -3.042   7.203
  664    HB   ILE  80           HB       ILE  80  -9.846  -3.209   8.467
  665   HG12  ILE  80          HG12      ILE  80  -9.164  -0.416   9.431
  666   HG13  ILE  80          HG11      ILE  80 -10.569  -0.892   8.479
  667   HG21  ILE  80          HG21      ILE  80  -8.961  -3.571  10.625
  668   HG22  ILE  80          HG22      ILE  80  -7.849  -2.208  10.497
  669   HG23  ILE  80          HG23      ILE  80  -7.546  -3.681   9.583
  670   HD11  ILE  80          HD11      ILE  80  -9.988  -1.451  11.377
  671   HD12  ILE  80          HD12      ILE  80 -11.089  -2.490  10.476
  672   HD13  ILE  80          HD13      ILE  80 -11.444  -0.771  10.652
  673    H    GLY  81           HN       GLY  81  -9.584  -3.076   5.666
  674    HA2  GLY  81           HA2      GLY  81 -11.105  -0.739   5.017
  675    HA3  GLY  81           HA1      GLY  81  -9.697  -0.817   3.958
  676    H    PHE  82           HN       PHE  82 -11.982  -0.996   2.626
  677    HA   PHE  82           HA       PHE  82 -12.003  -3.806   1.729
  678    HB2  PHE  82           HB2      PHE  82 -14.452  -3.983   1.843
  679    HB3  PHE  82           HB1      PHE  82 -13.790  -3.694   3.451
  680    HD1  PHE  82           HD2      PHE  82 -14.049  -1.529   4.559
  681    HD2  PHE  82           HD1      PHE  82 -15.711  -2.251   0.664
  682    HE1  PHE  82           HE2      PHE  82 -15.438   0.514   4.774
  683    HE2  PHE  82           HE1      PHE  82 -17.101  -0.207   0.880
  684    HZ   PHE  82           HZ       PHE  82 -16.964   1.175   2.936
  685    H    ILE  83           HN       ILE  83 -12.874  -4.057  -0.393
  686    HA   ILE  83           HA       ILE  83 -12.912  -1.506  -1.948
  687    HB   ILE  83           HB       ILE  83 -12.385  -4.356  -2.827
  688   HG12  ILE  83          HG12      ILE  83 -10.511  -1.977  -2.702
  689   HG13  ILE  83          HG11      ILE  83 -10.635  -3.174  -1.414
  690   HG21  ILE  83          HG21      ILE  83 -12.482  -1.729  -4.329
  691   HG22  ILE  83          HG22      ILE  83 -13.371  -3.210  -4.681
  692   HG23  ILE  83          HG23      ILE  83 -11.630  -3.142  -4.950
  693   HD11  ILE  83          HD11      ILE  83 -10.090  -3.966  -4.276
  694   HD12  ILE  83          HD12      ILE  83  -9.840  -4.918  -2.813
  695   HD13  ILE  83          HD13      ILE  83  -8.791  -3.543  -3.161
  696    H    ASP  84           HN       ASP  84 -14.837  -0.817  -2.618
  697    HA   ASP  84           HA       ASP  84 -17.141  -2.682  -2.596
  698    HB2  ASP  84           HB2      ASP  84 -17.267  -0.453  -1.454
  699    HB3  ASP  84           HB1      ASP  84 -17.113   0.315  -3.035
  700    H    GLU  85           HN       GLU  85 -18.639  -2.702  -4.407
  701    HA   GLU  85           HA       GLU  85 -19.034  -3.099  -6.688
  702    HB2  GLU  85           HB2      GLU  85 -17.566  -0.445  -6.838
  703    HB3  GLU  85           HB1      GLU  85 -18.524  -1.146  -8.143
  704    HG2  GLU  85           HG2      GLU  85 -19.597  -0.475  -5.388
  705    HG3  GLU  85           HG1      GLU  85 -19.807   0.534  -6.817
  706    H    ASN  86           HN       ASN  86 -16.273  -3.797  -5.428
  707    HA   ASN  86           HA       ASN  86 -14.301  -4.813  -6.177
  708    HB2  ASN  86           HB2      ASN  86 -16.113  -6.054  -7.512
  709    HB3  ASN  86           HB1      ASN  86 -15.659  -5.024  -8.867
  710   HD21  ASN  86          HD21      ASN  86 -13.900  -6.956  -6.363
  711   HD22  ASN  86          HD22      ASN  86 -12.801  -7.639  -7.461
  712    H    HIS  87           HN       HIS  87 -14.455  -1.940  -6.341
  713    HA   HIS  87           HA       HIS  87 -12.242  -1.493  -8.190
  714    HB2  HIS  87           HB2      HIS  87 -14.110  -1.236  -9.759
  715    HB3  HIS  87           HB1      HIS  87 -14.899  -0.102  -8.662
  716    HD1  HIS  87           HD1      HIS  87 -11.663  -0.426 -10.646
  717    HD2  HIS  87           HD2      HIS  87 -14.089   2.535  -8.995
  718    HE1  HIS  87           HE1      HIS  87 -10.694   1.792 -11.392
  719    H    ASP  88           HN       ASP  88 -14.795   0.402  -6.554
  720    HA   ASP  88           HA       ASP  88 -13.028   2.506  -5.747
  721    HB2  ASP  88           HB2      ASP  88 -15.466   2.798  -5.857
  722    HB3  ASP  88           HB1      ASP  88 -15.673   1.626  -4.554
  723    H    MET  89           HN       MET  89 -11.576   2.559  -4.104
  724    HA   MET  89           HA       MET  89 -11.587   0.326  -2.121
  725    HB2  MET  89           HB2      MET  89  -9.520   0.793  -3.514
  726    HB3  MET  89           HB1      MET  89  -9.380   2.322  -2.646
  727    HG2  MET  89           HG2      MET  89  -9.208   1.154  -0.519
  728    HG3  MET  89           HG1      MET  89  -9.502  -0.394  -1.303
  729    HE1  MET  89           HE1      MET  89  -7.501  -1.964  -1.756
  730    HE2  MET  89           HE2      MET  89  -6.433  -1.412  -3.044
  731    HE3  MET  89           HE3      MET  89  -8.178  -1.254  -3.229
  732    H    ASP  90           HN       ASP  90 -12.753   0.901  -0.347
  733    HA   ASP  90           HA       ASP  90 -12.548   3.708   0.672
  734    HB2  ASP  90           HB2      ASP  90 -14.578   1.511   1.154
  735    HB3  ASP  90           HB1      ASP  90 -14.567   3.040   2.036
  736    H    PHE  91           HN       PHE  91 -11.729   4.093   2.704
  737    HA   PHE  91           HA       PHE  91 -10.687   1.724   4.229
  738    HB2  PHE  91           HB2      PHE  91  -9.630   4.540   3.888
  739    HB3  PHE  91           HB1      PHE  91  -9.070   3.473   5.180
  740    HD1  PHE  91           HD1      PHE  91  -7.881   1.381   4.667
  741    HD2  PHE  91           HD2      PHE  91  -9.077   4.100   1.566
  742    HE1  PHE  91           HE1      PHE  91  -6.390   0.212   3.069
  743    HE2  PHE  91           HE2      PHE  91  -7.583   2.933  -0.032
  744    HZ   PHE  91           HZ       PHE  91  -6.243   0.987   0.720
  745    H    LEU  92           HN       LEU  92 -11.298   1.514   6.329
  746    HA   LEU  92           HA       LEU  92 -13.290   3.472   7.361
  747    HB2  LEU  92           HB2      LEU  92 -13.592   0.875   7.245
  748    HB3  LEU  92           HB1      LEU  92 -12.567   0.851   8.678
  749    HG   LEU  92           HG       LEU  92 -15.149   2.414   8.384
  750   HD11  LEU  92          HD11      LEU  92 -14.537  -0.001  10.105
  751   HD12  LEU  92          HD12      LEU  92 -15.358  -0.087   8.546
  752   HD13  LEU  92          HD13      LEU  92 -16.102   0.783   9.888
  753   HD21  LEU  92          HD21      LEU  92 -14.767   2.558  10.965
  754   HD22  LEU  92          HD22      LEU  92 -13.853   3.643   9.924
  755   HD23  LEU  92          HD23      LEU  92 -13.085   2.195  10.578
  756    H    TYR  93           HN       TYR  93 -10.732   1.483   8.876
  757    HA   TYR  93           HA       TYR  93  -9.987   3.854  10.564
  758    HB2  TYR  93           HB2      TYR  93 -11.042   2.064  11.867
  759    HB3  TYR  93           HB1      TYR  93  -9.897   0.896  11.217
  760    HD1  TYR  93           HD1      TYR  93  -9.940   4.208  12.978
  761    HD2  TYR  93           HD2      TYR  93  -7.956   0.436  12.447
  762    HE1  TYR  93           HE1      TYR  93  -8.339   4.797  14.777
  763    HE2  TYR  93           HE2      TYR  93  -6.357   1.024  14.245
  764    HH   TYR  93           HH       TYR  93  -5.666   2.606  15.643
  765    H    LEU  94           HN       LEU  94  -7.958   4.563  10.242
  766    HA   LEU  94           HA       LEU  94  -5.934   2.690   9.052
  767    HB2  LEU  94           HB2      LEU  94  -6.523   4.420   7.452
  768    HB3  LEU  94           HB1      LEU  94  -6.312   5.676   8.670
  769    HG   LEU  94           HG       LEU  94  -3.921   5.237   8.788
  770   HD11  LEU  94          HD11      LEU  94  -3.677   2.912   8.516
  771   HD12  LEU  94          HD12      LEU  94  -3.010   3.553   7.017
  772   HD13  LEU  94          HD13      LEU  94  -4.642   2.885   7.041
  773   HD21  LEU  94          HD21      LEU  94  -3.298   6.042   6.631
  774   HD22  LEU  94          HD22      LEU  94  -4.939   6.632   6.889
  775   HD23  LEU  94          HD23      LEU  94  -4.658   5.233   5.855
  776    H    HIS  95           HN       HIS  95  -4.281   2.267  10.392
  777    HA   HIS  95           HA       HIS  95  -3.483   4.311  12.429
  778    HB2  HIS  95           HB2      HIS  95  -4.675   2.495  13.564
  779    HB3  HIS  95           HB1      HIS  95  -3.630   1.305  12.791
  780    HD1  HIS  95           HD1      HIS  95  -1.298   3.796  13.371
  781    HD2  HIS  95           HD2      HIS  95  -3.355   1.286  15.986
  782    HE1  HIS  95           HE1      HIS  95   0.072   3.709  15.501
  783    H    ASN  96           HN       ASN  96  -1.615   5.057  11.534
  784    HA   ASN  96           HA       ASN  96   0.167   3.301  10.039
  785    HB2  ASN  96           HB2      ASN  96   0.517   6.159  10.992
  786    HB3  ASN  96           HB1      ASN  96   1.619   5.316   9.903
  787   HD21  ASN  96          HD21      ASN  96  -0.780   3.877   8.633
  788   HD22  ASN  96          HD22      ASN  96  -1.469   5.043   7.610
  789    H    THR  97           HN       THR  97   2.584   3.429  10.642
  790    HA   THR  97           HA       THR  97   2.944   2.091  13.146
  791    HB   THR  97           HB       THR  97   5.385   2.325  12.618
  792    HG1  THR  97           HG1      THR  97   4.694   3.474  10.178
  793   HG21  THR  97          HG21      THR  97   3.457   1.427  10.468
  794   HG22  THR  97          HG22      THR  97   4.292   0.433  11.663
  795   HG23  THR  97          HG23      THR  97   5.197   1.169  10.339
  796    H    VAL  98           HN       VAL  98   3.353   5.477  12.177
  797    HA   VAL  98           HA       VAL  98   4.510   6.142  14.824
  798    HB   VAL  98           HB       VAL  98   3.910   7.869  12.403
  799   HG11  VAL  98          HG11      VAL  98   5.258   8.493  15.049
  800   HG12  VAL  98          HG12      VAL  98   3.811   9.257  14.388
  801   HG13  VAL  98          HG13      VAL  98   5.377   9.525  13.625
  802   HG21  VAL  98          HG21      VAL  98   5.737   6.159  12.180
  803   HG22  VAL  98          HG22      VAL  98   6.541   6.900  13.563
  804   HG23  VAL  98          HG23      VAL  98   6.321   7.820  12.074
  805    H    MET  99           HN       MET  99   1.676   7.263  12.897
  806    HA   MET  99           HA       MET  99   0.077   7.333  15.350
  807    HB2  MET  99           HB2      MET  99  -0.461   9.766  15.127
  808    HB3  MET  99           HB1      MET  99   1.227   9.474  15.545
  809    HG2  MET  99           HG2      MET  99   1.851   9.709  13.161
  810    HG3  MET  99           HG1      MET  99   0.165  10.029  12.756
  811    HE1  MET  99           HE1      MET  99   0.933  13.610  12.292
  812    HE2  MET  99           HE2      MET  99  -0.053  12.209  11.884
  813    HE3  MET  99           HE3      MET  99   1.685  12.163  11.606
  814    HA   PRO 100           HA       PRO 100  -3.035   6.549  12.276
  815    HB2  PRO 100           HB2      PRO 100  -5.309   7.287  13.641
  816    HB3  PRO 100           HB1      PRO 100  -4.422   5.785  13.963
  817    HG2  PRO 100           HG2      PRO 100  -4.343   8.379  15.438
  818    HG3  PRO 100           HG1      PRO 100  -4.337   6.720  16.067
  819    HD2  PRO 100           HD2      PRO 100  -2.060   8.223  15.878
  820    HD3  PRO 100           HD1      PRO 100  -2.054   6.452  15.726
  821    H    LEU 101           HN       LEU 101  -4.247   7.601  10.680
  822    HA   LEU 101           HA       LEU 101  -4.114  10.595  10.731
  823    HB2  LEU 101           HB2      LEU 101  -4.446   8.740   8.356
  824    HB3  LEU 101           HB1      LEU 101  -4.155  10.479   8.308
  825    HG   LEU 101           HG       LEU 101  -2.261   8.401   9.448
  826   HD11  LEU 101          HD11      LEU 101  -2.284   9.995   6.877
  827   HD12  LEU 101          HD12      LEU 101  -2.228   8.242   7.063
  828   HD13  LEU 101          HD13      LEU 101  -0.830   9.221   7.503
  829   HD21  LEU 101          HD21      LEU 101  -1.814  10.345  10.691
  830   HD22  LEU 101          HD22      LEU 101  -2.227  11.418   9.353
  831   HD23  LEU 101          HD23      LEU 101  -0.709  10.520   9.331
  832    H    LEU 102           HN       LEU 102  -6.253   7.886   9.784
  833    HA   LEU 102           HA       LEU 102  -8.597   9.743  10.097
  834    HB2  LEU 102           HB2      LEU 102  -8.326   7.390   8.203
  835    HB3  LEU 102           HB1      LEU 102  -9.731   8.443   8.356
  836    HG   LEU 102           HG       LEU 102  -6.956   9.343   7.525
  837   HD11  LEU 102          HD11      LEU 102  -8.275   7.889   5.892
  838   HD12  LEU 102          HD12      LEU 102  -7.810   9.482   5.295
  839   HD13  LEU 102          HD13      LEU 102  -9.463   9.191   5.835
  840   HD21  LEU 102          HD21      LEU 102  -7.938  11.249   8.482
  841   HD22  LEU 102          HD22      LEU 102  -9.570  10.771   8.012
  842   HD23  LEU 102          HD23      LEU 102  -8.449  11.396   6.804
  843    H    ASP 103           HN       ASP 103 -10.308   8.984  11.287
  844    HA   ASP 103           HA       ASP 103 -10.654   6.198  11.972
  845    HB2  ASP 103           HB2      ASP 103 -10.189   6.438  14.401
  846    HB3  ASP 103           HB1      ASP 103  -8.736   6.668  13.428
  847    H    GLN 104           HN       GLN 104 -12.858   6.190  11.864
  848    HA   GLN 104           HA       GLN 104 -14.362   8.487  13.071
  849    HB2  GLN 104           HB2      GLN 104 -15.146   6.442  10.978
  850    HB3  GLN 104           HB1      GLN 104 -16.264   7.610  11.686
  851    HG2  GLN 104           HG2      GLN 104 -14.871   9.465  10.886
  852    HG3  GLN 104           HG1      GLN 104 -13.706   8.321  10.221
  853   HE21  GLN 104          HE21      GLN 104 -14.547   9.844   8.247
  854   HE22  GLN 104          HE22      GLN 104 -15.797   9.152   7.331
  855    H    ARG 105           HN       ARG 105 -15.073   8.058  15.059
  856    HA   ARG 105           HA       ARG 105 -15.231   5.435  16.205
  857    HB2  ARG 105           HB2      ARG 105 -16.416   8.089  17.065
  858    HB3  ARG 105           HB1      ARG 105 -16.485   6.625  18.046
  859    HG2  ARG 105           HG2      ARG 105 -14.031   6.486  18.046
  860    HG3  ARG 105           HG1      ARG 105 -13.942   7.928  17.032
  861    HD2  ARG 105           HD2      ARG 105 -15.092   9.226  18.805
  862    HD3  ARG 105           HD1      ARG 105 -15.117   7.788  19.825
  863    HE   ARG 105           HE       ARG 105 -12.759   9.445  19.218
  864   HH11  ARG 105          HH21      ARG 105 -14.055   6.467  20.388
  865   HH12  ARG 105          HH22      ARG 105 -12.652   6.073  21.321
  866   HH21  ARG 105          HH11      ARG 105 -10.925   8.941  20.429
  867   HH22  ARG 105          HH12      ARG 105 -10.879   7.470  21.343
  868    H    TYR 106           HN       TYR 106 -17.618   7.542  14.675
  869    HA   TYR 106           HA       TYR 106 -19.992   6.201  15.411
  870    HB2  TYR 106           HB2      TYR 106 -19.352   7.443  12.716
  871    HB3  TYR 106           HB1      TYR 106 -20.962   7.164  13.377
  872    HD1  TYR 106           HD1      TYR 106 -21.753   8.450  15.351
  873    HD2  TYR 106           HD2      TYR 106 -17.987   9.281  13.460
  874    HE1  TYR 106           HE1      TYR 106 -21.655  10.642  16.507
  875    HE2  TYR 106           HE2      TYR 106 -17.888  11.472  14.616
  876    HH   TYR 106           HH       TYR 106 -20.611  12.668  16.515
  877    H    LEU 107           HN       LEU 107 -17.889   5.611  12.590
  878    HA   LEU 107           HA       LEU 107 -19.394   3.399  11.574
  879    HB2  LEU 107           HB2      LEU 107 -16.572   4.386  11.204
  880    HB3  LEU 107           HB1      LEU 107 -17.065   2.849  10.496
  881    HG   LEU 107           HG       LEU 107 -18.856   3.928   9.258
  882   HD11  LEU 107          HD11      LEU 107 -19.632   5.609  10.741
  883   HD12  LEU 107          HD12      LEU 107 -18.957   6.496   9.375
  884   HD13  LEU 107          HD13      LEU 107 -18.037   6.346  10.870
  885   HD21  LEU 107          HD21      LEU 107 -17.445   5.648   7.950
  886   HD22  LEU 107          HD22      LEU 107 -16.812   4.007   8.048
  887   HD23  LEU 107          HD23      LEU 107 -16.150   5.270   9.085
  888    H    LEU 108           HN       LEU 108 -16.650   3.544  13.844
  889    HA   LEU 108           HA       LEU 108 -16.562   0.617  14.064
  890    HB2  LEU 108           HB2      LEU 108 -15.194   2.738  15.742
  891    HB3  LEU 108           HB1      LEU 108 -14.813   1.017  15.733
  892    HG   LEU 108           HG       LEU 108 -14.597   2.867  13.339
  893   HD11  LEU 108          HD11      LEU 108 -12.256   2.872  13.674
  894   HD12  LEU 108          HD12      LEU 108 -12.323   1.521  14.804
  895   HD13  LEU 108          HD13      LEU 108 -12.913   3.111  15.291
  896   HD21  LEU 108          HD21      LEU 108 -14.975   0.742  12.411
  897   HD22  LEU 108          HD22      LEU 108 -14.177  -0.094  13.744
  898   HD23  LEU 108          HD23      LEU 108 -13.218   0.765  12.538
  899    H    THR 109           HN       THR 109 -18.658   2.889  15.244
  900    HA   THR 109           HA       THR 109 -19.032   1.560  17.886
  901    HB   THR 109           HB       THR 109 -20.348   3.995  16.636
  902    HG1  THR 109           HG1      THR 109 -18.755   3.895  18.950
  903   HG21  THR 109          HG21      THR 109 -21.214   4.287  19.020
  904   HG22  THR 109          HG22      THR 109 -20.761   2.604  19.287
  905   HG23  THR 109          HG23      THR 109 -21.976   3.009  18.074
  906    H    GLY 110           HN       GLY 110 -20.201   1.497  14.672
  907    HA2  GLY 110           HA2      GLY 110 -21.846   0.154  13.677
  908    HA3  GLY 110           HA1      GLY 110 -22.019  -0.663  15.230
  909    H    GLY 111           HN       GLY 111 -24.329  -0.370  14.009
  910    HA2  GLY 111           HA2      GLY 111 -26.500   0.394  14.503
  911    HA3  GLY 111           HA1      GLY 111 -25.802   1.468  15.715
  912    H    GLN 112           HN       GLN 112 -27.841   2.378  14.076
  913    HA   GLN 112           HA       GLN 112 -26.608   3.954  11.893
  914    HB2  GLN 112           HB2      GLN 112 -28.934   4.670  11.439
  915    HB3  GLN 112           HB1      GLN 112 -28.805   2.912  11.497
  916    HG2  GLN 112           HG2      GLN 112 -29.552   2.977  13.878
  917    HG3  GLN 112           HG1      GLN 112 -29.788   4.719  13.724
  918   HE21  GLN 112          HE21      GLN 112 -32.147   4.168  14.195
  919   HE22  GLN 112          HE22      GLN 112 -33.126   3.665  12.903
  920    H    LEU 113           HN       LEU 113 -27.126   6.348  11.843
  921    HA   LEU 113           HA       LEU 113 -26.403   7.528  14.423
  922    HB2  LEU 113           HB2      LEU 113 -26.863   8.607  11.640
  923    HB3  LEU 113           HB1      LEU 113 -26.641   9.695  13.009
  924    HG   LEU 113           HG       LEU 113 -24.480   8.624  13.520
  925   HD11  LEU 113          HD11      LEU 113 -25.268   6.883  11.179
  926   HD12  LEU 113          HD12      LEU 113 -24.737   6.387  12.787
  927   HD13  LEU 113          HD13      LEU 113 -23.580   7.076  11.651
  928   HD21  LEU 113          HD21      LEU 113 -24.427  10.546  12.037
  929   HD22  LEU 113          HD22      LEU 113 -24.839   9.538  10.648
  930   HD23  LEU 113          HD23      LEU 113 -23.270   9.357  11.436
  931    H    GLU 114           HN       GLU 114 -27.943   7.955  15.918
  932    HA   GLU 114           HA       GLU 114 -30.755   8.367  15.060
  933    HB2  GLU 114           HB2      GLU 114 -30.253   6.807  16.943
  934    HB3  GLU 114           HB1      GLU 114 -29.594   8.167  17.856
  935    HG2  GLU 114           HG2      GLU 114 -31.759   9.310  17.778
  936    HG3  GLU 114           HG1      GLU 114 -32.432   8.009  16.794
  937    H    HIS 115           HN       HIS 115 -31.899  10.276  15.542
  938    HA   HIS 115           HA       HIS 115 -30.315  12.572  16.633
  939    HB2  HIS 115           HB2      HIS 115 -31.211  14.028  14.890
  940    HB3  HIS 115           HB1      HIS 115 -30.355  12.681  14.141
  941    HD1  HIS 115           HD1      HIS 115 -31.825  10.789  13.049
  942    HD2  HIS 115           HD2      HIS 115 -33.986  14.092  14.390
  943    HE1  HIS 115           HE1      HIS 115 -34.128  10.608  12.010
  944    H    HIS 116           HN       HIS 116 -31.386  13.387  18.335
  945    HA   HIS 116           HA       HIS 116 -33.122  13.932  19.801
  946    HB2  HIS 116           HB2      HIS 116 -33.769  15.431  17.960
  947    HB3  HIS 116           HB1      HIS 116 -34.692  14.128  17.213
  948    HD1  HIS 116           HD1      HIS 116 -34.556  15.897  20.597
  949    HD2  HIS 116           HD2      HIS 116 -37.316  14.087  18.052
  950    HE1  HIS 116           HE1      HIS 116 -36.828  16.201  21.673
  951    H    HIS 117           HN       HIS 117 -35.132  13.107  20.756
  952    HA   HIS 117           HA       HIS 117 -35.473  10.211  20.184
  953    HB2  HIS 117           HB2      HIS 117 -36.297  11.981  22.499
  954    HB3  HIS 117           HB1      HIS 117 -36.786  10.291  22.357
  955    HD1  HIS 117           HD1      HIS 117 -34.766   8.517  22.198
  956    HD2  HIS 117           HD2      HIS 117 -33.711  12.341  23.476
  957    HE1  HIS 117           HE1      HIS 117 -32.469   8.312  23.241
  958    H    HIS 118           HN       HIS 118 -36.841  10.151  18.413
  959    HA   HIS 118           HA       HIS 118 -39.177  11.790  18.086
  960    HB2  HIS 118           HB2      HIS 118 -38.055  10.559  16.231
  961    HB3  HIS 118           HB1      HIS 118 -38.605   9.040  16.938
  962    HD1  HIS 118           HD1      HIS 118 -41.186   8.563  16.896
  963    HD2  HIS 118           HD2      HIS 118 -40.046  12.014  14.854
  964    HE1  HIS 118           HE1      HIS 118 -43.169   9.242  15.475
  965    H    HIS 119           HN       HIS 119 -38.645   8.569  19.456
  966    HA   HIS 119           HA       HIS 119 -41.461   8.092  19.985
  967    HB2  HIS 119           HB2      HIS 119 -38.945   6.758  21.022
  968    HB3  HIS 119           HB1      HIS 119 -40.579   6.176  21.339
  969    HD1  HIS 119           HD1      HIS 119 -38.047   6.554  18.587
  970    HD2  HIS 119           HD2      HIS 119 -41.872   4.978  19.108
  971    HE1  HIS 119           HE1      HIS 119 -38.561   5.212  16.500
  972    H    HIS 120           HN       HIS 120 -42.507   8.184  22.016
  973    HA   HIS 120           HA       HIS 120 -41.078   9.232  24.358
  974    HB2  HIS 120           HB2      HIS 120 -42.494  11.229  24.584
  975    HB3  HIS 120           HB1      HIS 120 -41.590  11.290  23.070
  976    HD1  HIS 120           HD1      HIS 120 -42.924  10.776  20.861
  977    HD2  HIS 120           HD2      HIS 120 -45.292  11.033  24.282
  978    HE1  HIS 120           HE1      HIS 120 -45.318  10.968  20.061
  Start of MODEL   14
    1    H1   MET   1           HT1      MET   1  -8.117  -7.602  17.213
    2    H2   MET   1           HT2      MET   1  -6.687  -7.604  18.134
    3    H3   MET   1           HT3      MET   1  -7.208  -6.180  17.368
    4    HA   MET   1           HA       MET   1  -8.006  -7.310  19.893
    5    HB2  MET   1           HB2      MET   1  -6.961  -5.019  19.359
    6    HB3  MET   1           HB1      MET   1  -8.555  -4.565  18.752
    7    HG2  MET   1           HG2      MET   1  -8.492  -3.870  21.048
    8    HG3  MET   1           HG1      MET   1  -9.493  -5.320  21.005
    9    HE1  MET   1           HE1      MET   1  -6.834  -3.580  22.891
   10    HE2  MET   1           HE2      MET   1  -5.958  -3.922  21.400
   11    HE3  MET   1           HE3      MET   1  -5.432  -4.658  22.912
   12    H    THR   2           HN       THR   2 -10.198  -4.989  19.303
   13    HA   THR   2           HA       THR   2 -12.358  -6.963  18.712
   14    HB   THR   2           HB       THR   2 -13.828  -5.039  19.552
   15    HG1  THR   2           HG1      THR   2 -11.237  -4.045  20.056
   16   HG21  THR   2          HG21      THR   2 -13.233  -6.994  20.934
   17   HG22  THR   2          HG22      THR   2 -13.321  -5.527  21.909
   18   HG23  THR   2          HG23      THR   2 -11.752  -6.183  21.442
   19    H    LEU   3           HN       LEU   3 -10.446  -4.828  17.103
   20    HA   LEU   3           HA       LEU   3 -12.291  -3.336  15.488
   21    HB2  LEU   3           HB2      LEU   3  -9.449  -4.271  15.117
   22    HB3  LEU   3           HB1      LEU   3 -10.283  -3.408  13.826
   23    HG   LEU   3           HG       LEU   3 -10.287  -2.254  16.614
   24   HD11  LEU   3          HD11      LEU   3  -8.223  -0.960  15.939
   25   HD12  LEU   3          HD12      LEU   3  -8.026  -2.094  14.605
   26   HD13  LEU   3          HD13      LEU   3  -7.938  -2.669  16.268
   27   HD21  LEU   3          HD21      LEU   3 -11.691  -1.225  14.850
   28   HD22  LEU   3          HD22      LEU   3 -10.269  -1.046  13.823
   29   HD23  LEU   3          HD23      LEU   3 -10.390  -0.134  15.327
   30    H    GLU   4           HN       GLU   4 -10.822  -6.522  15.132
   31    HA   GLU   4           HA       GLU   4 -11.746  -7.112  12.508
   32    HB2  GLU   4           HB2      GLU   4 -10.082  -8.459  13.852
   33    HB3  GLU   4           HB1      GLU   4 -11.433  -9.063  14.807
   34    HG2  GLU   4           HG2      GLU   4 -10.979 -10.703  13.103
   35    HG3  GLU   4           HG1      GLU   4 -12.474  -9.883  12.647
   36    H    LEU   5           HN       LEU   5 -13.212  -7.913  15.661
   37    HA   LEU   5           HA       LEU   5 -15.586  -9.097  14.571
   38    HB2  LEU   5           HB2      LEU   5 -14.860  -7.915  17.246
   39    HB3  LEU   5           HB1      LEU   5 -16.503  -8.471  16.933
   40    HG   LEU   5           HG       LEU   5 -15.617 -10.697  16.308
   41   HD11  LEU   5          HD11      LEU   5 -13.168 -11.100  17.006
   42   HD12  LEU   5          HD12      LEU   5 -12.990  -9.347  16.952
   43   HD13  LEU   5          HD13      LEU   5 -13.437 -10.235  15.495
   44   HD21  LEU   5          HD21      LEU   5 -15.086 -11.421  18.552
   45   HD22  LEU   5          HD22      LEU   5 -16.251 -10.103  18.683
   46   HD23  LEU   5          HD23      LEU   5 -14.542  -9.805  19.000
   47    H    GLN   6           HN       GLN   6 -14.890  -5.788  15.671
   48    HA   GLN   6           HA       GLN   6 -17.552  -4.784  15.225
   49    HB2  GLN   6           HB2      GLN   6 -14.859  -3.392  15.303
   50    HB3  GLN   6           HB1      GLN   6 -16.392  -2.530  15.189
   51    HG2  GLN   6           HG2      GLN   6 -15.842  -4.524  17.393
   52    HG3  GLN   6           HG1      GLN   6 -15.406  -2.822  17.544
   53   HE21  GLN   6          HE21      GLN   6 -17.067  -1.383  18.152
   54   HE22  GLN   6          HE22      GLN   6 -18.707  -1.810  18.252
   55    H    LEU   7           HN       LEU   7 -14.702  -5.116  13.193
   56    HA   LEU   7           HA       LEU   7 -15.612  -3.555  10.981
   57    HB2  LEU   7           HB2      LEU   7 -13.278  -4.357  11.199
   58    HB3  LEU   7           HB1      LEU   7 -13.835  -6.016  10.994
   59    HG   LEU   7           HG       LEU   7 -14.686  -5.446   8.735
   60   HD11  LEU   7          HD11      LEU   7 -13.686  -3.152   7.870
   61   HD12  LEU   7          HD12      LEU   7 -13.768  -2.710   9.577
   62   HD13  LEU   7          HD13      LEU   7 -15.231  -3.186   8.716
   63   HD21  LEU   7          HD21      LEU   7 -12.432  -5.027   7.682
   64   HD22  LEU   7          HD22      LEU   7 -12.458  -6.344   8.853
   65   HD23  LEU   7          HD23      LEU   7 -11.786  -4.778   9.305
   66    H    LYS   8           HN       LYS   8 -15.941  -7.011  11.716
   67    HA   LYS   8           HA       LYS   8 -17.408  -7.685   9.335
   68    HB2  LYS   8           HB2      LYS   8 -17.257  -8.986  12.064
   69    HB3  LYS   8           HB1      LYS   8 -18.113  -9.703  10.702
   70    HG2  LYS   8           HG2      LYS   8 -16.024  -9.700   9.387
   71    HG3  LYS   8           HG1      LYS   8 -15.168  -8.975  10.749
   72    HD2  LYS   8           HD2      LYS   8 -15.740 -10.949  12.141
   73    HD3  LYS   8           HD1      LYS   8 -16.543 -11.680  10.752
   74    HE2  LYS   8           HE2      LYS   8 -13.613 -10.901  10.866
   75    HE3  LYS   8           HE1      LYS   8 -14.238 -12.543  11.015
   76    HZ1  LYS   8           HZ1      LYS   8 -13.523 -12.083   8.759
   77    HZ2  LYS   8           HZ2      LYS   8 -14.588 -10.763   8.663
   78    HZ3  LYS   8           HZ3      LYS   8 -15.198 -12.342   8.807
   79    H    HIS   9           HN       HIS   9 -18.415  -6.793  12.614
   80    HA   HIS   9           HA       HIS   9 -21.239  -7.104  12.150
   81    HB2  HIS   9           HB2      HIS   9 -19.716  -5.409  14.149
   82    HB3  HIS   9           HB1      HIS   9 -21.460  -5.656  14.192
   83    HD1  HIS   9           HD1      HIS   9 -21.828  -8.559  13.742
   84    HD2  HIS   9           HD2      HIS   9 -18.667  -7.122  16.048
   85    HE1  HIS   9           HE1      HIS   9 -21.100 -10.474  15.230
   86    H    TYR  10           HN       TYR  10 -19.068  -4.294  11.969
   87    HA   TYR  10           HA       TYR  10 -21.087  -2.357  11.363
   88    HB2  TYR  10           HB2      TYR  10 -18.820  -1.692  12.027
   89    HB3  TYR  10           HB1      TYR  10 -18.162  -2.434  10.571
   90    HD1  TYR  10           HD2      TYR  10 -20.567   0.178  11.726
   91    HD2  TYR  10           HD1      TYR  10 -18.023  -1.204   8.560
   92    HE1  TYR  10           HE2      TYR  10 -20.997   2.268  10.466
   93    HE2  TYR  10           HE1      TYR  10 -18.452   0.888   7.296
   94    HH   TYR  10           HH       TYR  10 -20.583   3.424   8.626
   95    H    ILE  11           HN       ILE  11 -18.941  -4.211   9.213
   96    HA   ILE  11           HA       ILE  11 -20.066  -3.196   6.775
   97    HB   ILE  11           HB       ILE  11 -18.575  -5.759   7.384
   98   HG12  ILE  11          HG12      ILE  11 -17.327  -3.650   7.729
   99   HG13  ILE  11          HG11      ILE  11 -16.675  -4.574   6.379
  100   HG21  ILE  11          HG21      ILE  11 -19.728  -6.256   5.375
  101   HG22  ILE  11          HG22      ILE  11 -18.152  -5.674   4.837
  102   HG23  ILE  11          HG23      ILE  11 -19.554  -4.608   4.774
  103   HD11  ILE  11          HD11      ILE  11 -16.787  -2.512   5.345
  104   HD12  ILE  11          HD12      ILE  11 -18.098  -1.951   6.377
  105   HD13  ILE  11          HD13      ILE  11 -18.448  -3.019   5.020
  106    H    THR  12           HN       THR  12 -20.775  -6.120   8.652
  107    HA   THR  12           HA       THR  12 -22.703  -7.156   6.799
  108    HB   THR  12           HB       THR  12 -23.436  -8.561   8.734
  109    HG1  THR  12           HG1      THR  12 -21.971  -6.609  10.048
  110   HG21  THR  12          HG21      THR  12 -21.665  -9.648   7.714
  111   HG22  THR  12          HG22      THR  12 -20.931  -9.329   9.285
  112   HG23  THR  12          HG23      THR  12 -20.567  -8.280   7.918
  113    H    ASN  13           HN       ASN  13 -22.926  -4.878   9.451
  114    HA   ASN  13           HA       ASN  13 -25.777  -4.884   9.743
  115    HB2  ASN  13           HB2      ASN  13 -24.250  -3.851  11.385
  116    HB3  ASN  13           HB1      ASN  13 -23.783  -2.646  10.187
  117   HD21  ASN  13          HD21      ASN  13 -24.664  -1.003  11.771
  118   HD22  ASN  13          HD22      ASN  13 -26.339  -0.732  11.816
  119    H    LEU  14           HN       LEU  14 -23.634  -2.774   7.844
  120    HA   LEU  14           HA       LEU  14 -25.744  -1.226   6.656
  121    HB2  LEU  14           HB2      LEU  14 -22.843  -1.683   6.081
  122    HB3  LEU  14           HB1      LEU  14 -23.817  -0.853   4.868
  123    HG   LEU  14           HG       LEU  14 -22.680   0.673   6.528
  124   HD11  LEU  14          HD11      LEU  14 -25.609   1.064   7.011
  125   HD12  LEU  14          HD12      LEU  14 -25.087   0.993   5.325
  126   HD13  LEU  14          HD13      LEU  14 -24.401   2.201   6.411
  127   HD21  LEU  14          HD21      LEU  14 -23.297   0.703   8.811
  128   HD22  LEU  14          HD22      LEU  14 -23.162  -1.021   8.452
  129   HD23  LEU  14          HD23      LEU  14 -24.751  -0.255   8.523
  130    H    PHE  15           HN       PHE  15 -24.028  -4.123   5.507
  131    HA   PHE  15           HA       PHE  15 -25.763  -4.161   3.092
  132    HB2  PHE  15           HB2      PHE  15 -23.361  -5.791   3.953
  133    HB3  PHE  15           HB1      PHE  15 -24.305  -6.169   2.512
  134    HD1  PHE  15           HD1      PHE  15 -24.562  -4.423   0.708
  135    HD2  PHE  15           HD2      PHE  15 -21.767  -4.009   3.944
  136    HE1  PHE  15           HE1      PHE  15 -23.331  -2.697  -0.579
  137    HE2  PHE  15           HE2      PHE  15 -20.536  -2.282   2.656
  138    HZ   PHE  15           HZ       PHE  15 -21.318  -1.625   0.396
  139    H    ASN  16           HN       ASN  16 -25.966  -5.188   6.224
  140    HA   ASN  16           HA       ASN  16 -27.283  -6.775   7.332
  141    HB2  ASN  16           HB2      ASN  16 -28.810  -6.873   4.711
  142    HB3  ASN  16           HB1      ASN  16 -29.417  -7.298   6.314
  143   HD21  ASN  16          HD21      ASN  16 -28.234  -5.095   7.788
  144   HD22  ASN  16          HD22      ASN  16 -29.003  -3.669   7.285
  145    H    LEU  17           HN       LEU  17 -24.938  -7.757   6.081
  146    HA   LEU  17           HA       LEU  17 -25.605 -10.256   4.717
  147    HB2  LEU  17           HB2      LEU  17 -22.988  -9.244   5.861
  148    HB3  LEU  17           HB1      LEU  17 -23.144 -10.652   4.814
  149    HG   LEU  17           HG       LEU  17 -24.231  -7.987   3.919
  150   HD11  LEU  17          HD11      LEU  17 -21.898  -7.565   4.611
  151   HD12  LEU  17          HD12      LEU  17 -22.064  -7.487   2.857
  152   HD13  LEU  17          HD13      LEU  17 -21.360  -8.915   3.614
  153   HD21  LEU  17          HD21      LEU  17 -23.683  -8.946   1.687
  154   HD22  LEU  17          HD22      LEU  17 -24.771  -9.994   2.596
  155   HD23  LEU  17          HD23      LEU  17 -23.058 -10.392   2.479
  156    HA   PRO  18           HA       PRO  18 -26.120 -12.729   8.346
  157    HB2  PRO  18           HB2      PRO  18 -25.100 -15.155   7.458
  158    HB3  PRO  18           HB1      PRO  18 -26.709 -14.533   7.043
  159    HG2  PRO  18           HG2      PRO  18 -24.191 -14.468   5.445
  160    HG3  PRO  18           HG1      PRO  18 -25.857 -14.758   4.912
  161    HD2  PRO  18           HD2      PRO  18 -24.624 -12.365   4.561
  162    HD3  PRO  18           HD1      PRO  18 -26.373 -12.492   4.840
  163    H    ARG  19           HN       ARG  19 -24.965 -12.905  10.184
  164    HA   ARG  19           HA       ARG  19 -22.021 -12.629  10.081
  165    HB2  ARG  19           HB2      ARG  19 -24.033 -12.560  12.344
  166    HB3  ARG  19           HB1      ARG  19 -22.296 -12.388  12.583
  167    HG2  ARG  19           HG2      ARG  19 -22.281 -10.409  11.118
  168    HG3  ARG  19           HG1      ARG  19 -24.015 -10.589  10.849
  169    HD2  ARG  19           HD2      ARG  19 -24.430 -10.282  13.260
  170    HD3  ARG  19           HD1      ARG  19 -22.697 -10.111  13.540
  171    HE   ARG  19           HE       ARG  19 -23.478  -8.186  11.590
  172   HH11  ARG  19          HH21      ARG  19 -23.873  -8.973  14.933
  173   HH12  ARG  19          HH22      ARG  19 -24.145  -7.331  15.415
  174   HH21  ARG  19          HH11      ARG  19 -23.836  -6.050  12.213
  175   HH22  ARG  19          HH12      ARG  19 -24.125  -5.684  13.881
  176    H    ASP  20           HN       ASP  20 -24.354 -15.106  10.422
  177    HA   ASP  20           HA       ASP  20 -22.643 -16.867  12.050
  178    HB2  ASP  20           HB2      ASP  20 -24.460 -18.545  11.630
  179    HB3  ASP  20           HB1      ASP  20 -25.061 -17.044  12.332
  180    H    GLU  21           HN       GLU  21 -22.487 -15.859   8.940
  181    HA   GLU  21           HA       GLU  21 -21.722 -18.516   7.813
  182    HB2  GLU  21           HB2      GLU  21 -23.248 -17.089   6.480
  183    HB3  GLU  21           HB1      GLU  21 -22.007 -15.836   6.428
  184    HG2  GLU  21           HG2      GLU  21 -20.478 -17.349   5.268
  185    HG3  GLU  21           HG1      GLU  21 -21.643 -18.665   5.396
  186    H    LYS  22           HN       LYS  22 -19.651 -19.069   7.945
  187    HA   LYS  22           HA       LYS  22 -17.564 -17.131   8.599
  188    HB2  LYS  22           HB2      LYS  22 -17.560 -19.431   9.523
  189    HB3  LYS  22           HB1      LYS  22 -17.330 -20.068   7.895
  190    HG2  LYS  22           HG2      LYS  22 -15.205 -18.880   7.689
  191    HG3  LYS  22           HG1      LYS  22 -15.445 -18.130   9.268
  192    HD2  LYS  22           HD2      LYS  22 -15.438 -20.377  10.319
  193    HD3  LYS  22           HD1      LYS  22 -15.146 -21.100   8.736
  194    HE2  LYS  22           HE2      LYS  22 -13.327 -19.096  10.104
  195    HE3  LYS  22           HE1      LYS  22 -13.038 -20.832  10.008
  196    HZ1  LYS  22           HZ1      LYS  22 -13.216 -18.933   7.733
  197    HZ2  LYS  22           HZ2      LYS  22 -13.092 -20.620   7.567
  198    HZ3  LYS  22           HZ3      LYS  22 -11.826 -19.736   8.278
  199    H    TRP  23           HN       TRP  23 -15.998 -16.352   7.266
  200    HA   TRP  23           HA       TRP  23 -16.350 -16.829   4.340
  201    HB2  TRP  23           HB2      TRP  23 -14.740 -14.644   5.668
  202    HB3  TRP  23           HB1      TRP  23 -15.325 -14.692   4.006
  203    HD1  TRP  23           HD1      TRP  23 -18.290 -15.828   5.091
  204    HE1  TRP  23           HE1      TRP  23 -19.928 -14.047   5.973
  205    HE3  TRP  23           HE3      TRP  23 -15.024 -12.018   6.049
  206    HZ2  TRP  23           HZ2      TRP  23 -19.866 -11.361   6.958
  207    HZ3  TRP  23           HZ3      TRP  23 -15.840  -9.862   6.959
  208    HH2  TRP  23           HH2      TRP  23 -18.254  -9.530   7.414
  209    H    GLU  24           HN       GLU  24 -14.375 -16.890   3.021
  210    HA   GLU  24           HA       GLU  24 -12.166 -18.349   4.438
  211    HB2  GLU  24           HB2      GLU  24 -13.418 -19.572   2.635
  212    HB3  GLU  24           HB1      GLU  24 -12.867 -18.349   1.491
  213    HG2  GLU  24           HG2      GLU  24 -10.558 -18.919   1.888
  214    HG3  GLU  24           HG1      GLU  24 -11.000 -20.001   3.207
  215    H    CYS  25           HN       CYS  25 -10.448 -17.094   4.768
  216    HA   CYS  25           HA       CYS  25  -9.950 -14.760   2.988
  217    HB2  CYS  25           HB2      CYS  25 -10.001 -14.118   5.272
  218    HB3  CYS  25           HB1      CYS  25  -8.994 -15.482   5.753
  219    HG   CYS  25           HG       CYS  25  -7.781 -13.291   3.893
  220    H    GLU  26           HN       GLU  26  -8.103 -14.495   1.871
  221    HA   GLU  26           HA       GLU  26  -6.266 -16.853   1.701
  222    HB2  GLU  26           HB2      GLU  26  -5.706 -15.922  -0.563
  223    HB3  GLU  26           HB1      GLU  26  -7.396 -16.394  -0.400
  224    HG2  GLU  26           HG2      GLU  26  -7.959 -14.016   0.128
  225    HG3  GLU  26           HG1      GLU  26  -6.284 -13.582  -0.211
  226    H    SER  27           HN       SER  27  -4.216 -16.563   2.334
  227    HA   SER  27           HA       SER  27  -3.355 -13.836   3.158
  228    HB2  SER  27           HB2      SER  27  -3.122 -15.456   4.899
  229    HB3  SER  27           HB1      SER  27  -2.361 -16.614   3.812
  230    HG   SER  27           HG       SER  27  -1.194 -14.799   5.312
  231    H    ILE  28           HN       ILE  28  -2.058 -12.736   1.870
  232    HA   ILE  28           HA       ILE  28   0.036 -14.140   0.298
  233    HB   ILE  28           HB       ILE  28  -0.500 -12.776  -1.704
  234   HG12  ILE  28          HG12      ILE  28  -3.022 -12.056  -0.168
  235   HG13  ILE  28          HG11      ILE  28  -1.691 -10.946  -0.493
  236   HG21  ILE  28          HG21      ILE  28  -1.406 -15.119  -1.262
  237   HG22  ILE  28          HG22      ILE  28  -2.292 -14.160  -2.449
  238   HG23  ILE  28          HG23      ILE  28  -2.927 -14.342  -0.813
  239   HD11  ILE  28          HD11      ILE  28  -3.438 -12.324  -2.551
  240   HD12  ILE  28          HD12      ILE  28  -2.015 -11.358  -2.942
  241   HD13  ILE  28          HD13      ILE  28  -3.410 -10.601  -2.174
  242    H    GLU  29           HN       GLU  29   1.827 -12.814  -0.166
  243    HA   GLU  29           HA       GLU  29   2.043 -10.414   1.588
  244    HB2  GLU  29           HB2      GLU  29   3.709 -12.286   1.796
  245    HB3  GLU  29           HB1      GLU  29   4.232 -11.939   0.148
  246    HG2  GLU  29           HG2      GLU  29   4.852  -9.670   0.779
  247    HG3  GLU  29           HG1      GLU  29   4.230  -9.922   2.409
  248    H    GLU  30           HN       GLU  30   1.872  -8.464   0.645
  249    HA   GLU  30           HA       GLU  30   2.887  -8.093  -2.143
  250    HB2  GLU  30           HB2      GLU  30   0.169  -7.227  -1.120
  251    HB3  GLU  30           HB1      GLU  30   0.864  -6.715  -2.655
  252    HG2  GLU  30           HG2      GLU  30   0.343  -9.599  -1.868
  253    HG3  GLU  30           HG1      GLU  30  -0.698  -8.638  -2.915
  254    H    VAL  31           HN       VAL  31   3.280  -5.835  -2.652
  255    HA   VAL  31           HA       VAL  31   4.384  -4.386  -0.374
  256    HB   VAL  31           HB       VAL  31   4.188  -3.474  -3.246
  257   HG11  VAL  31          HG11      VAL  31   6.163  -2.777  -1.052
  258   HG12  VAL  31          HG12      VAL  31   4.774  -1.780  -1.477
  259   HG13  VAL  31          HG13      VAL  31   6.061  -2.045  -2.653
  260   HG21  VAL  31          HG21      VAL  31   5.293  -5.650  -3.180
  261   HG22  VAL  31          HG22      VAL  31   6.300  -5.132  -1.829
  262   HG23  VAL  31          HG23      VAL  31   6.514  -4.400  -3.419
  263    H    ALA  32           HN       ALA  32   3.549  -2.643   0.628
  264    HA   ALA  32           HA       ALA  32   0.788  -2.062   0.556
  265    HB1  ALA  32           HB1      ALA  32   1.334  -0.127   1.933
  266    HB2  ALA  32           HB2      ALA  32   3.011  -0.182   1.389
  267    HB3  ALA  32           HB3      ALA  32   2.377  -1.471   2.406
  268    H    ASP  33           HN       ASP  33   3.455  -0.613  -1.252
  269    HA   ASP  33           HA       ASP  33   1.891   1.581  -2.320
  270    HB2  ASP  33           HB2      ASP  33   3.794   1.989  -3.759
  271    HB3  ASP  33           HB1      ASP  33   4.419   1.515  -2.180
  272    H    ASP  34           HN       ASP  34   1.741  -1.702  -2.883
  273    HA   ASP  34           HA       ASP  34   0.878  -1.390  -5.735
  274    HB2  ASP  34           HB2      ASP  34   2.614  -3.130  -5.080
  275    HB3  ASP  34           HB1      ASP  34   1.337  -3.948  -4.184
  276    H    ILE  35           HN       ILE  35  -0.519  -1.080  -2.839
  277    HA   ILE  35           HA       ILE  35  -3.132  -2.099  -3.829
  278    HB   ILE  35           HB       ILE  35  -3.613  -3.097  -1.581
  279   HG12  ILE  35          HG12      ILE  35  -0.623  -2.758  -1.167
  280   HG13  ILE  35          HG11      ILE  35  -1.850  -1.786  -0.358
  281   HG21  ILE  35          HG21      ILE  35  -2.401  -5.144  -2.000
  282   HG22  ILE  35          HG22      ILE  35  -1.167  -4.278  -2.915
  283   HG23  ILE  35          HG23      ILE  35  -2.803  -4.420  -3.558
  284   HD11  ILE  35          HD11      ILE  35  -1.347  -3.504   1.193
  285   HD12  ILE  35          HD12      ILE  35  -1.326  -4.742  -0.063
  286   HD13  ILE  35          HD13      ILE  35  -2.855  -4.017   0.436
  287    H    LEU  36           HN       LEU  36  -1.270  -0.107  -1.605
  288    HA   LEU  36           HA       LEU  36  -3.735   1.361  -0.838
  289    HB2  LEU  36           HB2      LEU  36  -0.943   1.252   0.259
  290    HB3  LEU  36           HB1      LEU  36  -2.025   2.581   0.689
  291    HG   LEU  36           HG       LEU  36  -3.051  -0.246   0.909
  292   HD11  LEU  36          HD11      LEU  36  -2.247  -0.146   3.339
  293   HD12  LEU  36          HD12      LEU  36  -1.140   1.118   2.804
  294   HD13  LEU  36          HD13      LEU  36  -1.030  -0.500   2.113
  295   HD21  LEU  36          HD21      LEU  36  -3.518   2.300   2.503
  296   HD22  LEU  36          HD22      LEU  36  -4.356   0.770   2.756
  297   HD23  LEU  36          HD23      LEU  36  -4.590   1.665   1.257
  298    HA   PRO  37           HA       PRO  37  -2.871   4.432  -4.045
  299    HB2  PRO  37           HB2      PRO  37  -4.224   6.214  -2.039
  300    HB3  PRO  37           HB1      PRO  37  -4.532   6.042  -3.779
  301    HG2  PRO  37           HG2      PRO  37  -6.155   4.944  -1.972
  302    HG3  PRO  37           HG1      PRO  37  -5.792   4.135  -3.505
  303    HD2  PRO  37           HD2      PRO  37  -4.828   3.472  -0.759
  304    HD3  PRO  37           HD1      PRO  37  -5.089   2.419  -2.166
  305    H    ASP  38           HN       ASP  38  -1.357   6.074  -4.344
  306    HA   ASP  38           HA       ASP  38   0.818   6.304  -2.559
  307    HB2  ASP  38           HB2      ASP  38   1.480   8.281  -3.916
  308    HB3  ASP  38           HB1      ASP  38   0.995   6.922  -4.928
  309    H    GLN  39           HN       GLN  39  -2.274   7.496  -2.204
  310    HA   GLN  39           HA       GLN  39  -1.823  10.039  -0.960
  311    HB2  GLN  39           HB2      GLN  39  -4.062   9.239  -1.703
  312    HB3  GLN  39           HB1      GLN  39  -4.023   8.019  -0.431
  313    HG2  GLN  39           HG2      GLN  39  -3.952   9.731   1.289
  314    HG3  GLN  39           HG1      GLN  39  -3.814  10.999   0.074
  315   HE21  GLN  39          HE21      GLN  39  -5.970  11.012   1.937
  316   HE22  GLN  39          HE22      GLN  39  -7.413  10.703   1.098
  317    H    TYR  40           HN       TYR  40  -1.889   6.727   0.289
  318    HA   TYR  40           HA       TYR  40  -0.763   7.753   2.879
  319    HB2  TYR  40           HB2      TYR  40  -3.049   7.008   3.251
  320    HB3  TYR  40           HB1      TYR  40  -2.718   5.480   2.437
  321    HD1  TYR  40           HD1      TYR  40  -1.417   7.601   5.242
  322    HD2  TYR  40           HD2      TYR  40  -2.074   3.635   3.733
  323    HE1  TYR  40           HE1      TYR  40  -0.604   6.651   7.383
  324    HE2  TYR  40           HE2      TYR  40  -1.264   2.685   5.874
  325    HH   TYR  40           HH       TYR  40  -0.056   3.211   7.773
  326    H    VAL  41           HN       VAL  41   1.153   7.246   1.224
  327    HA   VAL  41           HA       VAL  41   2.262   4.647   2.120
  328    HB   VAL  41           HB       VAL  41   2.086   5.446  -0.802
  329   HG11  VAL  41          HG11      VAL  41   4.241   4.492  -0.486
  330   HG12  VAL  41          HG12      VAL  41   3.236   3.166  -1.070
  331   HG13  VAL  41          HG13      VAL  41   3.626   3.287   0.645
  332   HG21  VAL  41          HG21      VAL  41   0.919   3.226  -0.974
  333   HG22  VAL  41          HG22      VAL  41   0.032   4.406  -0.012
  334   HG23  VAL  41          HG23      VAL  41   0.944   3.128   0.787
  335    H    ARG  42           HN       ARG  42   2.736   7.699   0.376
  336    HA   ARG  42           HA       ARG  42   5.654   7.628   0.630
  337    HB2  ARG  42           HB2      ARG  42   3.769   9.893  -0.096
  338    HB3  ARG  42           HB1      ARG  42   5.525   9.940  -0.268
  339    HG2  ARG  42           HG2      ARG  42   5.445   8.058  -1.841
  340    HG3  ARG  42           HG1      ARG  42   3.696   7.941  -1.633
  341    HD2  ARG  42           HD2      ARG  42   4.182   9.179  -3.681
  342    HD3  ARG  42           HD1      ARG  42   3.465  10.266  -2.494
  343    HE   ARG  42           HE       ARG  42   5.552  11.399  -2.325
  344   HH11  ARG  42          HH21      ARG  42   5.813   8.443  -4.101
  345   HH12  ARG  42          HH22      ARG  42   7.379   8.821  -4.733
  346   HH21  ARG  42          HH11      ARG  42   7.575  11.894  -3.147
  347   HH22  ARG  42          HH12      ARG  42   8.375  10.773  -4.195
  348    H    LEU  43           HN       LEU  43   3.099   8.377   2.690
  349    HA   LEU  43           HA       LEU  43   4.089  10.579   4.188
  350    HB2  LEU  43           HB2      LEU  43   2.298   8.247   4.828
  351    HB3  LEU  43           HB1      LEU  43   2.746   9.385   6.099
  352    HG   LEU  43           HG       LEU  43   0.590   9.946   4.950
  353   HD11  LEU  43          HD11      LEU  43   0.948  12.207   5.182
  354   HD12  LEU  43          HD12      LEU  43   2.412  12.196   4.198
  355   HD13  LEU  43          HD13      LEU  43   2.474  11.665   5.880
  356   HD21  LEU  43          HD21      LEU  43   0.568  10.647   2.662
  357   HD22  LEU  43          HD22      LEU  43   1.462   9.126   2.688
  358   HD23  LEU  43          HD23      LEU  43   2.328  10.658   2.576
  359    H    GLY  44           HN       GLY  44   3.827   7.831   6.172
  360    HA2  GLY  44           HA2      GLY  44   6.533   8.236   7.202
  361    HA3  GLY  44           HA1      GLY  44   5.332   7.111   7.831
  362    HA   PRO  45           HA       PRO  45   8.752   4.661   5.808
  363    HB2  PRO  45           HB2      PRO  45   7.824   2.775   7.937
  364    HB3  PRO  45           HB1      PRO  45   9.478   3.246   7.494
  365    HG2  PRO  45           HG2      PRO  45   8.309   4.164   9.721
  366    HG3  PRO  45           HG1      PRO  45   9.416   5.167   8.768
  367    HD2  PRO  45           HD2      PRO  45   6.427   5.291   8.926
  368    HD3  PRO  45           HD1      PRO  45   7.599   6.610   8.718
  369    H    LEU  46           HN       LEU  46   5.416   4.483   6.193
  370    HA   LEU  46           HA       LEU  46   4.708   1.899   5.298
  371    HB2  LEU  46           HB2      LEU  46   3.481   4.632   4.976
  372    HB3  LEU  46           HB1      LEU  46   2.750   3.255   4.152
  373    HG   LEU  46           HG       LEU  46   1.777   3.756   6.426
  374   HD11  LEU  46          HD11      LEU  46   1.382   1.531   6.886
  375   HD12  LEU  46          HD12      LEU  46   3.061   1.050   6.647
  376   HD13  LEU  46          HD13      LEU  46   2.024   1.372   5.252
  377   HD21  LEU  46          HD21      LEU  46   4.386   2.650   7.495
  378   HD22  LEU  46          HD22      LEU  46   3.048   3.346   8.412
  379   HD23  LEU  46          HD23      LEU  46   4.057   4.382   7.398
  380    H    SER  47           HN       SER  47   6.584   4.210   3.791
  381    HA   SER  47           HA       SER  47   5.857   3.796   1.045
  382    HB2  SER  47           HB2      SER  47   8.561   4.649   2.053
  383    HB3  SER  47           HB1      SER  47   7.796   5.070   0.525
  384    HG   SER  47           HG       SER  47   6.347   5.693   2.793
  385    H    ASN  48           HN       ASN  48   6.250   2.111  -0.198
  386    HA   ASN  48           HA       ASN  48   7.098   0.097  -0.981
  387    HB2  ASN  48           HB2      ASN  48   9.029   1.625  -1.381
  388    HB3  ASN  48           HB1      ASN  48   9.698   1.139   0.176
  389   HD21  ASN  48          HD21      ASN  48   7.981  -1.393  -1.445
  390   HD22  ASN  48          HD22      ASN  48   9.335  -2.215  -2.046
  391    H    LYS  49           HN       LYS  49   5.955   0.008   1.662
  392    HA   LYS  49           HA       LYS  49   7.725  -1.873   3.137
  393    HB2  LYS  49           HB2      LYS  49   5.298  -0.272   3.818
  394    HB3  LYS  49           HB1      LYS  49   5.526  -1.781   4.697
  395    HG2  LYS  49           HG2      LYS  49   7.807   0.177   4.423
  396    HG3  LYS  49           HG1      LYS  49   6.573   0.415   5.661
  397    HD2  LYS  49           HD2      LYS  49   7.004  -1.864   6.531
  398    HD3  LYS  49           HD1      LYS  49   8.259  -2.092   5.315
  399    HE2  LYS  49           HE2      LYS  49   9.467  -0.129   6.246
  400    HE3  LYS  49           HE1      LYS  49   8.241  -0.011   7.510
  401    HZ1  LYS  49           HZ1      LYS  49  10.140  -1.253   8.292
  402    HZ2  LYS  49           HZ2      LYS  49  10.004  -2.345   6.997
  403    HZ3  LYS  49           HZ3      LYS  49   8.791  -2.275   8.184
  404    H    ILE  50           HN       ILE  50   7.278  -4.003   3.400
  405    HA   ILE  50           HA       ILE  50   5.253  -5.161   1.571
  406    HB   ILE  50           HB       ILE  50   7.442  -6.505   3.171
  407   HG12  ILE  50          HG12      ILE  50   8.234  -6.715   0.570
  408   HG13  ILE  50          HG11      ILE  50   7.378  -5.177   0.476
  409   HG21  ILE  50          HG21      ILE  50   5.783  -8.127   2.680
  410   HG22  ILE  50          HG22      ILE  50   6.979  -8.312   1.399
  411   HG23  ILE  50          HG23      ILE  50   5.475  -7.448   1.080
  412   HD11  ILE  50          HD11      ILE  50   9.806  -5.895   2.099
  413   HD12  ILE  50          HD12      ILE  50   8.772  -4.556   2.599
  414   HD13  ILE  50          HD13      ILE  50   9.558  -4.523   1.021
  415    H    LEU  51           HN       LEU  51   3.300  -5.287   2.489
  416    HA   LEU  51           HA       LEU  51   3.100  -6.219   5.335
  417    HB2  LEU  51           HB2      LEU  51   1.077  -4.637   3.737
  418    HB3  LEU  51           HB1      LEU  51   0.998  -5.021   5.456
  419    HG   LEU  51           HG       LEU  51   3.135  -3.326   4.120
  420   HD11  LEU  51          HD11      LEU  51   1.029  -2.126   4.254
  421   HD12  LEU  51          HD12      LEU  51   2.101  -1.510   5.512
  422   HD13  LEU  51          HD13      LEU  51   0.805  -2.628   5.930
  423   HD21  LEU  51          HD21      LEU  51   2.754  -4.371   6.923
  424   HD22  LEU  51          HD22      LEU  51   3.584  -2.838   6.665
  425   HD23  LEU  51          HD23      LEU  51   4.225  -4.317   5.954
  426    H    GLN  52           HN       GLN  52   1.551  -7.762   5.860
  427    HA   GLN  52           HA       GLN  52   1.009  -9.704   3.744
  428    HB2  GLN  52           HB2      GLN  52   1.610 -10.386   6.060
  429    HB3  GLN  52           HB1      GLN  52   0.103  -9.678   6.638
  430    HG2  GLN  52           HG2      GLN  52  -1.206 -11.221   5.309
  431    HG3  GLN  52           HG1      GLN  52   0.246 -11.846   4.529
  432   HE21  GLN  52          HE21      GLN  52  -1.522 -13.578   5.969
  433   HE22  GLN  52          HE22      GLN  52  -0.713 -14.142   7.348
  434    H    THR  53           HN       THR  53  -0.551  -9.125   2.343
  435    HA   THR  53           HA       THR  53  -2.924  -7.628   3.168
  436    HB   THR  53           HB       THR  53  -2.039  -8.871   0.558
  437    HG1  THR  53           HG1      THR  53  -1.004  -6.950   1.379
  438   HG21  THR  53          HG21      THR  53  -4.416  -8.932   0.455
  439   HG22  THR  53          HG22      THR  53  -3.946  -7.457  -0.388
  440   HG23  THR  53          HG23      THR  53  -4.564  -7.371   1.262
  441    H    ASN  54           HN       ASN  54  -4.789  -8.522   3.842
  442    HA   ASN  54           HA       ASN  54  -5.239 -11.456   3.368
  443    HB2  ASN  54           HB2      ASN  54  -6.164  -9.687   5.651
  444    HB3  ASN  54           HB1      ASN  54  -6.643 -11.368   5.427
  445   HD21  ASN  54          HD21      ASN  54  -5.525 -12.300   7.207
  446   HD22  ASN  54          HD22      ASN  54  -3.836 -12.265   7.367
  447    H    THR  55           HN       THR  55  -6.625 -11.627   1.728
  448    HA   THR  55           HA       THR  55  -8.839  -9.637   1.438
  449    HB   THR  55           HB       THR  55  -7.759 -11.761  -0.435
  450    HG1  THR  55           HG1      THR  55  -6.675  -9.641   0.019
  451   HG21  THR  55          HG21      THR  55 -10.113  -9.880  -0.647
  452   HG22  THR  55          HG22      THR  55 -10.076 -11.621  -0.924
  453   HG23  THR  55          HG23      THR  55  -9.310 -10.529  -2.077
  454    H    TYR  56           HN       TYR  56 -10.889 -10.207   1.942
  455    HA   TYR  56           HA       TYR  56 -11.416 -13.054   2.697
  456    HB2  TYR  56           HB2      TYR  56 -12.821 -10.478   3.406
  457    HB3  TYR  56           HB1      TYR  56 -13.419 -12.077   3.854
  458    HD1  TYR  56           HD1      TYR  56 -10.315  -9.976   4.035
  459    HD2  TYR  56           HD2      TYR  56 -12.691 -13.054   5.862
  460    HE1  TYR  56           HE1      TYR  56  -8.781 -10.003   5.982
  461    HE2  TYR  56           HE2      TYR  56 -11.157 -13.080   7.810
  462    HH   TYR  56           HH       TYR  56  -8.966 -10.665   8.454
  463    H    TYR  57           HN       TYR  57 -12.803 -14.244   1.538
  464    HA   TYR  57           HA       TYR  57 -14.739 -12.892  -0.277
  465    HB2  TYR  57           HB2      TYR  57 -14.111 -14.308  -2.157
  466    HB3  TYR  57           HB1      TYR  57 -12.696 -13.410  -1.611
  467    HD1  TYR  57           HD1      TYR  57 -10.875 -14.544  -0.370
  468    HD2  TYR  57           HD2      TYR  57 -14.289 -16.707  -1.838
  469    HE1  TYR  57           HE1      TYR  57  -9.674 -16.681  -0.026
  470    HE2  TYR  57           HE2      TYR  57 -13.078 -18.844  -1.493
  471    HH   TYR  57           HH       TYR  57  -9.816 -19.058  -1.068
  472    H    SER  58           HN       SER  58 -16.672 -13.829  -0.105
  473    HA   SER  58           HA       SER  58 -16.875 -16.698   0.698
  474    HB2  SER  58           HB2      SER  58 -17.166 -15.372   2.742
  475    HB3  SER  58           HB1      SER  58 -18.414 -14.413   1.958
  476    HG   SER  58           HG       SER  58 -19.769 -15.948   2.391
  477    H    ASP  59           HN       ASP  59 -19.396 -17.225   0.616
  478    HA   ASP  59           HA       ASP  59 -20.201 -17.025  -2.119
  479    HB2  ASP  59           HB2      ASP  59 -20.991 -18.835  -0.667
  480    HB3  ASP  59           HB1      ASP  59 -21.795 -17.668   0.380
  481    H    THR  60           HN       THR  60 -21.563 -15.472   0.776
  482    HA   THR  60           HA       THR  60 -23.420 -13.808  -0.629
  483    HB   THR  60           HB       THR  60 -23.450 -12.515   1.543
  484    HG1  THR  60           HG1      THR  60 -21.765 -14.498   2.570
  485   HG21  THR  60          HG21      THR  60 -24.395 -14.358   2.836
  486   HG22  THR  60          HG22      THR  60 -23.558 -15.531   1.821
  487   HG23  THR  60          HG23      THR  60 -24.847 -14.540   1.141
  488    H    LEU  61           HN       LEU  61 -20.119 -13.198   0.522
  489    HA   LEU  61           HA       LEU  61 -20.044 -10.421  -0.206
  490    HB2  LEU  61           HB2      LEU  61 -17.831 -12.470   0.069
  491    HB3  LEU  61           HB1      LEU  61 -17.548 -10.739  -0.137
  492    HG   LEU  61           HG       LEU  61 -19.196 -11.944   2.105
  493   HD11  LEU  61          HD11      LEU  61 -16.724 -12.534   2.137
  494   HD12  LEU  61          HD12      LEU  61 -17.310 -11.657   3.550
  495   HD13  LEU  61          HD13      LEU  61 -16.398 -10.808   2.303
  496   HD21  LEU  61          HD21      LEU  61 -18.386  -9.148   1.336
  497   HD22  LEU  61          HD22      LEU  61 -18.540  -9.540   3.051
  498   HD23  LEU  61          HD23      LEU  61 -19.922  -9.731   1.976
  499    H    HIS  62           HN       HIS  62 -19.262 -13.372  -1.979
  500    HA   HIS  62           HA       HIS  62 -18.058 -12.180  -4.256
  501    HB2  HIS  62           HB2      HIS  62 -18.121 -14.631  -3.855
  502    HB3  HIS  62           HB1      HIS  62 -19.858 -14.619  -4.168
  503    HD1  HIS  62           HD1      HIS  62 -16.641 -13.596  -5.929
  504    HD2  HIS  62           HD2      HIS  62 -20.481 -14.930  -6.850
  505    HE1  HIS  62           HE1      HIS  62 -16.719 -13.863  -8.445
  506    H    LYS  63           HN       LYS  63 -21.480 -12.960  -3.652
  507    HA   LYS  63           HA       LYS  63 -22.435 -11.885  -6.145
  508    HB2  LYS  63           HB2      LYS  63 -23.689 -12.625  -3.523
  509    HB3  LYS  63           HB1      LYS  63 -24.647 -11.697  -4.670
  510    HG2  LYS  63           HG2      LYS  63 -25.124 -13.998  -5.110
  511    HG3  LYS  63           HG1      LYS  63 -24.036 -13.487  -6.403
  512    HD2  LYS  63           HD2      LYS  63 -22.126 -14.437  -5.142
  513    HD3  LYS  63           HD1      LYS  63 -23.238 -14.967  -3.879
  514    HE2  LYS  63           HE2      LYS  63 -24.437 -16.362  -5.519
  515    HE3  LYS  63           HE1      LYS  63 -23.324 -15.831  -6.782
  516    HZ1  LYS  63           HZ1      LYS  63 -22.886 -18.033  -5.510
  517    HZ2  LYS  63           HZ2      LYS  63 -22.247 -17.009  -4.314
  518    HZ3  LYS  63           HZ3      LYS  63 -21.591 -17.003  -5.881
  519    H    SER  64           HN       SER  64 -22.015 -10.444  -2.938
  520    HA   SER  64           HA       SER  64 -23.237  -7.923  -3.681
  521    HB2  SER  64           HB2      SER  64 -21.206  -8.357  -1.481
  522    HB3  SER  64           HB1      SER  64 -22.466  -7.128  -1.551
  523    HG   SER  64           HG       SER  64 -23.030  -8.917  -0.212
  524    H    ASN  65           HN       ASN  65 -20.347  -9.413  -4.486
  525    HA   ASN  65           HA       ASN  65 -18.431  -8.693  -5.606
  526    HB2  ASN  65           HB2      ASN  65 -20.021  -6.161  -6.123
  527    HB3  ASN  65           HB1      ASN  65 -18.639  -6.754  -7.042
  528   HD21  ASN  65          HD21      ASN  65 -19.437  -9.583  -7.015
  529   HD22  ASN  65          HD22      ASN  65 -20.793  -9.716  -8.025
  530    H    ILE  66           HN       ILE  66 -18.639  -8.218  -2.781
  531    HA   ILE  66           HA       ILE  66 -16.856  -5.813  -2.514
  532    HB   ILE  66           HB       ILE  66 -18.853  -6.922  -0.524
  533   HG12  ILE  66          HG12      ILE  66 -18.670  -4.186  -1.813
  534   HG13  ILE  66          HG11      ILE  66 -19.696  -5.478  -2.429
  535   HG21  ILE  66          HG21      ILE  66 -16.978  -6.231   0.759
  536   HG22  ILE  66          HG22      ILE  66 -18.061  -4.839   0.780
  537   HG23  ILE  66          HG23      ILE  66 -16.660  -4.853  -0.293
  538   HD11  ILE  66          HD11      ILE  66 -20.876  -5.576  -0.272
  539   HD12  ILE  66          HD12      ILE  66 -20.962  -3.953  -0.957
  540   HD13  ILE  66          HD13      ILE  66 -19.838  -4.298   0.358
  541    H    TYR  67           HN       TYR  67 -14.884  -6.243  -1.718
  542    HA   TYR  67           HA       TYR  67 -14.391  -8.901  -0.406
  543    HB2  TYR  67           HB2      TYR  67 -12.451  -7.351  -2.135
  544    HB3  TYR  67           HB1      TYR  67 -12.222  -8.962  -1.454
  545    HD1  TYR  67           HD1      TYR  67 -13.513 -10.896  -2.292
  546    HD2  TYR  67           HD2      TYR  67 -13.876  -7.000  -4.064
  547    HE1  TYR  67           HE1      TYR  67 -14.605 -11.902  -4.279
  548    HE2  TYR  67           HE2      TYR  67 -14.968  -8.005  -6.050
  549    HH   TYR  67           HH       TYR  67 -15.807  -9.862  -6.943
  550    HA   PRO  68           HA       PRO  68 -13.349  -5.776   2.823
  551    HB2  PRO  68           HB2      PRO  68 -12.866  -8.333   4.304
  552    HB3  PRO  68           HB1      PRO  68 -13.767  -6.887   4.814
  553    HG2  PRO  68           HG2      PRO  68 -15.037  -9.103   4.054
  554    HG3  PRO  68           HG1      PRO  68 -15.665  -7.495   3.655
  555    HD2  PRO  68           HD2      PRO  68 -14.289  -9.472   1.873
  556    HD3  PRO  68           HD1      PRO  68 -15.571  -8.309   1.487
  557    H    PHE  69           HN       PHE  69 -11.316  -5.012   3.388
  558    HA   PHE  69           HA       PHE  69  -8.961  -6.771   2.762
  559    HB2  PHE  69           HB2      PHE  69  -9.759  -4.321   1.538
  560    HB3  PHE  69           HB1      PHE  69  -8.329  -3.946   2.498
  561    HD1  PHE  69           HD1      PHE  69  -9.595  -6.644   0.217
  562    HD2  PHE  69           HD2      PHE  69  -6.257  -4.250   1.468
  563    HE1  PHE  69           HE1      PHE  69  -8.180  -7.716  -1.512
  564    HE2  PHE  69           HE2      PHE  69  -4.844  -5.313  -0.261
  565    HZ   PHE  69           HZ       PHE  69  -5.803  -7.049  -1.753
  566    H    ILE  70           HN       ILE  70  -7.660  -7.099   4.438
  567    HA   ILE  70           HA       ILE  70  -7.430  -4.978   6.544
  568    HB   ILE  70           HB       ILE  70  -7.656  -7.951   7.084
  569   HG12  ILE  70          HG12      ILE  70  -9.592  -5.696   7.712
  570   HG13  ILE  70          HG11      ILE  70  -9.814  -6.866   6.413
  571   HG21  ILE  70          HG21      ILE  70  -7.725  -7.153   9.461
  572   HG22  ILE  70          HG22      ILE  70  -7.397  -5.517   8.888
  573   HG23  ILE  70          HG23      ILE  70  -6.195  -6.790   8.667
  574   HD11  ILE  70          HD11      ILE  70  -9.421  -8.583   8.471
  575   HD12  ILE  70          HD12      ILE  70 -11.015  -7.961   8.042
  576   HD13  ILE  70          HD13      ILE  70 -10.109  -7.220   9.359
  577    H    LEU  71           HN       LEU  71  -5.333  -4.508   6.900
  578    HA   LEU  71           HA       LEU  71  -3.249  -6.348   5.781
  579    HB2  LEU  71           HB2      LEU  71  -2.985  -3.461   6.650
  580    HB3  LEU  71           HB1      LEU  71  -1.800  -4.400   5.743
  581    HG   LEU  71           HG       LEU  71  -4.581  -3.635   4.805
  582   HD11  LEU  71          HD11      LEU  71  -1.898  -2.829   3.664
  583   HD12  LEU  71          HD12      LEU  71  -2.760  -1.854   4.855
  584   HD13  LEU  71          HD13      LEU  71  -3.483  -2.162   3.275
  585   HD21  LEU  71          HD21      LEU  71  -3.560  -4.583   2.591
  586   HD22  LEU  71          HD22      LEU  71  -4.180  -5.718   3.786
  587   HD23  LEU  71          HD23      LEU  71  -2.444  -5.430   3.663
  588    H    TYR  72           HN       TYR  72  -1.682  -7.185   7.042
  589    HA   TYR  72           HA       TYR  72  -1.743  -6.558   9.970
  590    HB2  TYR  72           HB2      TYR  72  -1.283  -9.207   8.591
  591    HB3  TYR  72           HB1      TYR  72  -1.052  -8.934  10.318
  592    HD1  TYR  72           HD2      TYR  72  -3.538  -9.114   7.588
  593    HD2  TYR  72           HD1      TYR  72  -2.927  -8.614  11.809
  594    HE1  TYR  72           HE2      TYR  72  -5.961  -9.477   7.981
  595    HE2  TYR  72           HE1      TYR  72  -5.347  -8.977  12.204
  596    HH   TYR  72           HH       TYR  72  -7.320  -9.366  11.281
  597    H    TYR  73           HN       TYR  73   0.181  -6.342  10.995
  598    HA   TYR  73           HA       TYR  73   2.697  -6.805   9.475
  599    HB2  TYR  73           HB2      TYR  73   2.118  -4.432   9.148
  600    HB3  TYR  73           HB1      TYR  73   2.008  -4.217  10.896
  601    HD1  TYR  73           HD2      TYR  73   4.361  -5.414   8.233
  602    HD2  TYR  73           HD1      TYR  73   3.931  -3.629  12.117
  603    HE1  TYR  73           HE2      TYR  73   6.811  -5.055   8.339
  604    HE2  TYR  73           HE1      TYR  73   6.384  -3.281  12.224
  605    HH   TYR  73           HH       TYR  73   8.342  -3.212   9.789
  606    H    GLN  74           HN       GLN  74   3.914  -8.046  10.720
  607    HA   GLN  74           HA       GLN  74   4.860  -9.061  12.597
  608    HB2  GLN  74           HB2      GLN  74   4.336  -6.308  13.759
  609    HB3  GLN  74           HB1      GLN  74   5.268  -7.563  14.572
  610    HG2  GLN  74           HG2      GLN  74   6.852  -7.634  12.705
  611    HG3  GLN  74           HG1      GLN  74   5.906  -6.431  11.834
  612   HE21  GLN  74          HE21      GLN  74   8.343  -5.476  12.134
  613   HE22  GLN  74          HE22      GLN  74   8.507  -4.429  13.460
  614    H    LYS  75           HN       LYS  75   2.551  -6.989  14.329
  615    HA   LYS  75           HA       LYS  75   0.899  -9.383  14.969
  616    HB2  LYS  75           HB2      LYS  75   0.934  -8.798  17.380
  617    HB3  LYS  75           HB1      LYS  75   2.540  -9.222  16.788
  618    HG2  LYS  75           HG2      LYS  75   3.125  -6.847  16.580
  619    HG3  LYS  75           HG1      LYS  75   1.502  -6.383  17.089
  620    HD2  LYS  75           HD2      LYS  75   2.908  -6.211  19.032
  621    HD3  LYS  75           HD1      LYS  75   1.908  -7.646  19.242
  622    HE2  LYS  75           HE2      LYS  75   3.697  -9.114  18.769
  623    HE3  LYS  75           HE1      LYS  75   4.653  -7.846  18.003
  624    HZ1  LYS  75           HZ1      LYS  75   5.175  -6.909  20.037
  625    HZ2  LYS  75           HZ2      LYS  75   5.253  -8.575  20.358
  626    HZ3  LYS  75           HZ3      LYS  75   3.897  -7.677  20.847
  627    H    GLN  76           HN       GLN  76   1.299  -5.897  14.821
  628    HA   GLN  76           HA       GLN  76  -1.591  -5.504  15.449
  629    HB2  GLN  76           HB2      GLN  76   0.068  -4.060  16.586
  630    HB3  GLN  76           HB1      GLN  76   0.574  -3.437  15.013
  631    HG2  GLN  76           HG2      GLN  76  -1.641  -2.544  14.590
  632    HG3  GLN  76           HG1      GLN  76  -2.270  -3.306  16.048
  633   HE21  GLN  76          HE21      GLN  76  -2.707  -1.570  17.434
  634   HE22  GLN  76          HE22      GLN  76  -1.594  -0.351  17.825
  635    H    LEU  77           HN       LEU  77  -2.957  -4.349  14.065
  636    HA   LEU  77           HA       LEU  77  -2.575  -4.905  11.248
  637    HB2  LEU  77           HB2      LEU  77  -4.769  -3.825  10.979
  638    HB3  LEU  77           HB1      LEU  77  -4.783  -5.055  12.240
  639    HG   LEU  77           HG       LEU  77  -4.069  -2.379  13.294
  640   HD11  LEU  77          HD11      LEU  77  -6.355  -1.447  13.117
  641   HD12  LEU  77          HD12      LEU  77  -6.806  -2.787  12.058
  642   HD13  LEU  77          HD13      LEU  77  -5.585  -1.624  11.540
  643   HD21  LEU  77          HD21      LEU  77  -5.576  -3.001  15.051
  644   HD22  LEU  77          HD22      LEU  77  -4.747  -4.482  14.576
  645   HD23  LEU  77          HD23      LEU  77  -6.394  -4.181  14.026
  646    H    ILE  78           HN       ILE  78  -2.689  -3.284   9.565
  647    HA   ILE  78           HA       ILE  78  -1.338  -0.723  10.338
  648    HB   ILE  78           HB       ILE  78  -1.313  -2.306   7.767
  649   HG12  ILE  78          HG12      ILE  78   0.114  -3.198   9.560
  650   HG13  ILE  78          HG11      ILE  78   1.084  -2.541   8.248
  651   HG21  ILE  78          HG21      ILE  78  -0.205   0.419   8.450
  652   HG22  ILE  78          HG22      ILE  78  -1.271  -0.013   7.113
  653   HG23  ILE  78          HG23      ILE  78   0.412  -0.544   7.108
  654   HD11  ILE  78          HD11      ILE  78   0.758  -1.559  11.047
  655   HD12  ILE  78          HD12      ILE  78   0.943  -0.325   9.801
  656   HD13  ILE  78          HD13      ILE  78   2.189  -1.557  10.020
  657    H    ALA  79           HN       ALA  79  -3.984  -2.119   8.439
  658    HA   ALA  79           HA       ALA  79  -5.377   0.449   8.582
  659    HB1  ALA  79           HB1      ALA  79  -5.456   0.953   6.249
  660    HB2  ALA  79           HB2      ALA  79  -4.688  -0.572   5.826
  661    HB3  ALA  79           HB3      ALA  79  -3.755   0.684   6.637
  662    H    ILE  80           HN       ILE  80  -7.543   0.319   7.812
  663    HA   ILE  80           HA       ILE  80  -8.559  -2.429   7.194
  664    HB   ILE  80           HB       ILE  80  -9.652  -0.481   9.242
  665   HG12  ILE  80          HG12      ILE  80  -8.789  -3.366   9.536
  666   HG13  ILE  80          HG11      ILE  80  -7.716  -2.005   9.849
  667   HG21  ILE  80          HG21      ILE  80 -10.812  -2.988   8.013
  668   HG22  ILE  80          HG22      ILE  80 -11.556  -1.395   8.137
  669   HG23  ILE  80          HG23      ILE  80 -11.342  -2.380   9.582
  670   HD11  ILE  80          HD11      ILE  80  -8.863  -1.356  11.753
  671   HD12  ILE  80          HD12      ILE  80  -9.133  -3.095  11.808
  672   HD13  ILE  80          HD13      ILE  80 -10.396  -2.027  11.193
  673    H    GLY  81           HN       GLY  81 -10.138  -2.456   5.647
  674    HA2  GLY  81           HA2      GLY  81 -11.884  -0.264   5.046
  675    HA3  GLY  81           HA1      GLY  81 -10.518  -0.232   3.930
  676    H    PHE  82           HN       PHE  82 -13.238  -0.719   3.218
  677    HA   PHE  82           HA       PHE  82 -13.165  -3.590   2.358
  678    HB2  PHE  82           HB2      PHE  82 -15.580  -3.500   2.192
  679    HB3  PHE  82           HB1      PHE  82 -15.112  -2.899   3.780
  680    HD1  PHE  82           HD1      PHE  82 -16.354  -1.953   0.433
  681    HD2  PHE  82           HD2      PHE  82 -15.374  -0.553   4.375
  682    HE1  PHE  82           HE1      PHE  82 -17.529   0.181  -0.032
  683    HE2  PHE  82           HE2      PHE  82 -16.547   1.581   3.904
  684    HZ   PHE  82           HZ       PHE  82 -17.625   1.948   1.703
  685    H    ILE  83           HN       ILE  83 -13.276  -4.050   0.181
  686    HA   ILE  83           HA       ILE  83 -13.042  -1.699  -1.639
  687    HB   ILE  83           HB       ILE  83 -12.482  -4.614  -2.222
  688   HG12  ILE  83          HG12      ILE  83 -10.730  -2.379  -1.159
  689   HG13  ILE  83          HG11      ILE  83 -10.979  -3.978  -0.464
  690   HG21  ILE  83          HG21      ILE  83 -12.903  -2.934  -4.128
  691   HG22  ILE  83          HG22      ILE  83 -11.372  -3.809  -4.178
  692   HG23  ILE  83          HG23      ILE  83 -11.416  -2.143  -3.607
  693   HD11  ILE  83          HD11      ILE  83  -9.404  -3.222  -2.921
  694   HD12  ILE  83          HD12      ILE  83  -9.964  -4.875  -2.671
  695   HD13  ILE  83          HD13      ILE  83  -8.864  -4.130  -1.510
  696    H    ASP  84           HN       ASP  84 -14.795  -1.087  -2.670
  697    HA   ASP  84           HA       ASP  84 -17.121  -2.865  -2.948
  698    HB2  ASP  84           HB2      ASP  84 -17.270  -0.426  -2.281
  699    HB3  ASP  84           HB1      ASP  84 -16.809  -0.028  -3.936
  700    H    GLU  85           HN       GLU  85 -17.708  -3.863  -4.781
  701    HA   GLU  85           HA       GLU  85 -17.586  -4.672  -6.970
  702    HB2  GLU  85           HB2      GLU  85 -16.940  -1.752  -7.457
  703    HB3  GLU  85           HB1      GLU  85 -17.258  -2.916  -8.741
  704    HG2  GLU  85           HG2      GLU  85 -19.480  -3.365  -7.826
  705    HG3  GLU  85           HG1      GLU  85 -19.165  -2.272  -6.479
  706    H    ASN  86           HN       ASN  86 -15.281  -2.411  -8.080
  707    HA   ASN  86           HA       ASN  86 -13.102  -4.469  -7.893
  708    HB2  ASN  86           HB2      ASN  86 -13.814  -2.503 -10.077
  709    HB3  ASN  86           HB1      ASN  86 -12.274  -3.357 -10.028
  710   HD21  ASN  86          HD21      ASN  86 -14.112  -3.797 -12.179
  711   HD22  ASN  86          HD22      ASN  86 -14.711  -5.378 -12.056
  712    H    HIS  87           HN       HIS  87 -14.105  -1.260  -7.176
  713    HA   HIS  87           HA       HIS  87 -11.528  -0.700  -5.884
  714    HB2  HIS  87           HB2      HIS  87 -11.056   1.356  -7.097
  715    HB3  HIS  87           HB1      HIS  87 -11.159   0.029  -8.255
  716    HD1  HIS  87           HD1      HIS  87 -13.888  -0.285  -9.090
  717    HD2  HIS  87           HD2      HIS  87 -12.518   3.502  -8.010
  718    HE1  HIS  87           HE1      HIS  87 -15.473   1.382 -10.153
  719    H    ASP  88           HN       ASP  88 -12.197   2.237  -5.992
  720    HA   ASP  88           HA       ASP  88 -13.331   3.759  -4.626
  721    HB2  ASP  88           HB2      ASP  88 -15.567   1.850  -5.355
  722    HB3  ASP  88           HB1      ASP  88 -15.842   3.293  -4.381
  723    H    MET  89           HN       MET  89 -11.827   1.761  -3.353
  724    HA   MET  89           HA       MET  89 -13.348   0.614  -1.151
  725    HB2  MET  89           HB2      MET  89 -11.247  -0.233  -0.378
  726    HB3  MET  89           HB1      MET  89 -11.218  -0.340  -2.137
  727    HG2  MET  89           HG2      MET  89 -10.055   1.939  -2.117
  728    HG3  MET  89           HG1      MET  89  -9.843   1.695  -0.385
  729    HE1  MET  89           HE1      MET  89  -8.390   0.237   0.737
  730    HE2  MET  89           HE2      MET  89  -7.452  -1.103   0.082
  731    HE3  MET  89           HE3      MET  89  -9.204  -1.231   0.180
  732    H    ASP  90           HN       ASP  90 -13.476   1.325   0.938
  733    HA   ASP  90           HA       ASP  90 -12.424   4.082   1.494
  734    HB2  ASP  90           HB2      ASP  90 -14.938   3.805   1.369
  735    HB3  ASP  90           HB1      ASP  90 -14.813   2.763   2.790
  736    H    PHE  91           HN       PHE  91 -11.575   4.463   3.556
  737    HA   PHE  91           HA       PHE  91 -10.662   2.008   4.983
  738    HB2  PHE  91           HB2      PHE  91  -9.595   4.844   5.071
  739    HB3  PHE  91           HB1      PHE  91  -8.876   3.448   5.874
  740    HD1  PHE  91           HD1      PHE  91  -7.943   1.569   4.528
  741    HD2  PHE  91           HD2      PHE  91  -9.314   5.206   2.699
  742    HE1  PHE  91           HE1      PHE  91  -6.723   0.983   2.450
  743    HE2  PHE  91           HE2      PHE  91  -8.094   4.620   0.619
  744    HZ   PHE  91           HZ       PHE  91  -6.798   2.509   0.496
  745    H    LEU  92           HN       LEU  92 -12.233   1.584   6.456
  746    HA   LEU  92           HA       LEU  92 -13.739   3.570   7.907
  747    HB2  LEU  92           HB2      LEU  92 -13.185   0.697   8.699
  748    HB3  LEU  92           HB1      LEU  92 -14.538   1.695   9.235
  749    HG   LEU  92           HG       LEU  92 -14.015   0.888   6.357
  750   HD11  LEU  92          HD11      LEU  92 -16.117  -0.489   6.730
  751   HD12  LEU  92          HD12      LEU  92 -15.914  -0.185   8.456
  752   HD13  LEU  92          HD13      LEU  92 -14.680  -1.074   7.566
  753   HD21  LEU  92          HD21      LEU  92 -16.503   1.683   6.236
  754   HD22  LEU  92          HD22      LEU  92 -15.234   2.908   6.276
  755   HD23  LEU  92          HD23      LEU  92 -16.139   2.530   7.741
  756    H    TYR  93           HN       TYR  93 -10.809   1.711   8.623
  757    HA   TYR  93           HA       TYR  93 -10.187   3.692  10.751
  758    HB2  TYR  93           HB2      TYR  93 -11.336   1.655  11.768
  759    HB3  TYR  93           HB1      TYR  93  -9.929   0.722  11.259
  760    HD1  TYR  93           HD1      TYR  93 -11.147   3.402  13.468
  761    HD2  TYR  93           HD2      TYR  93  -7.747   1.055  12.300
  762    HE1  TYR  93           HE1      TYR  93  -9.913   4.202  15.462
  763    HE2  TYR  93           HE2      TYR  93  -6.509   1.857  14.295
  764    HH   TYR  93           HH       TYR  93  -7.087   4.394  15.916
  765    H    LEU  94           HN       LEU  94  -8.148   4.328  10.556
  766    HA   LEU  94           HA       LEU  94  -6.232   2.612   9.023
  767    HB2  LEU  94           HB2      LEU  94  -6.812   4.780   7.947
  768    HB3  LEU  94           HB1      LEU  94  -6.223   5.623   9.381
  769    HG   LEU  94           HG       LEU  94  -3.981   4.628   9.038
  770   HD11  LEU  94          HD11      LEU  94  -4.199   2.602   7.928
  771   HD12  LEU  94          HD12      LEU  94  -3.747   3.629   6.572
  772   HD13  LEU  94          HD13      LEU  94  -5.439   3.210   6.832
  773   HD21  LEU  94          HD21      LEU  94  -4.236   6.783   8.078
  774   HD22  LEU  94          HD22      LEU  94  -5.241   6.170   6.765
  775   HD23  LEU  94          HD23      LEU  94  -3.517   5.806   6.800
  776    H    HIS  95           HN       HIS  95  -4.432   1.956  10.073
  777    HA   HIS  95           HA       HIS  95  -3.692   3.332  12.635
  778    HB2  HIS  95           HB2      HIS  95  -4.817   1.048  12.900
  779    HB3  HIS  95           HB1      HIS  95  -3.375   0.366  12.140
  780    HD1  HIS  95           HD1      HIS  95  -1.972   3.075  13.739
  781    HD2  HIS  95           HD2      HIS  95  -3.586  -0.464  15.231
  782    HE1  HIS  95           HE1      HIS  95  -1.025   2.787  16.063
  783    H    ASN  96           HN       ASN  96  -1.855   4.380  12.114
  784    HA   ASN  96           HA       ASN  96   0.157   3.064  10.356
  785    HB2  ASN  96           HB2      ASN  96  -0.526   5.416   9.881
  786    HB3  ASN  96           HB1      ASN  96   0.084   5.884  11.469
  787   HD21  ASN  96          HD21      ASN  96   1.074   6.581   8.649
  788   HD22  ASN  96          HD22      ASN  96   2.718   6.165   8.673
  789    H    THR  97           HN       THR  97   1.245   1.642  11.631
  790    HA   THR  97           HA       THR  97   2.541   0.812  13.411
  791    HB   THR  97           HB       THR  97   4.348   2.485  14.137
  792    HG1  THR  97           HG1      THR  97   3.840   4.457  13.688
  793   HG21  THR  97          HG21      THR  97   5.464   2.389  11.944
  794   HG22  THR  97          HG22      THR  97   3.930   1.970  11.181
  795   HG23  THR  97          HG23      THR  97   4.678   0.857  12.326
  796    H    VAL  98           HN       VAL  98   2.999   3.899  14.838
  797    HA   VAL  98           HA       VAL  98   1.040   3.256  17.002
  798    HB   VAL  98           HB       VAL  98   3.430   2.726  17.603
  799   HG11  VAL  98          HG11      VAL  98   5.022   4.493  17.910
  800   HG12  VAL  98          HG12      VAL  98   3.814   5.731  17.569
  801   HG13  VAL  98          HG13      VAL  98   4.378   4.671  16.277
  802   HG21  VAL  98          HG21      VAL  98   1.529   3.571  19.215
  803   HG22  VAL  98          HG22      VAL  98   2.498   5.041  19.293
  804   HG23  VAL  98          HG23      VAL  98   3.191   3.499  19.800
  805    H    MET  99           HN       MET  99   1.118   5.135  14.597
  806    HA   MET  99           HA       MET  99   0.202   7.536  16.105
  807    HB2  MET  99           HB2      MET  99   1.383   8.959  14.315
  808    HB3  MET  99           HB1      MET  99   2.402   8.243  15.565
  809    HG2  MET  99           HG2      MET  99   3.164   6.523  14.103
  810    HG3  MET  99           HG1      MET  99   1.911   6.874  12.912
  811    HE1  MET  99           HE1      MET  99   3.386   7.639  10.613
  812    HE2  MET  99           HE2      MET  99   4.091   6.430  11.682
  813    HE3  MET  99           HE3      MET  99   5.096   7.734  11.056
  814    HA   PRO 100           HA       PRO 100  -2.672   6.050  12.710
  815    HB2  PRO 100           HB2      PRO 100  -4.639   6.890  14.801
  816    HB3  PRO 100           HB1      PRO 100  -4.596   5.405  13.825
  817    HG2  PRO 100           HG2      PRO 100  -3.933   5.365  16.401
  818    HG3  PRO 100           HG1      PRO 100  -3.051   4.384  15.214
  819    HD2  PRO 100           HD2      PRO 100  -2.223   6.978  16.494
  820    HD3  PRO 100           HD1      PRO 100  -1.242   5.540  16.136
  821    H    LEU 101           HN       LEU 101  -3.710   7.389  11.247
  822    HA   LEU 101           HA       LEU 101  -3.613  10.320  11.795
  823    HB2  LEU 101           HB2      LEU 101  -4.131   8.866   9.190
  824    HB3  LEU 101           HB1      LEU 101  -3.776  10.581   9.383
  825    HG   LEU 101           HG       LEU 101  -1.900   8.296  10.072
  826   HD11  LEU 101          HD11      LEU 101  -1.815  10.349   7.838
  827   HD12  LEU 101          HD12      LEU 101  -2.202   8.640   7.641
  828   HD13  LEU 101          HD13      LEU 101  -0.587   9.126   8.157
  829   HD21  LEU 101          HD21      LEU 101  -1.744  11.296  10.397
  830   HD22  LEU 101          HD22      LEU 101  -0.273  10.350  10.172
  831   HD23  LEU 101          HD23      LEU 101  -1.320  10.034  11.555
  832    H    LEU 102           HN       LEU 102  -5.801   8.178   9.955
  833    HA   LEU 102           HA       LEU 102  -8.070   9.957  10.407
  834    HB2  LEU 102           HB2      LEU 102  -8.051   7.123   9.330
  835    HB3  LEU 102           HB1      LEU 102  -9.341   8.307   9.136
  836    HG   LEU 102           HG       LEU 102  -6.516   8.583   8.068
  837   HD11  LEU 102          HD11      LEU 102  -7.513   8.250   5.871
  838   HD12  LEU 102          HD12      LEU 102  -9.122   8.136   6.581
  839   HD13  LEU 102          HD13      LEU 102  -7.928   6.877   6.897
  840   HD21  LEU 102          HD21      LEU 102  -7.234  10.788   8.415
  841   HD22  LEU 102          HD22      LEU 102  -8.925  10.397   8.104
  842   HD23  LEU 102          HD23      LEU 102  -7.780  10.491   6.765
  843    H    ASP 103           HN       ASP 103  -8.057   6.473  10.984
  844    HA   ASP 103           HA       ASP 103  -9.244   5.267  12.615
  845    HB2  ASP 103           HB2      ASP 103  -8.361   5.893  14.966
  846    HB3  ASP 103           HB1      ASP 103  -7.191   5.356  13.764
  847    H    GLN 104           HN       GLN 104 -11.377   6.042  12.192
  848    HA   GLN 104           HA       GLN 104 -12.367   8.117  14.125
  849    HB2  GLN 104           HB2      GLN 104 -13.392   7.350  11.382
  850    HB3  GLN 104           HB1      GLN 104 -14.235   8.435  12.491
  851    HG2  GLN 104           HG2      GLN 104 -12.308   9.947  12.523
  852    HG3  GLN 104           HG1      GLN 104 -11.414   8.858  11.465
  853   HE21  GLN 104          HE21      GLN 104 -11.545  11.186  10.267
  854   HE22  GLN 104          HE22      GLN 104 -12.808  11.311   9.139
  855    H    ARG 105           HN       ARG 105 -13.401   7.216  15.743
  856    HA   ARG 105           HA       ARG 105 -14.396   4.522  15.801
  857    HB2  ARG 105           HB2      ARG 105 -15.089   6.894  17.561
  858    HB3  ARG 105           HB1      ARG 105 -15.406   5.204  17.956
  859    HG2  ARG 105           HG2      ARG 105 -12.612   6.160  17.324
  860    HG3  ARG 105           HG1      ARG 105 -13.273   6.300  18.952
  861    HD2  ARG 105           HD2      ARG 105 -13.761   3.840  18.907
  862    HD3  ARG 105           HD1      ARG 105 -12.940   3.751  17.349
  863    HE   ARG 105           HE       ARG 105 -11.387   4.912  19.572
  864   HH11  ARG 105          HH21      ARG 105 -12.180   2.188  17.592
  865   HH12  ARG 105          HH22      ARG 105 -10.692   1.366  17.915
  866   HH21  ARG 105          HH11      ARG 105  -9.462   3.847  19.995
  867   HH22  ARG 105          HH12      ARG 105  -9.158   2.303  19.274
  868    H    TYR 106           HN       TYR 106 -15.831   7.629  15.069
  869    HA   TYR 106           HA       TYR 106 -18.580   7.001  15.202
  870    HB2  TYR 106           HB2      TYR 106 -17.158   8.693  13.122
  871    HB3  TYR 106           HB1      TYR 106 -18.879   8.765  13.493
  872    HD1  TYR 106           HD1      TYR 106 -19.643   9.569  15.724
  873    HD2  TYR 106           HD2      TYR 106 -15.522   9.755  14.529
  874    HE1  TYR 106           HE1      TYR 106 -19.187  11.186  17.548
  875    HE2  TYR 106           HE2      TYR 106 -15.065  11.372  16.355
  876    HH   TYR 106           HH       TYR 106 -17.139  11.890  18.910
  877    H    LEU 107           HN       LEU 107 -16.304   6.561  12.521
  878    HA   LEU 107           HA       LEU 107 -18.183   5.383  10.700
  879    HB2  LEU 107           HB2      LEU 107 -15.191   5.434  10.949
  880    HB3  LEU 107           HB1      LEU 107 -15.943   4.406   9.727
  881    HG   LEU 107           HG       LEU 107 -15.325   6.717   8.913
  882   HD11  LEU 107          HD11      LEU 107 -18.315   6.613   8.746
  883   HD12  LEU 107          HD12      LEU 107 -17.434   5.196   8.170
  884   HD13  LEU 107          HD13      LEU 107 -17.116   6.779   7.462
  885   HD21  LEU 107          HD21      LEU 107 -16.480   8.644   9.712
  886   HD22  LEU 107          HD22      LEU 107 -16.005   7.765  11.166
  887   HD23  LEU 107          HD23      LEU 107 -17.664   7.666  10.579
  888    H    LEU 108           HN       LEU 108 -15.942   3.974  13.062
  889    HA   LEU 108           HA       LEU 108 -16.487   1.238  12.393
  890    HB2  LEU 108           HB2      LEU 108 -15.563   2.537  14.961
  891    HB3  LEU 108           HB1      LEU 108 -15.675   0.788  14.760
  892    HG   LEU 108           HG       LEU 108 -14.050   2.612  12.959
  893   HD11  LEU 108          HD11      LEU 108 -13.299   1.036  15.423
  894   HD12  LEU 108          HD12      LEU 108 -12.923   2.715  15.035
  895   HD13  LEU 108          HD13      LEU 108 -12.106   1.407  14.180
  896   HD21  LEU 108          HD21      LEU 108 -14.575  -0.347  13.062
  897   HD22  LEU 108          HD22      LEU 108 -12.960   0.186  12.590
  898   HD23  LEU 108          HD23      LEU 108 -14.364   0.708  11.663
  899    H    THR 109           HN       THR 109 -18.002   3.460  14.695
  900    HA   THR 109           HA       THR 109 -20.055   1.396  15.344
  901    HB   THR 109           HB       THR 109 -20.772   3.158  17.047
  902    HG1  THR 109           HG1      THR 109 -19.126   4.612  15.641
  903   HG21  THR 109          HG21      THR 109 -18.025   1.904  17.067
  904   HG22  THR 109          HG22      THR 109 -19.497   1.309  17.834
  905   HG23  THR 109          HG23      THR 109 -18.689   2.740  18.470
  906    H    GLY 110           HN       GLY 110 -19.606   3.558  12.985
  907    HA2  GLY 110           HA2      GLY 110 -21.120   4.397  11.391
  908    HA3  GLY 110           HA1      GLY 110 -22.436   3.693  12.325
  909    H    GLY 111           HN       GLY 111 -23.086   5.994  11.334
  910    HA2  GLY 111           HA2      GLY 111 -22.281   8.309  12.902
  911    HA3  GLY 111           HA1      GLY 111 -23.595   8.259  11.727
  912    H    GLN 112           HN       GLN 112 -23.274   9.165  14.677
  913    HA   GLN 112           HA       GLN 112 -25.461   7.566  15.910
  914    HB2  GLN 112           HB2      GLN 112 -23.394   8.068  17.228
  915    HB3  GLN 112           HB1      GLN 112 -23.785   9.783  17.117
  916    HG2  GLN 112           HG2      GLN 112 -24.600   8.925  19.247
  917    HG3  GLN 112           HG1      GLN 112 -25.982   9.309  18.222
  918   HE21  GLN 112          HE21      GLN 112 -27.464   7.721  18.996
  919   HE22  GLN 112          HE22      GLN 112 -27.179   6.052  18.887
  920    H    LEU 113           HN       LEU 113 -27.474   8.336  16.082
  921    HA   LEU 113           HA       LEU 113 -28.225  10.808  14.755
  922    HB2  LEU 113           HB2      LEU 113 -29.886   8.957  16.482
  923    HB3  LEU 113           HB1      LEU 113 -30.509  10.173  15.365
  924    HG   LEU 113           HG       LEU 113 -28.805   7.785  14.583
  925   HD11  LEU 113          HD11      LEU 113 -30.905   7.007  13.479
  926   HD12  LEU 113          HD12      LEU 113 -31.765   8.351  14.228
  927   HD13  LEU 113          HD13      LEU 113 -31.054   7.088  15.235
  928   HD21  LEU 113          HD21      LEU 113 -29.748   8.592  12.250
  929   HD22  LEU 113          HD22      LEU 113 -28.339   9.392  12.941
  930   HD23  LEU 113          HD23      LEU 113 -29.929  10.142  13.076
  931    H    GLU 114           HN       GLU 114 -28.787  12.728  15.640
  932    HA   GLU 114           HA       GLU 114 -28.042  13.214  18.446
  933    HB2  GLU 114           HB2      GLU 114 -28.961  15.069  16.234
  934    HB3  GLU 114           HB1      GLU 114 -28.439  15.601  17.832
  935    HG2  GLU 114           HG2      GLU 114 -26.473  15.812  16.568
  936    HG3  GLU 114           HG1      GLU 114 -26.270  14.227  17.315
  937    H    HIS 115           HN       HIS 115 -29.704  15.321  19.074
  938    HA   HIS 115           HA       HIS 115 -31.723  15.728  20.174
  939    HB2  HIS 115           HB2      HIS 115 -32.444  15.770  17.730
  940    HB3  HIS 115           HB1      HIS 115 -32.988  14.108  17.947
  941    HD1  HIS 115           HD1      HIS 115 -34.990  13.713  19.596
  942    HD2  HIS 115           HD2      HIS 115 -34.064  17.729  18.974
  943    HE1  HIS 115           HE1      HIS 115 -36.931  15.046  20.523
  944    H    HIS 116           HN       HIS 116 -30.188  13.149  20.577
  945    HA   HIS 116           HA       HIS 116 -32.182  11.132  21.252
  946    HB2  HIS 116           HB2      HIS 116 -30.298   9.902  22.206
  947    HB3  HIS 116           HB1      HIS 116 -29.811  10.585  20.655
  948    HD1  HIS 116           HD1      HIS 116 -28.176  12.640  20.708
  949    HD2  HIS 116           HD2      HIS 116 -28.942  10.967  24.450
  950    HE1  HIS 116           HE1      HIS 116 -26.439  13.591  22.288
  951    H    HIS 117           HN       HIS 117 -31.977  14.013  22.509
  952    HA   HIS 117           HA       HIS 117 -31.509  13.707  25.314
  953    HB2  HIS 117           HB2      HIS 117 -31.745  15.911  24.176
  954    HB3  HIS 117           HB1      HIS 117 -33.458  15.572  23.932
  955    HD1  HIS 117           HD1      HIS 117 -35.018  15.703  25.990
  956    HD2  HIS 117           HD2      HIS 117 -31.020  16.470  26.888
  957    HE1  HIS 117           HE1      HIS 117 -34.978  16.620  28.351
  958    H    HIS 118           HN       HIS 118 -34.459  13.365  23.365
  959    HA   HIS 118           HA       HIS 118 -35.561  11.538  25.391
  960    HB2  HIS 118           HB2      HIS 118 -37.673  12.817  25.631
  961    HB3  HIS 118           HB1      HIS 118 -36.289  13.699  26.272
  962    HD1  HIS 118           HD1      HIS 118 -35.229  15.539  24.546
  963    HD2  HIS 118           HD2      HIS 118 -39.096  14.222  23.711
  964    HE1  HIS 118           HE1      HIS 118 -36.241  17.240  22.963
  965    H    HIS 119           HN       HIS 119 -37.301  10.288  24.562
  966    HA   HIS 119           HA       HIS 119 -38.237  10.743  21.806
  967    HB2  HIS 119           HB2      HIS 119 -37.490   8.500  21.042
  968    HB3  HIS 119           HB1      HIS 119 -36.117   9.530  21.443
  969    HD1  HIS 119           HD1      HIS 119 -34.752   8.942  23.576
  970    HD2  HIS 119           HD2      HIS 119 -37.890   6.302  22.821
  971    HE1  HIS 119           HE1      HIS 119 -34.379   6.936  25.077
  972    H    HIS 120           HN       HIS 120 -38.226   8.892  24.789
  973    HA   HIS 120           HA       HIS 120 -40.606   7.332  24.148
  974    HB2  HIS 120           HB2      HIS 120 -38.829   6.662  25.816
  975    HB3  HIS 120           HB1      HIS 120 -39.439   7.931  26.877
  976    HD1  HIS 120           HD1      HIS 120 -41.656   7.511  28.089
  977    HD2  HIS 120           HD2      HIS 120 -40.652   4.465  25.426
  978    HE1  HIS 120           HE1      HIS 120 -43.280   5.616  28.524
  Start of MODEL   15
    1    H1   MET   1           HT1      MET   1 -12.247  -2.872  21.507
    2    H2   MET   1           HT2      MET   1 -13.478  -4.007  21.217
    3    H3   MET   1           HT3      MET   1 -12.632  -3.317  19.916
    4    HA   MET   1           HA       MET   1 -10.556  -4.333  20.968
    5    HB2  MET   1           HB2      MET   1 -12.792  -5.872  22.307
    6    HB3  MET   1           HB1      MET   1 -11.128  -6.445  22.214
    7    HG2  MET   1           HG2      MET   1 -10.367  -4.385  23.366
    8    HG3  MET   1           HG1      MET   1 -12.043  -3.856  23.503
    9    HE1  MET   1           HE1      MET   1 -13.823  -6.264  24.352
   10    HE2  MET   1           HE2      MET   1 -13.710  -4.604  24.932
   11    HE3  MET   1           HE3      MET   1 -13.682  -5.936  26.083
   12    H    THR   2           HN       THR   2  -9.991  -6.582  20.184
   13    HA   THR   2           HA       THR   2  -9.771  -7.846  18.208
   14    HB   THR   2           HB       THR   2 -11.775  -9.323  17.865
   15    HG1  THR   2           HG1      THR   2 -12.811  -7.721  19.962
   16   HG21  THR   2          HG21      THR   2 -11.553 -10.430  20.011
   17   HG22  THR   2          HG22      THR   2 -10.996  -8.939  20.768
   18   HG23  THR   2          HG23      THR   2  -9.984  -9.752  19.574
   19    H    LEU   3           HN       LEU   3  -9.501  -6.075  16.758
   20    HA   LEU   3           HA       LEU   3 -11.633  -4.689  15.460
   21    HB2  LEU   3           HB2      LEU   3  -8.739  -5.206  14.800
   22    HB3  LEU   3           HB1      LEU   3  -9.775  -4.369  13.646
   23    HG   LEU   3           HG       LEU   3  -8.510  -2.840  15.202
   24   HD11  LEU   3          HD11      LEU   3 -11.402  -2.439  15.873
   25   HD12  LEU   3          HD12      LEU   3 -10.966  -2.479  14.164
   26   HD13  LEU   3          HD13      LEU   3 -10.222  -1.296  15.237
   27   HD21  LEU   3          HD21      LEU   3 -10.435  -3.830  17.315
   28   HD22  LEU   3          HD22      LEU   3  -9.052  -2.757  17.528
   29   HD23  LEU   3          HD23      LEU   3  -8.797  -4.467  17.165
   30    H    GLU   4           HN       GLU   4  -9.870  -7.625  14.626
   31    HA   GLU   4           HA       GLU   4 -10.809  -8.096  12.040
   32    HB2  GLU   4           HB2      GLU   4 -10.819 -10.639  13.005
   33    HB3  GLU   4           HB1      GLU   4  -9.329  -9.765  12.651
   34    HG2  GLU   4           HG2      GLU   4  -8.985  -9.190  14.925
   35    HG3  GLU   4           HG1      GLU   4 -10.642  -9.591  15.367
   36    H    LEU   5           HN       LEU   5 -12.347  -9.294  15.033
   37    HA   LEU   5           HA       LEU   5 -14.696 -10.280  13.744
   38    HB2  LEU   5           HB2      LEU   5 -13.990  -9.540  16.576
   39    HB3  LEU   5           HB1      LEU   5 -15.660  -9.937  16.176
   40    HG   LEU   5           HG       LEU   5 -14.894 -12.098  15.224
   41   HD11  LEU   5          HD11      LEU   5 -12.649 -11.559  14.552
   42   HD12  LEU   5          HD12      LEU   5 -12.531 -12.795  15.803
   43   HD13  LEU   5          HD13      LEU   5 -12.205 -11.108  16.198
   44   HD21  LEU   5          HD21      LEU   5 -14.365 -13.169  17.367
   45   HD22  LEU   5          HD22      LEU   5 -15.591 -11.925  17.606
   46   HD23  LEU   5          HD23      LEU   5 -13.916 -11.609  18.057
   47    H    GLN   6           HN       GLN   6 -13.908  -7.148  15.167
   48    HA   GLN   6           HA       GLN   6 -16.515  -6.011  15.024
   49    HB2  GLN   6           HB2      GLN   6 -14.550  -5.026  16.257
   50    HB3  GLN   6           HB1      GLN   6 -13.867  -4.571  14.698
   51    HG2  GLN   6           HG2      GLN   6 -15.050  -2.656  15.621
   52    HG3  GLN   6           HG1      GLN   6 -15.942  -3.255  14.223
   53   HE21  GLN   6          HE21      GLN   6 -18.080  -2.704  14.875
   54   HE22  GLN   6          HE22      GLN   6 -18.815  -3.323  16.273
   55    H    LEU   7           HN       LEU   7 -13.891  -6.223  12.660
   56    HA   LEU   7           HA       LEU   7 -15.043  -4.513  10.693
   57    HB2  LEU   7           HB2      LEU   7 -12.703  -5.267  10.551
   58    HB3  LEU   7           HB1      LEU   7 -13.240  -6.931  10.339
   59    HG   LEU   7           HG       LEU   7 -14.338  -6.337   8.221
   60   HD11  LEU   7          HD11      LEU   7 -13.555  -3.561   9.081
   61   HD12  LEU   7          HD12      LEU   7 -15.080  -4.132   8.407
   62   HD13  LEU   7          HD13      LEU   7 -13.679  -3.928   7.360
   63   HD21  LEU   7          HD21      LEU   7 -11.457  -5.450   8.509
   64   HD22  LEU   7          HD22      LEU   7 -12.261  -5.614   6.948
   65   HD23  LEU   7          HD23      LEU   7 -12.054  -7.024   7.984
   66    H    LYS   8           HN       LYS   8 -15.289  -8.015  11.199
   67    HA   LYS   8           HA       LYS   8 -16.982  -8.539   8.949
   68    HB2  LYS   8           HB2      LYS   8 -16.409  -9.982  11.525
   69    HB3  LYS   8           HB1      LYS   8 -17.651 -10.586  10.431
   70    HG2  LYS   8           HG2      LYS   8 -15.735 -11.747   9.718
   71    HG3  LYS   8           HG1      LYS   8 -15.780 -10.387   8.598
   72    HD2  LYS   8           HD2      LYS   8 -14.188  -9.163  10.064
   73    HD3  LYS   8           HD1      LYS   8 -14.116 -10.569  11.125
   74    HE2  LYS   8           HE2      LYS   8 -13.372 -10.562   8.188
   75    HE3  LYS   8           HE1      LYS   8 -12.224 -10.527   9.527
   76    HZ1  LYS   8           HZ1      LYS   8 -12.415 -12.704   9.773
   77    HZ2  LYS   8           HZ2      LYS   8 -13.361 -12.754   8.362
   78    HZ3  LYS   8           HZ3      LYS   8 -14.105 -12.613   9.883
   79    H    HIS   9           HN       HIS   9 -17.650  -7.716  12.310
   80    HA   HIS   9           HA       HIS   9 -20.508  -7.993  12.117
   81    HB2  HIS   9           HB2      HIS   9 -19.281  -7.964  14.273
   82    HB3  HIS   9           HB1      HIS   9 -18.861  -6.275  13.992
   83    HD1  HIS   9           HD1      HIS   9 -21.950  -8.462  14.385
   84    HD2  HIS   9           HD2      HIS   9 -20.812  -4.475  14.813
   85    HE1  HIS   9           HE1      HIS   9 -23.939  -7.253  15.380
   86    H    TYR  10           HN       TYR  10 -18.317  -5.210  11.844
   87    HA   TYR  10           HA       TYR  10 -20.345  -3.230  11.451
   88    HB2  TYR  10           HB2      TYR  10 -18.053  -2.621  12.041
   89    HB3  TYR  10           HB1      TYR  10 -17.459  -3.301  10.526
   90    HD1  TYR  10           HD1      TYR  10 -19.837  -0.747  11.868
   91    HD2  TYR  10           HD2      TYR  10 -17.328  -1.948   8.597
   92    HE1  TYR  10           HE1      TYR  10 -20.277   1.415  10.738
   93    HE2  TYR  10           HE2      TYR  10 -17.774   0.211   7.464
   94    HH   TYR  10           HH       TYR  10 -19.831   2.696   8.986
   95    H    ILE  11           HN       ILE  11 -18.300  -4.933   9.071
   96    HA   ILE  11           HA       ILE  11 -19.571  -3.764   6.782
   97    HB   ILE  11           HB       ILE  11 -17.298  -4.900   6.848
   98   HG12  ILE  11          HG12      ILE  11 -19.156  -6.046   4.749
   99   HG13  ILE  11          HG11      ILE  11 -18.630  -4.363   4.744
  100   HG21  ILE  11          HG21      ILE  11 -18.338  -6.933   8.076
  101   HG22  ILE  11          HG22      ILE  11 -17.127  -7.256   6.837
  102   HG23  ILE  11          HG23      ILE  11 -18.842  -7.472   6.477
  103   HD11  ILE  11          HD11      ILE  11 -17.248  -6.018   3.343
  104   HD12  ILE  11          HD12      ILE  11 -16.648  -6.635   4.882
  105   HD13  ILE  11          HD13      ILE  11 -16.363  -4.953   4.434
  106    H    THR  12           HN       THR  12 -20.081  -6.834   8.488
  107    HA   THR  12           HA       THR  12 -21.999  -7.943   6.696
  108    HB   THR  12           HB       THR  12 -21.684  -8.319   9.685
  109    HG1  THR  12           HG1      THR  12 -20.920 -10.389   8.243
  110   HG21  THR  12          HG21      THR  12 -22.841 -10.521   9.179
  111   HG22  THR  12          HG22      THR  12 -23.275  -9.839   7.618
  112   HG23  THR  12          HG23      THR  12 -23.869  -9.093   9.100
  113    H    ASN  13           HN       ASN  13 -22.475  -5.978   9.633
  114    HA   ASN  13           HA       ASN  13 -25.348  -5.983   9.465
  115    HB2  ASN  13           HB2      ASN  13 -23.392  -4.150  10.868
  116    HB3  ASN  13           HB1      ASN  13 -25.140  -3.995  11.024
  117   HD21  ASN  13          HD21      ASN  13 -24.888  -7.215  10.645
  118   HD22  ASN  13          HD22      ASN  13 -24.659  -7.705  12.253
  119    H    LEU  14           HN       LEU  14 -22.853  -3.851   8.186
  120    HA   LEU  14           HA       LEU  14 -24.532  -1.702   7.415
  121    HB2  LEU  14           HB2      LEU  14 -22.094  -1.487   7.393
  122    HB3  LEU  14           HB1      LEU  14 -21.975  -2.713   6.133
  123    HG   LEU  14           HG       LEU  14 -23.173  -1.268   4.556
  124   HD11  LEU  14          HD11      LEU  14 -24.728  -0.048   5.818
  125   HD12  LEU  14          HD12      LEU  14 -23.534   1.186   5.423
  126   HD13  LEU  14          HD13      LEU  14 -23.532   0.434   7.019
  127   HD21  LEU  14          HD21      LEU  14 -21.001   0.285   6.000
  128   HD22  LEU  14          HD22      LEU  14 -21.511   0.511   4.327
  129   HD23  LEU  14          HD23      LEU  14 -20.712  -0.987   4.811
  130    H    PHE  15           HN       PHE  15 -23.609  -4.634   5.635
  131    HA   PHE  15           HA       PHE  15 -25.354  -3.843   3.372
  132    HB2  PHE  15           HB2      PHE  15 -23.395  -6.099   3.828
  133    HB3  PHE  15           HB1      PHE  15 -24.453  -6.050   2.418
  134    HD1  PHE  15           HD1      PHE  15 -24.411  -3.939   0.955
  135    HD2  PHE  15           HD2      PHE  15 -21.391  -4.838   3.874
  136    HE1  PHE  15           HE1      PHE  15 -22.864  -2.352  -0.157
  137    HE2  PHE  15           HE2      PHE  15 -19.845  -3.251   2.762
  138    HZ   PHE  15           HZ       PHE  15 -20.582  -2.008   0.746
  139    H    ASN  16           HN       ASN  16 -26.036  -4.980   6.255
  140    HA   ASN  16           HA       ASN  16 -27.717  -6.319   7.171
  141    HB2  ASN  16           HB2      ASN  16 -28.990  -4.815   5.537
  142    HB3  ASN  16           HB1      ASN  16 -29.000  -6.189   4.433
  143   HD21  ASN  16          HD21      ASN  16 -31.283  -6.629   4.601
  144   HD22  ASN  16          HD22      ASN  16 -32.004  -7.161   6.042
  145    H    LEU  17           HN       LEU  17 -25.460  -7.677   6.063
  146    HA   LEU  17           HA       LEU  17 -26.568 -10.064   4.725
  147    HB2  LEU  17           HB2      LEU  17 -23.746  -9.247   5.460
  148    HB3  LEU  17           HB1      LEU  17 -24.135 -10.788   4.695
  149    HG   LEU  17           HG       LEU  17 -24.873  -8.079   3.557
  150   HD11  LEU  17          HD11      LEU  17 -22.467  -8.248   3.539
  151   HD12  LEU  17          HD12      LEU  17 -23.030  -8.601   1.905
  152   HD13  LEU  17          HD13      LEU  17 -22.538  -9.917   2.970
  153   HD21  LEU  17          HD21      LEU  17 -24.962  -9.676   1.435
  154   HD22  LEU  17          HD22      LEU  17 -26.338  -9.581   2.526
  155   HD23  LEU  17          HD23      LEU  17 -25.213 -10.933   2.649
  156    HA   PRO  18           HA       PRO  18 -26.999 -12.377   8.465
  157    HB2  PRO  18           HB2      PRO  18 -26.504 -14.929   7.552
  158    HB3  PRO  18           HB1      PRO  18 -28.006 -14.042   7.220
  159    HG2  PRO  18           HG2      PRO  18 -25.598 -14.385   5.483
  160    HG3  PRO  18           HG1      PRO  18 -27.313 -14.493   5.056
  161    HD2  PRO  18           HD2      PRO  18 -25.862 -12.275   4.532
  162    HD3  PRO  18           HD1      PRO  18 -27.577 -12.176   4.979
  163    H    ARG  19           HN       ARG  19 -25.761 -13.084  10.165
  164    HA   ARG  19           HA       ARG  19 -22.834 -12.982   9.859
  165    HB2  ARG  19           HB2      ARG  19 -24.683 -13.256  12.242
  166    HB3  ARG  19           HB1      ARG  19 -22.926 -13.327  12.386
  167    HG2  ARG  19           HG2      ARG  19 -22.725 -11.095  11.413
  168    HG3  ARG  19           HG1      ARG  19 -24.469 -11.018  11.165
  169    HD2  ARG  19           HD2      ARG  19 -23.185 -11.390  13.881
  170    HD3  ARG  19           HD1      ARG  19 -23.635  -9.814  13.231
  171    HE   ARG  19           HE       ARG  19 -25.990 -11.089  13.004
  172   HH11  ARG  19          HH21      ARG  19 -23.658 -11.104  15.566
  173   HH12  ARG  19          HH22      ARG  19 -24.836 -11.406  16.797
  174   HH21  ARG  19          HH11      ARG  19 -27.516 -11.475  14.606
  175   HH22  ARG  19          HH12      ARG  19 -27.011 -11.616  16.258
  176    H    ASP  20           HN       ASP  20 -25.249 -15.346   9.734
  177    HA   ASP  20           HA       ASP  20 -23.711 -17.532  10.919
  178    HB2  ASP  20           HB2      ASP  20 -26.224 -17.466   9.222
  179    HB3  ASP  20           HB1      ASP  20 -25.542 -18.946   9.898
  180    H    GLU  21           HN       GLU  21 -23.295 -15.782   8.182
  181    HA   GLU  21           HA       GLU  21 -22.673 -17.992   6.341
  182    HB2  GLU  21           HB2      GLU  21 -23.629 -15.816   5.550
  183    HB3  GLU  21           HB1      GLU  21 -22.130 -15.027   6.038
  184    HG2  GLU  21           HG2      GLU  21 -20.847 -16.370   4.484
  185    HG3  GLU  21           HG1      GLU  21 -22.267 -17.333   4.080
  186    H    LYS  22           HN       LYS  22 -20.819 -19.065   6.550
  187    HA   LYS  22           HA       LYS  22 -18.602 -18.112   8.139
  188    HB2  LYS  22           HB2      LYS  22 -19.191 -20.517   7.886
  189    HB3  LYS  22           HB1      LYS  22 -18.694 -20.434   6.195
  190    HG2  LYS  22           HG2      LYS  22 -16.420 -19.827   6.859
  191    HG3  LYS  22           HG1      LYS  22 -16.899 -19.797   8.556
  192    HD2  LYS  22           HD2      LYS  22 -17.484 -22.201   8.425
  193    HD3  LYS  22           HD1      LYS  22 -16.964 -22.226   6.740
  194    HE2  LYS  22           HE2      LYS  22 -15.172 -21.439   9.055
  195    HE3  LYS  22           HE1      LYS  22 -15.211 -23.050   8.340
  196    HZ1  LYS  22           HZ1      LYS  22 -14.530 -22.163   6.249
  197    HZ2  LYS  22           HZ2      LYS  22 -13.451 -21.594   7.432
  198    HZ3  LYS  22           HZ3      LYS  22 -14.656 -20.567   6.813
  199    H    TRP  23           HN       TRP  23 -16.737 -17.157   7.503
  200    HA   TRP  23           HA       TRP  23 -16.547 -16.271   4.664
  201    HB2  TRP  23           HB2      TRP  23 -15.345 -15.281   7.253
  202    HB3  TRP  23           HB1      TRP  23 -14.711 -14.760   5.694
  203    HD1  TRP  23           HD1      TRP  23 -16.718 -13.777   3.964
  204    HE1  TRP  23           HE1      TRP  23 -18.620 -12.142   4.568
  205    HE3  TRP  23           HE3      TRP  23 -16.828 -14.399   9.025
  206    HZ2  TRP  23           HZ2      TRP  23 -20.001 -11.220   6.899
  207    HZ3  TRP  23           HZ3      TRP  23 -18.439 -13.128  10.415
  208    HH2  TRP  23           HH2      TRP  23 -20.025 -11.543   9.360
  209    H    GLU  24           HN       GLU  24 -14.534 -16.407   3.562
  210    HA   GLU  24           HA       GLU  24 -12.787 -18.660   4.488
  211    HB2  GLU  24           HB2      GLU  24 -13.396 -17.593   1.719
  212    HB3  GLU  24           HB1      GLU  24 -12.160 -18.806   2.052
  213    HG2  GLU  24           HG2      GLU  24 -13.847 -20.305   3.003
  214    HG3  GLU  24           HG1      GLU  24 -15.096 -19.084   2.765
  215    H    CYS  25           HN       CYS  25 -10.949 -17.934   5.344
  216    HA   CYS  25           HA       CYS  25  -9.941 -15.249   4.802
  217    HB2  CYS  25           HB2      CYS  25  -8.337 -15.697   6.512
  218    HB3  CYS  25           HB1      CYS  25  -9.836 -16.459   7.041
  219    HG   CYS  25           HG       CYS  25  -7.911 -18.223   7.288
  220    H    GLU  26           HN       GLU  26  -8.114 -14.696   3.684
  221    HA   GLU  26           HA       GLU  26  -6.501 -16.835   2.392
  222    HB2  GLU  26           HB2      GLU  26  -8.288 -16.166   0.784
  223    HB3  GLU  26           HB1      GLU  26  -7.709 -14.502   0.876
  224    HG2  GLU  26           HG2      GLU  26  -5.509 -15.198   0.051
  225    HG3  GLU  26           HG1      GLU  26  -6.040 -16.880   0.011
  226    H    SER  27           HN       SER  27  -4.746 -16.274   3.652
  227    HA   SER  27           HA       SER  27  -3.883 -13.510   3.960
  228    HB2  SER  27           HB2      SER  27  -2.314 -16.005   4.604
  229    HB3  SER  27           HB1      SER  27  -2.104 -14.398   5.293
  230    HG   SER  27           HG       SER  27  -4.374 -16.094   5.551
  231    H    ILE  28           HN       ILE  28  -2.432 -12.441   2.776
  232    HA   ILE  28           HA       ILE  28  -0.519 -13.842   1.042
  233    HB   ILE  28           HB       ILE  28  -2.597 -13.655  -0.344
  234   HG12  ILE  28          HG12      ILE  28  -0.384 -11.813  -1.293
  235   HG13  ILE  28          HG11      ILE  28  -0.241 -13.569  -1.273
  236   HG21  ILE  28          HG21      ILE  28  -2.101 -10.670  -0.218
  237   HG22  ILE  28          HG22      ILE  28  -3.317 -11.479   0.771
  238   HG23  ILE  28          HG23      ILE  28  -3.449 -11.508  -0.987
  239   HD11  ILE  28          HD11      ILE  28  -0.971 -12.669  -3.492
  240   HD12  ILE  28          HD12      ILE  28  -2.433 -12.056  -2.719
  241   HD13  ILE  28          HD13      ILE  28  -2.132 -13.792  -2.784
  242    H    GLU  29           HN       GLU  29   1.295 -12.591   0.695
  243    HA   GLU  29           HA       GLU  29   1.406 -10.013   2.162
  244    HB2  GLU  29           HB2      GLU  29   3.550 -11.821   1.022
  245    HB3  GLU  29           HB1      GLU  29   3.889 -10.274   1.801
  246    HG2  GLU  29           HG2      GLU  29   2.802 -11.048   3.861
  247    HG3  GLU  29           HG1      GLU  29   2.402 -12.583   3.090
  248    H    GLU  30           HN       GLU  30   1.310  -8.138   1.101
  249    HA   GLU  30           HA       GLU  30   2.304  -7.982  -1.708
  250    HB2  GLU  30           HB2      GLU  30  -0.426  -7.098  -0.746
  251    HB3  GLU  30           HB1      GLU  30   0.270  -6.630  -2.297
  252    HG2  GLU  30           HG2      GLU  30   0.472  -9.006  -2.928
  253    HG3  GLU  30           HG1      GLU  30  -0.221  -9.475  -1.376
  254    H    VAL  31           HN       VAL  31   2.694  -5.782  -2.401
  255    HA   VAL  31           HA       VAL  31   3.955  -4.172  -0.371
  256    HB   VAL  31           HB       VAL  31   3.244  -3.385  -3.211
  257   HG11  VAL  31          HG11      VAL  31   5.158  -1.855  -2.961
  258   HG12  VAL  31          HG12      VAL  31   5.403  -2.421  -1.308
  259   HG13  VAL  31          HG13      VAL  31   3.940  -1.529  -1.727
  260   HG21  VAL  31          HG21      VAL  31   5.719  -4.762  -2.109
  261   HG22  VAL  31          HG22      VAL  31   5.525  -4.187  -3.765
  262   HG23  VAL  31          HG23      VAL  31   4.516  -5.502  -3.163
  263    H    ALA  32           HN       ALA  32   3.222  -2.400   0.685
  264    HA   ALA  32           HA       ALA  32   0.468  -1.926   1.072
  265    HB1  ALA  32           HB1      ALA  32   2.496  -1.151   2.479
  266    HB2  ALA  32           HB2      ALA  32   1.127  -0.044   2.358
  267    HB3  ALA  32           HB3      ALA  32   2.571   0.222   1.378
  268    H    ASP  33           HN       ASP  33   2.761  -0.312  -1.100
  269    HA   ASP  33           HA       ASP  33   0.999   1.736  -2.025
  270    HB2  ASP  33           HB2      ASP  33   3.469   0.402  -3.105
  271    HB3  ASP  33           HB1      ASP  33   2.572   1.496  -4.155
  272    H    ASP  34           HN       ASP  34   1.498  -1.600  -3.095
  273    HA   ASP  34           HA       ASP  34  -0.063  -1.421  -5.493
  274    HB2  ASP  34           HB2      ASP  34   0.891  -3.659  -3.731
  275    HB3  ASP  34           HB1      ASP  34  -0.291  -4.017  -4.988
  276    H    ILE  35           HN       ILE  35  -0.961  -2.435  -2.185
  277    HA   ILE  35           HA       ILE  35  -3.796  -2.624  -3.061
  278    HB   ILE  35           HB       ILE  35  -2.847  -4.445  -1.664
  279   HG12  ILE  35          HG12      ILE  35  -4.903  -2.844  -0.120
  280   HG13  ILE  35          HG11      ILE  35  -5.287  -3.734  -1.592
  281   HG21  ILE  35          HG21      ILE  35  -2.714  -2.362   0.533
  282   HG22  ILE  35          HG22      ILE  35  -1.303  -2.919  -0.368
  283   HG23  ILE  35          HG23      ILE  35  -2.216  -4.051   0.628
  284   HD11  ILE  35          HD11      ILE  35  -5.803  -5.157   0.295
  285   HD12  ILE  35          HD12      ILE  35  -4.207  -4.882   0.994
  286   HD13  ILE  35          HD13      ILE  35  -4.368  -5.805  -0.502
  287    H    LEU  36           HN       LEU  36  -1.660  -0.408  -1.550
  288    HA   LEU  36           HA       LEU  36  -3.993   1.178  -0.606
  289    HB2  LEU  36           HB2      LEU  36  -1.908   0.241   0.971
  290    HB3  LEU  36           HB1      LEU  36  -1.416   1.897   0.617
  291    HG   LEU  36           HG       LEU  36  -2.767   1.892   2.624
  292   HD11  LEU  36          HD11      LEU  36  -4.062   3.707   2.066
  293   HD12  LEU  36          HD12      LEU  36  -4.788   2.909   0.678
  294   HD13  LEU  36          HD13      LEU  36  -3.165   3.587   0.552
  295   HD21  LEU  36          HD21      LEU  36  -4.079  -0.285   1.575
  296   HD22  LEU  36          HD22      LEU  36  -5.278   0.981   1.307
  297   HD23  LEU  36          HD23      LEU  36  -4.682   0.665   2.933
  298    HA   PRO  37           HA       PRO  37  -2.425   3.547  -4.185
  299    HB2  PRO  37           HB2      PRO  37  -4.562   5.352  -3.098
  300    HB3  PRO  37           HB1      PRO  37  -4.233   4.881  -4.778
  301    HG2  PRO  37           HG2      PRO  37  -6.246   3.796  -3.407
  302    HG3  PRO  37           HG1      PRO  37  -5.286   2.838  -4.550
  303    HD2  PRO  37           HD2      PRO  37  -5.261   2.799  -1.571
  304    HD3  PRO  37           HD1      PRO  37  -4.900   1.488  -2.716
  305    H    ASP  38           HN       ASP  38  -1.426   5.671  -4.392
  306    HA   ASP  38           HA       ASP  38   0.222   6.395  -2.173
  307    HB2  ASP  38           HB2      ASP  38  -0.438   7.805  -4.765
  308    HB3  ASP  38           HB1      ASP  38   0.746   8.426  -3.615
  309    H    GLN  39           HN       GLN  39  -2.967   7.248  -3.053
  310    HA   GLN  39           HA       GLN  39  -3.402   9.821  -2.163
  311    HB2  GLN  39           HB2      GLN  39  -5.161   8.224  -2.976
  312    HB3  GLN  39           HB1      GLN  39  -5.121   7.447  -1.395
  313    HG2  GLN  39           HG2      GLN  39  -6.957   9.042  -1.432
  314    HG3  GLN  39           HG1      GLN  39  -5.703   9.650  -0.350
  315   HE21  GLN  39          HE21      GLN  39  -6.028  11.911  -0.653
  316   HE22  GLN  39          HE22      GLN  39  -5.843  12.683  -2.152
  317    H    TYR  40           HN       TYR  40  -2.780   6.983  -0.161
  318    HA   TYR  40           HA       TYR  40  -2.633   8.781   2.244
  319    HB2  TYR  40           HB2      TYR  40  -3.598   5.942   1.933
  320    HB3  TYR  40           HB1      TYR  40  -3.051   6.547   3.496
  321    HD1  TYR  40           HD1      TYR  40  -4.240   8.399   4.614
  322    HD2  TYR  40           HD2      TYR  40  -5.664   6.706   0.933
  323    HE1  TYR  40           HE1      TYR  40  -6.438   9.494   4.964
  324    HE2  TYR  40           HE2      TYR  40  -7.862   7.804   1.280
  325    HH   TYR  40           HH       TYR  40  -8.827   9.646   2.490
  326    H    VAL  41           HN       VAL  41  -0.801   7.186   0.044
  327    HA   VAL  41           HA       VAL  41   1.394   6.743   2.034
  328    HB   VAL  41           HB       VAL  41   0.998   5.083  -0.468
  329   HG11  VAL  41          HG11      VAL  41   3.281   5.146   0.305
  330   HG12  VAL  41          HG12      VAL  41   2.598   3.586   0.762
  331   HG13  VAL  41          HG13      VAL  41   2.778   4.859   1.969
  332   HG21  VAL  41          HG21      VAL  41   0.121   4.603   2.386
  333   HG22  VAL  41          HG22      VAL  41   0.349   3.288   1.232
  334   HG23  VAL  41          HG23      VAL  41  -0.864   4.530   0.924
  335    H    ARG  42           HN       ARG  42   1.431   9.123   1.178
  336    HA   ARG  42           HA       ARG  42   2.410   9.707  -1.446
  337    HB2  ARG  42           HB2      ARG  42   2.661  11.150   1.202
  338    HB3  ARG  42           HB1      ARG  42   3.251  11.831  -0.314
  339    HG2  ARG  42           HG2      ARG  42   0.987  11.666  -1.274
  340    HG3  ARG  42           HG1      ARG  42   0.393  10.969   0.233
  341    HD2  ARG  42           HD2      ARG  42   1.708  13.692   0.041
  342    HD3  ARG  42           HD1      ARG  42  -0.038  13.443   0.011
  343    HE   ARG  42           HE       ARG  42   1.651  13.337   2.363
  344   HH11  ARG  42          HH21      ARG  42  -1.181  12.050   0.841
  345   HH12  ARG  42          HH22      ARG  42  -1.951  11.649   2.339
  346   HH21  ARG  42          HH11      ARG  42   0.648  12.821   4.304
  347   HH22  ARG  42          HH12      ARG  42  -0.919  12.084   4.295
  348    H    LEU  43           HN       LEU  43   4.100   9.118   1.634
  349    HA   LEU  43           HA       LEU  43   6.359   7.908   0.360
  350    HB2  LEU  43           HB2      LEU  43   6.579  10.474  -0.130
  351    HB3  LEU  43           HB1      LEU  43   7.025  10.590   1.571
  352    HG   LEU  43           HG       LEU  43   8.685   8.613   0.969
  353   HD11  LEU  43          HD11      LEU  43   9.545   8.854  -1.364
  354   HD12  LEU  43          HD12      LEU  43   8.200   9.937  -1.721
  355   HD13  LEU  43          HD13      LEU  43   7.890   8.251  -1.320
  356   HD21  LEU  43          HD21      LEU  43   9.469  10.754   1.734
  357   HD22  LEU  43          HD22      LEU  43   9.063  11.516   0.197
  358   HD23  LEU  43          HD23      LEU  43  10.386  10.352   0.282
  359    H    GLY  44           HN       GLY  44   4.457   7.741   2.692
  360    HA2  GLY  44           HA2      GLY  44   6.011   8.105   5.113
  361    HA3  GLY  44           HA1      GLY  44   4.490   7.225   4.986
  362    HA   PRO  45           HA       PRO  45   8.038   4.241   5.833
  363    HB2  PRO  45           HB2      PRO  45   5.907   3.094   7.589
  364    HB3  PRO  45           HB1      PRO  45   7.617   3.405   7.951
  365    HG2  PRO  45           HG2      PRO  45   5.679   4.946   8.953
  366    HG3  PRO  45           HG1      PRO  45   7.243   5.624   8.462
  367    HD2  PRO  45           HD2      PRO  45   4.603   5.745   7.036
  368    HD3  PRO  45           HD1      PRO  45   5.877   6.980   7.157
  369    H    LEU  46           HN       LEU  46   4.682   3.982   4.950
  370    HA   LEU  46           HA       LEU  46   4.915   1.186   4.044
  371    HB2  LEU  46           HB2      LEU  46   2.615   3.085   3.526
  372    HB3  LEU  46           HB1      LEU  46   2.578   1.324   3.566
  373    HG   LEU  46           HG       LEU  46   3.044   3.176   5.920
  374   HD11  LEU  46          HD11      LEU  46   0.962   2.018   6.753
  375   HD12  LEU  46          HD12      LEU  46   0.806   1.277   5.161
  376   HD13  LEU  46          HD13      LEU  46   0.703   3.029   5.332
  377   HD21  LEU  46          HD21      LEU  46   3.267   0.174   5.626
  378   HD22  LEU  46          HD22      LEU  46   2.948   0.930   7.187
  379   HD23  LEU  46          HD23      LEU  46   4.440   1.293   6.321
  380    H    SER  47           HN       SER  47   6.328   3.731   2.919
  381    HA   SER  47           HA       SER  47   5.462   4.280   0.292
  382    HB2  SER  47           HB2      SER  47   8.232   4.171   1.494
  383    HB3  SER  47           HB1      SER  47   7.938   4.725  -0.151
  384    HG   SER  47           HG       SER  47   6.390   5.791   1.917
  385    H    ASN  48           HN       ASN  48   7.470   1.620   1.498
  386    HA   ASN  48           HA       ASN  48   6.795   0.048  -0.903
  387    HB2  ASN  48           HB2      ASN  48   8.915   1.370  -1.423
  388    HB3  ASN  48           HB1      ASN  48   9.702   0.438  -0.150
  389   HD21  ASN  48          HD21      ASN  48  11.096  -0.526  -1.884
  390   HD22  ASN  48          HD22      ASN  48  10.476  -1.771  -2.855
  391    H    LYS  49           HN       LYS  49   6.457   0.057   2.110
  392    HA   LYS  49           HA       LYS  49   7.996  -2.285   2.981
  393    HB2  LYS  49           HB2      LYS  49   7.208  -0.265   4.434
  394    HB3  LYS  49           HB1      LYS  49   5.667  -1.120   4.497
  395    HG2  LYS  49           HG2      LYS  49   6.737  -3.083   5.456
  396    HG3  LYS  49           HG1      LYS  49   8.331  -2.363   5.255
  397    HD2  LYS  49           HD2      LYS  49   7.817  -1.986   7.528
  398    HD3  LYS  49           HD1      LYS  49   7.459  -0.449   6.747
  399    HE2  LYS  49           HE2      LYS  49   5.096  -0.918   6.734
  400    HE3  LYS  49           HE1      LYS  49   5.365  -2.583   7.244
  401    HZ1  LYS  49           HZ1      LYS  49   5.236  -1.894   9.322
  402    HZ2  LYS  49           HZ2      LYS  49   5.092  -0.274   8.829
  403    HZ3  LYS  49           HZ3      LYS  49   6.629  -0.952   9.094
  404    H    ILE  50           HN       ILE  50   7.283  -4.343   3.086
  405    HA   ILE  50           HA       ILE  50   4.842  -5.038   1.640
  406    HB   ILE  50           HB       ILE  50   6.962  -6.688   3.036
  407   HG12  ILE  50          HG12      ILE  50   7.492  -7.313   0.661
  408   HG13  ILE  50          HG11      ILE  50   6.286  -6.144   0.129
  409   HG21  ILE  50          HG21      ILE  50   4.998  -8.022   3.161
  410   HG22  ILE  50          HG22      ILE  50   5.843  -8.587   1.720
  411   HG23  ILE  50          HG23      ILE  50   4.455  -7.510   1.563
  412   HD11  ILE  50          HD11      ILE  50   8.839  -5.453   0.305
  413   HD12  ILE  50          HD12      ILE  50   8.439  -5.213   2.005
  414   HD13  ILE  50          HD13      ILE  50   7.572  -4.316   0.757
  415    H    LEU  51           HN       LEU  51   2.908  -5.274   2.559
  416    HA   LEU  51           HA       LEU  51   2.735  -5.671   5.525
  417    HB2  LEU  51           HB2      LEU  51   0.664  -4.511   3.643
  418    HB3  LEU  51           HB1      LEU  51   0.562  -4.586   5.403
  419    HG   LEU  51           HG       LEU  51   2.673  -3.068   3.837
  420   HD11  LEU  51          HD11      LEU  51   0.312  -2.071   5.463
  421   HD12  LEU  51          HD12      LEU  51   0.422  -2.041   3.702
  422   HD13  LEU  51          HD13      LEU  51   1.521  -1.059   4.671
  423   HD21  LEU  51          HD21      LEU  51   2.973  -2.078   6.256
  424   HD22  LEU  51          HD22      LEU  51   3.711  -3.629   5.870
  425   HD23  LEU  51          HD23      LEU  51   2.198  -3.575   6.773
  426    H    GLN  52           HN       GLN  52   1.762  -7.439   6.284
  427    HA   GLN  52           HA       GLN  52   1.006  -9.570   4.472
  428    HB2  GLN  52           HB2      GLN  52   2.030  -9.791   6.823
  429    HB3  GLN  52           HB1      GLN  52   0.407  -9.470   7.433
  430    HG2  GLN  52           HG2      GLN  52   1.019 -11.664   5.432
  431    HG3  GLN  52           HG1      GLN  52   0.986 -11.927   7.175
  432   HE21  GLN  52          HE21      GLN  52  -1.227 -10.546   8.054
  433   HE22  GLN  52          HE22      GLN  52  -2.630 -11.086   7.265
  434    H    THR  53           HN       THR  53  -0.776  -9.014   3.275
  435    HA   THR  53           HA       THR  53  -3.143  -7.843   4.552
  436    HB   THR  53           HB       THR  53  -3.961  -7.529   2.373
  437    HG1  THR  53           HG1      THR  53  -3.550  -8.885   0.737
  438   HG21  THR  53          HG21      THR  53  -1.559  -6.554   2.888
  439   HG22  THR  53          HG22      THR  53  -2.224  -6.438   1.260
  440   HG23  THR  53          HG23      THR  53  -1.053  -7.697   1.646
  441    H    ASN  54           HN       ASN  54  -5.253  -8.838   4.377
  442    HA   ASN  54           HA       ASN  54  -5.354 -11.756   3.925
  443    HB2  ASN  54           HB2      ASN  54  -6.499 -12.098   6.141
  444    HB3  ASN  54           HB1      ASN  54  -4.789 -11.691   6.277
  445   HD21  ASN  54          HD21      ASN  54  -4.277  -9.360   6.810
  446   HD22  ASN  54          HD22      ASN  54  -5.412  -8.460   7.694
  447    H    THR  55           HN       THR  55  -6.845 -11.617   2.343
  448    HA   THR  55           HA       THR  55  -9.233  -9.893   2.698
  449    HB   THR  55           HB       THR  55  -8.364 -11.550   0.321
  450    HG1  THR  55           HG1      THR  55  -7.888  -9.360  -0.456
  451   HG21  THR  55          HG21      THR  55 -10.730 -11.158   0.220
  452   HG22  THR  55          HG22      THR  55  -9.978  -9.977  -0.851
  453   HG23  THR  55          HG23      THR  55 -10.536  -9.486   0.748
  454    H    TYR  56           HN       TYR  56 -11.262 -10.673   2.932
  455    HA   TYR  56           HA       TYR  56 -11.557 -13.617   3.361
  456    HB2  TYR  56           HB2      TYR  56 -13.186 -11.263   4.357
  457    HB3  TYR  56           HB1      TYR  56 -13.619 -12.952   4.626
  458    HD1  TYR  56           HD1      TYR  56 -11.145 -10.308   5.383
  459    HD2  TYR  56           HD2      TYR  56 -12.389 -14.343   6.171
  460    HE1  TYR  56           HE1      TYR  56  -9.598 -10.407   7.320
  461    HE2  TYR  56           HE2      TYR  56 -10.844 -14.442   8.107
  462    HH   TYR  56           HH       TYR  56  -9.440 -11.732   9.478
  463    H    TYR  57           HN       TYR  57 -12.954 -14.735   2.057
  464    HA   TYR  57           HA       TYR  57 -14.584 -13.139   0.102
  465    HB2  TYR  57           HB2      TYR  57 -13.067 -15.727  -0.321
  466    HB3  TYR  57           HB1      TYR  57 -14.204 -15.044  -1.483
  467    HD1  TYR  57           HD2      TYR  57 -13.800 -12.707  -2.373
  468    HD2  TYR  57           HD1      TYR  57 -10.835 -14.895  -0.166
  469    HE1  TYR  57           HE2      TYR  57 -12.040 -11.194  -3.240
  470    HE2  TYR  57           HE1      TYR  57  -9.073 -13.379  -1.034
  471    HH   TYR  57           HH       TYR  57  -9.885 -10.697  -3.246
  472    H    SER  58           HN       SER  58 -16.642 -13.552   0.038
  473    HA   SER  58           HA       SER  58 -17.725 -16.140   1.041
  474    HB2  SER  58           HB2      SER  58 -18.163 -13.454   2.161
  475    HB3  SER  58           HB1      SER  58 -19.656 -14.323   1.825
  476    HG   SER  58           HG       SER  58 -17.540 -15.675   3.060
  477    H    ASP  59           HN       ASP  59 -19.924 -16.522   0.222
  478    HA   ASP  59           HA       ASP  59 -20.168 -15.992  -2.574
  479    HB2  ASP  59           HB2      ASP  59 -21.243 -17.926  -1.481
  480    HB3  ASP  59           HB1      ASP  59 -22.291 -16.833  -0.577
  481    H    THR  60           HN       THR  60 -21.907 -14.624   0.222
  482    HA   THR  60           HA       THR  60 -23.486 -12.780  -1.311
  483    HB   THR  60           HB       THR  60 -23.794 -11.635   0.914
  484    HG1  THR  60           HG1      THR  60 -22.090 -11.933   2.127
  485   HG21  THR  60          HG21      THR  60 -25.157 -13.608   0.171
  486   HG22  THR  60          HG22      THR  60 -25.007 -13.472   1.923
  487   HG23  THR  60          HG23      THR  60 -24.034 -14.652   1.043
  488    H    LEU  61           HN       LEU  61 -20.297 -12.565   0.173
  489    HA   LEU  61           HA       LEU  61 -19.907  -9.747  -0.154
  490    HB2  LEU  61           HB2      LEU  61 -18.102 -12.124   0.193
  491    HB3  LEU  61           HB1      LEU  61 -17.383 -10.573  -0.232
  492    HG   LEU  61           HG       LEU  61 -17.537 -11.073   2.262
  493   HD11  LEU  61          HD11      LEU  61 -19.157  -8.606   1.698
  494   HD12  LEU  61          HD12      LEU  61 -17.532  -8.719   1.030
  495   HD13  LEU  61          HD13      LEU  61 -17.777  -8.823   2.770
  496   HD21  LEU  61          HD21      LEU  61 -19.950 -12.026   1.935
  497   HD22  LEU  61          HD22      LEU  61 -20.456 -10.343   2.003
  498   HD23  LEU  61          HD23      LEU  61 -19.620 -11.067   3.376
  499    H    HIS  62           HN       HIS  62 -19.215 -12.486  -2.263
  500    HA   HIS  62           HA       HIS  62 -17.913 -10.963  -4.312
  501    HB2  HIS  62           HB2      HIS  62 -17.808 -13.454  -4.114
  502    HB3  HIS  62           HB1      HIS  62 -19.502 -13.528  -4.600
  503    HD1  HIS  62           HD1      HIS  62 -20.073 -12.735  -7.054
  504    HD2  HIS  62           HD2      HIS  62 -15.998 -13.005  -6.221
  505    HE1  HIS  62           HE1      HIS  62 -18.878 -12.639  -9.285
  506    H    LYS  63           HN       LYS  63 -21.279 -11.954  -3.809
  507    HA   LYS  63           HA       LYS  63 -22.315 -10.887  -6.255
  508    HB2  LYS  63           HB2      LYS  63 -23.630 -11.372  -3.568
  509    HB3  LYS  63           HB1      LYS  63 -24.516 -10.923  -5.027
  510    HG2  LYS  63           HG2      LYS  63 -23.630 -12.926  -6.174
  511    HG3  LYS  63           HG1      LYS  63 -22.764 -13.378  -4.706
  512    HD2  LYS  63           HD2      LYS  63 -24.899 -13.547  -3.487
  513    HD3  LYS  63           HD1      LYS  63 -25.773 -13.079  -4.946
  514    HE2  LYS  63           HE2      LYS  63 -24.901 -15.069  -6.114
  515    HE3  LYS  63           HE1      LYS  63 -24.025 -15.542  -4.659
  516    HZ1  LYS  63           HZ1      LYS  63 -26.350 -16.532  -5.124
  517    HZ2  LYS  63           HZ2      LYS  63 -26.921 -15.048  -4.527
  518    HZ3  LYS  63           HZ3      LYS  63 -25.956 -16.045  -3.547
  519    H    SER  64           HN       SER  64 -21.944  -9.473  -3.016
  520    HA   SER  64           HA       SER  64 -23.215  -6.966  -3.702
  521    HB2  SER  64           HB2      SER  64 -21.176  -7.405  -1.512
  522    HB3  SER  64           HB1      SER  64 -22.454  -6.194  -1.563
  523    HG   SER  64           HG       SER  64 -23.119  -8.911  -1.761
  524    H    ASN  65           HN       ASN  65 -20.194  -8.331  -4.418
  525    HA   ASN  65           HA       ASN  65 -18.420  -7.495  -5.704
  526    HB2  ASN  65           HB2      ASN  65 -19.662  -4.739  -5.672
  527    HB3  ASN  65           HB1      ASN  65 -18.656  -5.490  -6.909
  528   HD21  ASN  65          HD21      ASN  65 -19.969  -8.002  -7.188
  529   HD22  ASN  65          HD22      ASN  65 -21.527  -7.733  -7.803
  530    H    ILE  66           HN       ILE  66 -18.786  -7.234  -2.689
  531    HA   ILE  66           HA       ILE  66 -16.761  -5.080  -2.198
  532    HB   ILE  66           HB       ILE  66 -18.930  -6.278  -0.474
  533   HG12  ILE  66          HG12      ILE  66 -19.270  -3.804  -0.004
  534   HG13  ILE  66          HG11      ILE  66 -18.048  -3.470  -1.222
  535   HG21  ILE  66          HG21      ILE  66 -16.370  -4.959   0.420
  536   HG22  ILE  66          HG22      ILE  66 -17.119  -6.430   1.029
  537   HG23  ILE  66          HG23      ILE  66 -17.836  -4.862   1.396
  538   HD11  ILE  66          HD11      ILE  66 -19.391  -4.207  -2.972
  539   HD12  ILE  66          HD12      ILE  66 -20.594  -3.507  -1.894
  540   HD13  ILE  66          HD13      ILE  66 -20.357  -5.253  -1.932
  541    H    TYR  67           HN       TYR  67 -14.813  -5.636  -1.582
  542    HA   TYR  67           HA       TYR  67 -14.334  -8.428  -0.611
  543    HB2  TYR  67           HB2      TYR  67 -12.445  -6.828  -2.334
  544    HB3  TYR  67           HB1      TYR  67 -12.284  -8.513  -1.832
  545    HD1  TYR  67           HD1      TYR  67 -14.086 -10.187  -2.547
  546    HD2  TYR  67           HD2      TYR  67 -13.695  -6.270  -4.267
  547    HE1  TYR  67           HE1      TYR  67 -15.431 -10.912  -4.504
  548    HE2  TYR  67           HE2      TYR  67 -15.036  -6.994  -6.221
  549    HH   TYR  67           HH       TYR  67 -15.714 -10.238  -6.887
  550    HA   PRO  68           HA       PRO  68 -12.638  -5.605   2.565
  551    HB2  PRO  68           HB2      PRO  68 -13.247  -7.079   4.729
  552    HB3  PRO  68           HB1      PRO  68 -14.495  -6.186   3.833
  553    HG2  PRO  68           HG2      PRO  68 -13.816  -9.090   3.734
  554    HG3  PRO  68           HG1      PRO  68 -15.406  -8.309   3.735
  555    HD2  PRO  68           HD2      PRO  68 -14.103  -9.224   1.459
  556    HD3  PRO  68           HD1      PRO  68 -15.375  -7.986   1.448
  557    H    PHE  69           HN       PHE  69 -10.643  -5.564   3.552
  558    HA   PHE  69           HA       PHE  69  -9.206  -8.065   4.095
  559    HB2  PHE  69           HB2      PHE  69  -7.265  -7.558   2.769
  560    HB3  PHE  69           HB1      PHE  69  -8.665  -7.521   1.703
  561    HD1  PHE  69           HD2      PHE  69  -6.138  -5.472   3.460
  562    HD2  PHE  69           HD1      PHE  69  -9.464  -5.436   0.739
  563    HE1  PHE  69           HE2      PHE  69  -5.563  -3.153   2.786
  564    HE2  PHE  69           HE1      PHE  69  -8.883  -3.121   0.065
  565    HZ   PHE  69           HZ       PHE  69  -6.935  -1.980   1.085
  566    H    ILE  70           HN       ILE  70  -7.272  -7.707   5.353
  567    HA   ILE  70           HA       ILE  70  -7.193  -5.031   6.699
  568    HB   ILE  70           HB       ILE  70  -7.050  -7.757   8.011
  569   HG12  ILE  70          HG12      ILE  70  -9.037  -5.506   8.413
  570   HG13  ILE  70          HG11      ILE  70  -9.321  -6.851   7.308
  571   HG21  ILE  70          HG21      ILE  70  -6.526  -4.950   8.999
  572   HG22  ILE  70          HG22      ILE  70  -5.553  -6.400   9.231
  573   HG23  ILE  70          HG23      ILE  70  -7.071  -6.212  10.107
  574   HD11  ILE  70          HD11      ILE  70  -9.274  -8.445   9.085
  575   HD12  ILE  70          HD12      ILE  70 -10.284  -7.118   9.659
  576   HD13  ILE  70          HD13      ILE  70  -8.618  -7.264  10.218
  577    H    LEU  71           HN       LEU  71  -5.178  -4.361   7.403
  578    HA   LEU  71           HA       LEU  71  -2.865  -5.815   6.193
  579    HB2  LEU  71           HB2      LEU  71  -3.028  -2.954   7.189
  580    HB3  LEU  71           HB1      LEU  71  -1.711  -3.671   6.261
  581    HG   LEU  71           HG       LEU  71  -4.564  -3.264   5.312
  582   HD11  LEU  71          HD11      LEU  71  -2.027  -2.082   4.170
  583   HD12  LEU  71          HD12      LEU  71  -2.934  -1.273   5.446
  584   HD13  LEU  71          HD13      LEU  71  -3.692  -1.579   3.883
  585   HD21  LEU  71          HD21      LEU  71  -3.380  -3.991   3.078
  586   HD22  LEU  71          HD22      LEU  71  -3.901  -5.232   4.216
  587   HD23  LEU  71          HD23      LEU  71  -2.206  -4.743   4.159
  588    H    TYR  72           HN       TYR  72  -1.457  -6.776   7.489
  589    HA   TYR  72           HA       TYR  72  -1.384  -6.024  10.382
  590    HB2  TYR  72           HB2      TYR  72  -1.192  -8.737   9.079
  591    HB3  TYR  72           HB1      TYR  72  -0.710  -8.442  10.749
  592    HD1  TYR  72           HD1      TYR  72  -2.508  -7.024  12.156
  593    HD2  TYR  72           HD2      TYR  72  -3.397  -9.445   8.719
  594    HE1  TYR  72           HE1      TYR  72  -4.866  -7.200  12.889
  595    HE2  TYR  72           HE2      TYR  72  -5.760  -9.617   9.456
  596    HH   TYR  72           HH       TYR  72  -6.855  -9.283  12.200
  597    H    TYR  73           HN       TYR  73   0.575  -5.812  11.323
  598    HA   TYR  73           HA       TYR  73   3.017  -6.467   9.759
  599    HB2  TYR  73           HB2      TYR  73   2.475  -4.096   9.274
  600    HB3  TYR  73           HB1      TYR  73   2.480  -3.754  11.005
  601    HD1  TYR  73           HD2      TYR  73   4.600  -5.049   8.217
  602    HD2  TYR  73           HD1      TYR  73   4.513  -3.318  12.148
  603    HE1  TYR  73           HE2      TYR  73   7.062  -4.762   8.146
  604    HE2  TYR  73           HE1      TYR  73   6.975  -3.033  12.077
  605    HH   TYR  73           HH       TYR  73   8.896  -4.311   9.397
  606    H    GLN  74           HN       GLN  74   4.418  -7.478  11.038
  607    HA   GLN  74           HA       GLN  74   5.535  -8.240  12.944
  608    HB2  GLN  74           HB2      GLN  74   5.765  -5.685  13.253
  609    HB3  GLN  74           HB1      GLN  74   4.445  -5.831  14.411
  610    HG2  GLN  74           HG2      GLN  74   6.491  -5.982  15.658
  611    HG3  GLN  74           HG1      GLN  74   5.798  -7.604  15.599
  612   HE21  GLN  74          HE21      GLN  74   7.932  -5.633  13.430
  613   HE22  GLN  74          HE22      GLN  74   9.047  -6.885  13.167
  614    H    LYS  75           HN       LYS  75   2.710  -6.602  14.343
  615    HA   LYS  75           HA       LYS  75   1.363  -9.119  14.930
  616    HB2  LYS  75           HB2      LYS  75   3.091  -9.030  16.732
  617    HB3  LYS  75           HB1      LYS  75   2.458  -7.459  17.224
  618    HG2  LYS  75           HG2      LYS  75   0.264  -8.473  17.690
  619    HG3  LYS  75           HG1      LYS  75   0.872 -10.046  17.171
  620    HD2  LYS  75           HD2      LYS  75   2.570  -9.980  18.968
  621    HD3  LYS  75           HD1      LYS  75   1.943  -8.418  19.496
  622    HE2  LYS  75           HE2      LYS  75  -0.249  -9.437  19.959
  623    HE3  LYS  75           HE1      LYS  75   0.353 -11.001  19.407
  624    HZ1  LYS  75           HZ1      LYS  75   0.890  -9.571  21.884
  625    HZ2  LYS  75           HZ2      LYS  75   2.207 -10.392  21.194
  626    HZ3  LYS  75           HZ3      LYS  75   0.789 -11.239  21.593
  627    H    GLN  76           HN       GLN  76   1.678  -5.635  15.360
  628    HA   GLN  76           HA       GLN  76  -1.177  -5.331  16.043
  629    HB2  GLN  76           HB2      GLN  76   0.523  -3.898  17.130
  630    HB3  GLN  76           HB1      GLN  76   0.949  -3.230  15.554
  631    HG2  GLN  76           HG2      GLN  76  -1.310  -2.343  15.273
  632    HG3  GLN  76           HG1      GLN  76  -1.819  -3.097  16.783
  633   HE21  GLN  76          HE21      GLN  76  -1.808  -1.674  18.518
  634   HE22  GLN  76          HE22      GLN  76  -0.789  -0.325  18.670
  635    H    LEU  77           HN       LEU  77  -2.675  -4.230  14.747
  636    HA   LEU  77           HA       LEU  77  -2.370  -4.641  11.897
  637    HB2  LEU  77           HB2      LEU  77  -4.640  -3.877  11.724
  638    HB3  LEU  77           HB1      LEU  77  -4.512  -4.910  13.147
  639    HG   LEU  77           HG       LEU  77  -3.916  -2.397  14.200
  640   HD11  LEU  77          HD11      LEU  77  -6.117  -2.084  12.136
  641   HD12  LEU  77          HD12      LEU  77  -4.546  -1.285  12.105
  642   HD13  LEU  77          HD13      LEU  77  -5.707  -0.897  13.375
  643   HD21  LEU  77          HD21      LEU  77  -6.200  -2.494  15.161
  644   HD22  LEU  77          HD22      LEU  77  -5.406  -4.067  15.219
  645   HD23  LEU  77          HD23      LEU  77  -6.631  -3.745  13.992
  646    H    ILE  78           HN       ILE  78  -2.427  -3.042  10.271
  647    HA   ILE  78           HA       ILE  78  -1.260  -0.424  11.102
  648    HB   ILE  78           HB       ILE  78  -1.401  -1.774   8.393
  649   HG12  ILE  78          HG12      ILE  78   0.098  -2.954   9.927
  650   HG13  ILE  78          HG11      ILE  78   1.042  -2.097   8.711
  651   HG21  ILE  78          HG21      ILE  78  -1.334   0.609   8.090
  652   HG22  ILE  78          HG22      ILE  78   0.298   0.004   7.801
  653   HG23  ILE  78          HG23      ILE  78  -0.095   0.786   9.333
  654   HD11  ILE  78          HD11      ILE  78   1.016  -0.163  10.563
  655   HD12  ILE  78          HD12      ILE  78   2.193  -1.473  10.628
  656   HD13  ILE  78          HD13      ILE  78   0.752  -1.534  11.638
  657    H    ALA  79           HN       ALA  79  -3.670  -1.754   8.819
  658    HA   ALA  79           HA       ALA  79  -5.469   0.490   9.417
  659    HB1  ALA  79           HB1      ALA  79  -4.396   0.109   6.614
  660    HB2  ALA  79           HB2      ALA  79  -3.973   1.443   7.688
  661    HB3  ALA  79           HB3      ALA  79  -5.629   1.267   7.104
  662    H    ILE  80           HN       ILE  80  -7.565   0.219   8.359
  663    HA   ILE  80           HA       ILE  80  -8.090  -2.563   7.383
  664    HB   ILE  80           HB       ILE  80  -9.707  -1.005   9.419
  665   HG12  ILE  80          HG12      ILE  80  -8.340  -3.689   9.704
  666   HG13  ILE  80          HG11      ILE  80  -7.542  -2.181  10.137
  667   HG21  ILE  80          HG21      ILE  80 -10.205  -3.563   7.888
  668   HG22  ILE  80          HG22      ILE  80 -11.285  -2.191   8.117
  669   HG23  ILE  80          HG23      ILE  80 -10.955  -3.284   9.460
  670   HD11  ILE  80          HD11      ILE  80 -10.098  -3.292  11.317
  671   HD12  ILE  80          HD12      ILE  80  -9.480  -1.674  11.654
  672   HD13  ILE  80          HD13      ILE  80  -8.547  -3.092  12.131
  673    H    GLY  81           HN       GLY  81  -9.456  -2.685   5.663
  674    HA2  GLY  81           HA2      GLY  81 -11.397  -0.626   5.036
  675    HA3  GLY  81           HA1      GLY  81  -9.963  -0.471   4.025
  676    H    PHE  82           HN       PHE  82 -12.022  -0.927   2.558
  677    HA   PHE  82           HA       PHE  82 -11.739  -3.744   1.703
  678    HB2  PHE  82           HB2      PHE  82 -14.144  -4.107   1.534
  679    HB3  PHE  82           HB1      PHE  82 -13.736  -3.688   3.194
  680    HD1  PHE  82           HD1      PHE  82 -14.290  -1.455   4.111
  681    HD2  PHE  82           HD2      PHE  82 -15.448  -2.617   0.139
  682    HE1  PHE  82           HE1      PHE  82 -15.920   0.416   4.036
  683    HE2  PHE  82           HE2      PHE  82 -17.070  -0.743   0.065
  684    HZ   PHE  82           HZ       PHE  82 -17.307   0.773   2.013
  685    H    ILE  83           HN       ILE  83 -12.580  -4.090  -0.496
  686    HA   ILE  83           HA       ILE  83 -12.078  -1.688  -2.157
  687    HB   ILE  83           HB       ILE  83 -12.386  -4.591  -2.967
  688   HG12  ILE  83          HG12      ILE  83  -9.856  -2.939  -2.772
  689   HG13  ILE  83          HG11      ILE  83 -10.390  -4.026  -1.490
  690   HG21  ILE  83          HG21      ILE  83 -12.881  -3.105  -4.815
  691   HG22  ILE  83          HG22      ILE  83 -11.260  -3.756  -5.058
  692   HG23  ILE  83          HG23      ILE  83 -11.470  -2.114  -4.450
  693   HD11  ILE  83          HD11      ILE  83  -8.808  -5.212  -2.909
  694   HD12  ILE  83          HD12      ILE  83  -9.728  -4.782  -4.349
  695   HD13  ILE  83          HD13      ILE  83 -10.415  -5.892  -3.164
  696    H    ASP  84           HN       ASP  84 -13.713  -0.576  -2.982
  697    HA   ASP  84           HA       ASP  84 -16.455  -1.614  -2.852
  698    HB2  ASP  84           HB2      ASP  84 -15.367   1.030  -3.866
  699    HB3  ASP  84           HB1      ASP  84 -17.075   0.647  -3.651
  700    H    GLU  85           HN       GLU  85 -17.685  -2.195  -4.590
  701    HA   GLU  85           HA       GLU  85 -18.055  -3.123  -6.715
  702    HB2  GLU  85           HB2      GLU  85 -16.667  -0.522  -7.419
  703    HB3  GLU  85           HB1      GLU  85 -17.526  -1.534  -8.581
  704    HG2  GLU  85           HG2      GLU  85 -18.781  -0.381  -6.075
  705    HG3  GLU  85           HG1      GLU  85 -18.924   0.344  -7.676
  706    H    ASN  86           HN       ASN  86 -15.177  -1.497  -7.840
  707    HA   ASN  86           HA       ASN  86 -13.563  -3.967  -7.715
  708    HB2  ASN  86           HB2      ASN  86 -14.940  -4.042  -9.847
  709    HB3  ASN  86           HB1      ASN  86 -14.088  -2.588 -10.363
  710   HD21  ASN  86          HD21      ASN  86 -12.835  -3.549 -12.058
  711   HD22  ASN  86          HD22      ASN  86 -11.662  -4.741 -11.770
  712    H    HIS  87           HN       HIS  87 -13.724  -0.897  -6.980
  713    HA   HIS  87           HA       HIS  87 -10.864  -0.483  -7.022
  714    HB2  HIS  87           HB2      HIS  87 -11.384   0.093  -9.388
  715    HB3  HIS  87           HB1      HIS  87 -12.497   1.336  -8.815
  716    HD1  HIS  87           HD1      HIS  87  -8.850   0.384  -8.143
  717    HD2  HIS  87           HD2      HIS  87 -11.228   3.776  -8.616
  718    HE1  HIS  87           HE1      HIS  87  -7.299   2.377  -7.963
  719    H    ASP  88           HN       ASP  88 -10.414   1.926  -6.353
  720    HA   ASP  88           HA       ASP  88 -10.610   3.499  -4.649
  721    HB2  ASP  88           HB2      ASP  88 -13.490   3.257  -5.543
  722    HB3  ASP  88           HB1      ASP  88 -12.962   4.422  -4.329
  723    H    MET  89           HN       MET  89  -9.923   2.198  -2.954
  724    HA   MET  89           HA       MET  89 -11.864   0.533  -1.510
  725    HB2  MET  89           HB2      MET  89  -9.029   1.119  -0.662
  726    HB3  MET  89           HB1      MET  89 -10.010  -0.296  -0.278
  727    HG2  MET  89           HG2      MET  89  -8.630  -1.120  -1.982
  728    HG3  MET  89           HG1      MET  89 -10.062  -0.634  -2.886
  729    HE1  MET  89           HE1      MET  89  -8.487  -1.020  -4.724
  730    HE2  MET  89           HE2      MET  89  -6.829  -0.870  -4.145
  731    HE3  MET  89           HE3      MET  89  -7.410   0.202  -5.414
  732    H    ASP  90           HN       ASP  90 -12.902   1.091   0.290
  733    HA   ASP  90           HA       ASP  90 -12.649   3.855   1.279
  734    HB2  ASP  90           HB2      ASP  90 -14.615   1.616   1.739
  735    HB3  ASP  90           HB1      ASP  90 -14.644   3.075   2.725
  736    H    PHE  91           HN       PHE  91 -12.032   4.427   3.323
  737    HA   PHE  91           HA       PHE  91 -10.515   2.376   4.844
  738    HB2  PHE  91           HB2      PHE  91 -10.489   5.399   5.023
  739    HB3  PHE  91           HB1      PHE  91  -9.419   4.310   5.905
  740    HD1  PHE  91           HD1      PHE  91  -7.691   3.011   4.731
  741    HD2  PHE  91           HD2      PHE  91 -10.211   5.773   2.621
  742    HE1  PHE  91           HE1      PHE  91  -6.141   2.945   2.803
  743    HE2  PHE  91           HE2      PHE  91  -8.667   5.696   0.681
  744    HZ   PHE  91           HZ       PHE  91  -6.636   4.289   0.772
  745    H    LEU  92           HN       LEU  92 -10.942   1.861   6.901
  746    HA   LEU  92           HA       LEU  92 -13.320   3.082   8.262
  747    HB2  LEU  92           HB2      LEU  92 -12.141   0.300   8.596
  748    HB3  LEU  92           HB1      LEU  92 -13.603   0.905   9.370
  749    HG   LEU  92           HG       LEU  92 -13.193   0.568   6.382
  750   HD11  LEU  92          HD11      LEU  92 -14.729  -1.278   6.538
  751   HD12  LEU  92          HD12      LEU  92 -15.072  -0.927   8.231
  752   HD13  LEU  92          HD13      LEU  92 -13.489  -1.542   7.763
  753   HD21  LEU  92          HD21      LEU  92 -15.406   1.743   8.062
  754   HD22  LEU  92          HD22      LEU  92 -15.786   0.972   6.522
  755   HD23  LEU  92          HD23      LEU  92 -14.702   2.356   6.565
  756    H    TYR  93           HN       TYR  93 -10.032   1.901   8.510
  757    HA   TYR  93           HA       TYR  93  -9.589   3.593  10.898
  758    HB2  TYR  93           HB2      TYR  93 -10.204   1.303  11.729
  759    HB3  TYR  93           HB1      TYR  93  -8.826   0.657  10.840
  760    HD1  TYR  93           HD1      TYR  93  -9.795   3.078  13.503
  761    HD2  TYR  93           HD2      TYR  93  -6.627   0.765  11.750
  762    HE1  TYR  93           HE1      TYR  93  -8.313   3.668  15.400
  763    HE2  TYR  93           HE2      TYR  93  -5.144   1.359  13.650
  764    HH   TYR  93           HH       TYR  93  -5.454   2.070  16.069
  765    H    LEU  94           HN       LEU  94  -7.732   4.702  10.528
  766    HA   LEU  94           HA       LEU  94  -5.693   3.451   8.728
  767    HB2  LEU  94           HB2      LEU  94  -7.152   5.510   7.893
  768    HB3  LEU  94           HB1      LEU  94  -6.017   6.439   8.870
  769    HG   LEU  94           HG       LEU  94  -5.160   6.312   6.594
  770   HD11  LEU  94          HD11      LEU  94  -3.603   5.999   8.626
  771   HD12  LEU  94          HD12      LEU  94  -2.971   5.514   7.052
  772   HD13  LEU  94          HD13      LEU  94  -3.565   4.294   8.175
  773   HD21  LEU  94          HD21      LEU  94  -4.750   3.368   6.589
  774   HD22  LEU  94          HD22      LEU  94  -5.240   4.436   5.277
  775   HD23  LEU  94          HD23      LEU  94  -6.432   3.871   6.443
  776    H    HIS  95           HN       HIS  95  -3.977   2.985   9.856
  777    HA   HIS  95           HA       HIS  95  -2.831   5.007  11.702
  778    HB2  HIS  95           HB2      HIS  95  -4.050   3.477  13.159
  779    HB3  HIS  95           HB1      HIS  95  -3.288   2.091  12.379
  780    HD1  HIS  95           HD1      HIS  95  -0.978   1.426  13.176
  781    HD2  HIS  95           HD2      HIS  95  -2.171   5.128  14.676
  782    HE1  HIS  95           HE1      HIS  95   0.765   2.101  14.883
  783    H    ASN  96           HN       ASN  96  -1.036   5.429  10.485
  784    HA   ASN  96           HA       ASN  96   0.495   3.157   9.320
  785    HB2  ASN  96           HB2      ASN  96   0.634   6.157   8.956
  786    HB3  ASN  96           HB1      ASN  96   1.855   5.068   8.304
  787   HD21  ASN  96          HD21      ASN  96   0.261   6.601   6.534
  788   HD22  ASN  96          HD22      ASN  96  -0.788   5.562   5.697
  789    H    THR  97           HN       THR  97   1.569   2.272  11.030
  790    HA   THR  97           HA       THR  97   2.890   2.201  13.006
  791    HB   THR  97           HB       THR  97   5.203   2.690  12.407
  792    HG1  THR  97           HG1      THR  97   4.694   4.738  11.429
  793   HG21  THR  97          HG21      THR  97   4.335   0.695  11.393
  794   HG22  THR  97          HG22      THR  97   5.242   1.542  10.141
  795   HG23  THR  97          HG23      THR  97   3.481   1.620  10.158
  796    H    VAL  98           HN       VAL  98   1.809   3.564  14.473
  797    HA   VAL  98           HA       VAL  98   1.563   5.389  15.891
  798    HB   VAL  98           HB       VAL  98   4.394   6.081  15.071
  799   HG11  VAL  98          HG11      VAL  98   2.674   6.604  17.505
  800   HG12  VAL  98          HG12      VAL  98   3.504   7.777  16.482
  801   HG13  VAL  98          HG13      VAL  98   4.431   6.732  17.559
  802   HG21  VAL  98          HG21      VAL  98   3.338   3.984  16.984
  803   HG22  VAL  98          HG22      VAL  98   4.999   4.579  17.036
  804   HG23  VAL  98          HG23      VAL  98   4.405   3.736  15.605
  805    H    MET  99           HN       MET  99   0.212   5.991  13.759
  806    HA   MET  99           HA       MET  99   0.433   8.838  13.502
  807    HB2  MET  99           HB2      MET  99   2.305   7.963  11.969
  808    HB3  MET  99           HB1      MET  99   1.014   7.396  10.918
  809    HG2  MET  99           HG2      MET  99   1.682   9.600  10.163
  810    HG3  MET  99           HG1      MET  99   0.089   9.736  10.904
  811    HE1  MET  99           HE1      MET  99   3.619  11.379  10.862
  812    HE2  MET  99           HE2      MET  99   3.764   9.712  11.415
  813    HE3  MET  99           HE3      MET  99   4.148  11.035  12.514
  814    HA   PRO 100           HA       PRO 100  -3.695   7.011  12.412
  815    HB2  PRO 100           HB2      PRO 100  -5.175   8.414  14.219
  816    HB3  PRO 100           HB1      PRO 100  -4.309   6.924  14.646
  817    HG2  PRO 100           HG2      PRO 100  -3.573   9.760  15.180
  818    HG3  PRO 100           HG1      PRO 100  -3.350   8.326  16.197
  819    HD2  PRO 100           HD2      PRO 100  -1.348   9.484  14.663
  820    HD3  PRO 100           HD1      PRO 100  -1.328   7.797  15.214
  821    H    LEU 101           HN       LEU 101  -4.179   7.930  10.463
  822    HA   LEU 101           HA       LEU 101  -4.291  10.865  10.168
  823    HB2  LEU 101           HB2      LEU 101  -4.965   8.783   8.078
  824    HB3  LEU 101           HB1      LEU 101  -4.437  10.444   7.818
  825    HG   LEU 101           HG       LEU 101  -2.777   8.185   8.982
  826   HD11  LEU 101          HD11      LEU 101  -1.358   8.708   6.945
  827   HD12  LEU 101          HD12      LEU 101  -2.684   9.720   6.370
  828   HD13  LEU 101          HD13      LEU 101  -2.927   7.987   6.588
  829   HD21  LEU 101          HD21      LEU 101  -2.252  11.149   8.680
  830   HD22  LEU 101          HD22      LEU 101  -0.936   9.979   8.791
  831   HD23  LEU 101          HD23      LEU 101  -2.077  10.151  10.124
  832    H    LEU 102           HN       LEU 102  -6.438   8.384  11.031
  833    HA   LEU 102           HA       LEU 102  -8.753  10.204  10.598
  834    HB2  LEU 102           HB2      LEU 102  -8.619   7.313   9.702
  835    HB3  LEU 102           HB1      LEU 102 -10.128   8.209   9.857
  836    HG   LEU 102           HG       LEU 102  -7.801   9.076   8.115
  837   HD11  LEU 102          HD11      LEU 102 -10.423   7.864   7.222
  838   HD12  LEU 102          HD12      LEU 102  -8.943   6.926   7.413
  839   HD13  LEU 102          HD13      LEU 102  -9.012   8.230   6.230
  840   HD21  LEU 102          HD21      LEU 102  -9.887  10.395   7.093
  841   HD22  LEU 102          HD22      LEU 102  -9.006  11.039   8.474
  842   HD23  LEU 102          HD23      LEU 102 -10.531  10.190   8.724
  843    H    ASP 103           HN       ASP 103  -8.399   6.825  11.630
  844    HA   ASP 103           HA       ASP 103  -9.056   5.760  13.606
  845    HB2  ASP 103           HB2      ASP 103  -7.180   7.252  14.429
  846    HB3  ASP 103           HB1      ASP 103  -8.413   8.407  14.934
  847    H    GLN 104           HN       GLN 104 -11.072   7.133  12.039
  848    HA   GLN 104           HA       GLN 104 -12.883   8.570  13.765
  849    HB2  GLN 104           HB2      GLN 104 -13.277   7.134  11.129
  850    HB3  GLN 104           HB1      GLN 104 -14.549   8.064  11.922
  851    HG2  GLN 104           HG2      GLN 104 -13.151  10.075  11.863
  852    HG3  GLN 104           HG1      GLN 104 -11.828   9.158  11.149
  853   HE21  GLN 104          HE21      GLN 104 -12.389  11.124   9.509
  854   HE22  GLN 104          HE22      GLN 104 -13.428  10.690   8.240
  855    H    ARG 105           HN       ARG 105 -13.849   7.684  15.448
  856    HA   ARG 105           HA       ARG 105 -14.220   4.822  15.752
  857    HB2  ARG 105           HB2      ARG 105 -15.283   7.146  17.382
  858    HB3  ARG 105           HB1      ARG 105 -15.278   5.458  17.892
  859    HG2  ARG 105           HG2      ARG 105 -12.721   6.856  17.087
  860    HG3  ARG 105           HG1      ARG 105 -13.345   6.973  18.732
  861    HD2  ARG 105           HD2      ARG 105 -12.625   4.408  17.267
  862    HD3  ARG 105           HD1      ARG 105 -11.746   5.133  18.612
  863    HE   ARG 105           HE       ARG 105 -14.375   4.757  19.521
  864   HH11  ARG 105          HH21      ARG 105 -11.746   2.863  18.315
  865   HH12  ARG 105          HH22      ARG 105 -12.176   1.458  19.233
  866   HH21  ARG 105          HH11      ARG 105 -14.941   2.935  20.706
  867   HH22  ARG 105          HH12      ARG 105 -13.979   1.500  20.584
  868    H    TYR 106           HN       TYR 106 -16.356   7.571  15.107
  869    HA   TYR 106           HA       TYR 106 -18.815   6.134  15.228
  870    HB2  TYR 106           HB2      TYR 106 -19.772   7.997  13.998
  871    HB3  TYR 106           HB1      TYR 106 -18.593   8.638  15.140
  872    HD1  TYR 106           HD2      TYR 106 -19.241   7.857  11.581
  873    HD2  TYR 106           HD1      TYR 106 -16.531   9.657  14.387
  874    HE1  TYR 106           HE2      TYR 106 -18.009   8.919   9.709
  875    HE2  TYR 106           HE1      TYR 106 -15.302  10.722  12.515
  876    HH   TYR 106           HH       TYR 106 -16.190  10.079   9.131
  877    H    LEU 107           HN       LEU 107 -16.616   6.782  12.524
  878    HA   LEU 107           HA       LEU 107 -18.197   5.491  10.527
  879    HB2  LEU 107           HB2      LEU 107 -16.315   6.997   9.967
  880    HB3  LEU 107           HB1      LEU 107 -15.183   5.849  10.675
  881    HG   LEU 107           HG       LEU 107 -15.829   4.157   9.003
  882   HD11  LEU 107          HD11      LEU 107 -17.228   5.200   7.010
  883   HD12  LEU 107          HD12      LEU 107 -17.833   6.278   8.268
  884   HD13  LEU 107          HD13      LEU 107 -18.054   4.535   8.418
  885   HD21  LEU 107          HD21      LEU 107 -14.846   5.253   7.037
  886   HD22  LEU 107          HD22      LEU 107 -13.991   5.743   8.499
  887   HD23  LEU 107          HD23      LEU 107 -15.153   6.838   7.748
  888    H    LEU 108           HN       LEU 108 -15.696   4.331  12.733
  889    HA   LEU 108           HA       LEU 108 -15.363   1.733  11.645
  890    HB2  LEU 108           HB2      LEU 108 -14.121   3.044  13.607
  891    HB3  LEU 108           HB1      LEU 108 -15.250   2.150  14.621
  892    HG   LEU 108           HG       LEU 108 -13.358   0.935  12.593
  893   HD11  LEU 108          HD11      LEU 108 -12.130   1.720  14.518
  894   HD12  LEU 108          HD12      LEU 108 -12.285  -0.032  14.644
  895   HD13  LEU 108          HD13      LEU 108 -13.315   1.016  15.619
  896   HD21  LEU 108          HD21      LEU 108 -14.125  -1.191  13.942
  897   HD22  LEU 108          HD22      LEU 108 -15.156  -0.558  12.662
  898   HD23  LEU 108          HD23      LEU 108 -15.531  -0.201  14.345
  899    H    THR 109           HN       THR 109 -17.593   2.873  14.185
  900    HA   THR 109           HA       THR 109 -19.177   0.351  13.808
  901    HB   THR 109           HB       THR 109 -18.227   0.287  16.012
  902    HG1  THR 109           HG1      THR 109 -20.074  -0.042  16.992
  903   HG21  THR 109          HG21      THR 109 -18.634   2.177  17.610
  904   HG22  THR 109          HG22      THR 109 -19.237   3.129  16.254
  905   HG23  THR 109          HG23      THR 109 -17.557   2.594  16.277
  906    H    GLY 110           HN       GLY 110 -19.442   2.782  12.302
  907    HA2  GLY 110           HA2      GLY 110 -21.546   4.456  13.286
  908    HA3  GLY 110           HA1      GLY 110 -21.090   4.283  11.594
  909    H    GLY 111           HN       GLY 111 -23.759   4.524  12.527
  910    HA2  GLY 111           HA2      GLY 111 -25.122   2.603  11.019
  911    HA3  GLY 111           HA1      GLY 111 -25.088   1.974  12.670
  912    H    GLN 112           HN       GLN 112 -25.102   4.667  13.864
  913    HA   GLN 112           HA       GLN 112 -27.992   5.049  13.908
  914    HB2  GLN 112           HB2      GLN 112 -27.502   6.784  15.598
  915    HB3  GLN 112           HB1      GLN 112 -26.679   5.269  15.962
  916    HG2  GLN 112           HG2      GLN 112 -24.984   6.865  16.280
  917    HG3  GLN 112           HG1      GLN 112 -24.678   6.296  14.641
  918   HE21  GLN 112          HE21      GLN 112 -23.879   8.215  13.671
  919   HE22  GLN 112          HE22      GLN 112 -24.755   9.666  13.597
  920    H    LEU 113           HN       LEU 113 -29.166   6.696  13.046
  921    HA   LEU 113           HA       LEU 113 -27.878   8.286  10.929
  922    HB2  LEU 113           HB2      LEU 113 -30.725   7.746  11.762
  923    HB3  LEU 113           HB1      LEU 113 -30.358   9.046  10.630
  924    HG   LEU 113           HG       LEU 113 -29.203   7.440   9.156
  925   HD11  LEU 113          HD11      LEU 113 -29.948   5.518  11.365
  926   HD12  LEU 113          HD12      LEU 113 -28.363   5.793  10.642
  927   HD13  LEU 113          HD13      LEU 113 -29.617   4.958   9.725
  928   HD21  LEU 113          HD21      LEU 113 -32.015   6.674   9.993
  929   HD22  LEU 113          HD22      LEU 113 -31.234   6.083   8.527
  930   HD23  LEU 113          HD23      LEU 113 -31.558   7.806   8.720
  931    H    GLU 114           HN       GLU 114 -27.383  10.377  11.094
  932    HA   GLU 114           HA       GLU 114 -27.900  11.789  13.641
  933    HB2  GLU 114           HB2      GLU 114 -26.293  13.449  12.746
  934    HB3  GLU 114           HB1      GLU 114 -25.620  11.821  12.713
  935    HG2  GLU 114           HG2      GLU 114 -26.251  11.616  10.324
  936    HG3  GLU 114           HG1      GLU 114 -26.878  13.264  10.360
  937    H    HIS 115           HN       HIS 115 -29.887  11.251  11.351
  938    HA   HIS 115           HA       HIS 115 -31.656  12.375  10.326
  939    HB2  HIS 115           HB2      HIS 115 -30.988  14.369  12.515
  940    HB3  HIS 115           HB1      HIS 115 -32.422  14.468  11.495
  941    HD1  HIS 115           HD1      HIS 115 -30.864  12.393  14.226
  942    HD2  HIS 115           HD2      HIS 115 -34.423  12.529  12.055
  943    HE1  HIS 115           HE1      HIS 115 -32.476  10.821  15.389
  944    H    HIS 116           HN       HIS 116 -30.130  12.541   8.487
  945    HA   HIS 116           HA       HIS 116 -28.593  14.890   7.945
  946    HB2  HIS 116           HB2      HIS 116 -28.402  12.691   6.724
  947    HB3  HIS 116           HB1      HIS 116 -29.928  13.064   5.926
  948    HD1  HIS 116           HD1      HIS 116 -29.945  15.127   4.281
  949    HD2  HIS 116           HD2      HIS 116 -26.174  14.109   5.737
  950    HE1  HIS 116           HE1      HIS 116 -28.265  16.360   2.842
  951    H    HIS 117           HN       HIS 117 -31.939  13.995   7.138
  952    HA   HIS 117           HA       HIS 117 -32.465  16.403   5.626
  953    HB2  HIS 117           HB2      HIS 117 -34.320  14.402   6.939
  954    HB3  HIS 117           HB1      HIS 117 -34.870  15.719   5.904
  955    HD1  HIS 117           HD1      HIS 117 -32.982  12.466   5.811
  956    HD2  HIS 117           HD2      HIS 117 -34.310  15.377   3.138
  957    HE1  HIS 117           HE1      HIS 117 -32.673  11.501   3.490
  958    H    HIS 118           HN       HIS 118 -33.063  18.367   6.327
  959    HA   HIS 118           HA       HIS 118 -33.211  18.865   9.235
  960    HB2  HIS 118           HB2      HIS 118 -33.136  20.678   6.806
  961    HB3  HIS 118           HB1      HIS 118 -33.294  21.284   8.455
  962    HD1  HIS 118           HD1      HIS 118 -30.863  19.573   6.144
  963    HD2  HIS 118           HD2      HIS 118 -30.937  21.083  10.028
  964    HE1  HIS 118           HE1      HIS 118 -28.466  19.570   6.958
  965    H    HIS 119           HN       HIS 119 -35.314  18.212   6.679
  966    HA   HIS 119           HA       HIS 119 -37.558  19.877   7.249
  967    HB2  HIS 119           HB2      HIS 119 -37.346  17.078   6.108
  968    HB3  HIS 119           HB1      HIS 119 -38.872  17.956   6.206
  969    HD1  HIS 119           HD1      HIS 119 -35.509  18.041   4.491
  970    HD2  HIS 119           HD2      HIS 119 -39.165  20.039   4.321
  971    HE1  HIS 119           HE1      HIS 119 -35.441  19.487   2.412
  972    H    HIS 120           HN       HIS 120 -36.598  16.708   8.532
  973    HA   HIS 120           HA       HIS 120 -38.908  16.332  10.193
  974    HB2  HIS 120           HB2      HIS 120 -36.094  15.227  10.421
  975    HB3  HIS 120           HB1      HIS 120 -37.467  14.652  11.366
  976    HD1  HIS 120           HD1      HIS 120 -36.344  12.520   9.660
  977    HD2  HIS 120           HD2      HIS 120 -39.085  15.258   8.118
  978    HE1  HIS 120           HE1      HIS 120 -37.365  11.436   7.609
  Start of MODEL   16
    1    H1   MET   1           HT1      MET   1  -7.851 -10.095  15.377
    2    H2   MET   1           HT2      MET   1  -9.256  -9.456  14.667
    3    H3   MET   1           HT3      MET   1  -8.973 -11.130  14.639
    4    HA   MET   1           HA       MET   1 -10.456 -11.020  16.345
    5    HB2  MET   1           HB2      MET   1  -7.721 -10.532  17.557
    6    HB3  MET   1           HB1      MET   1  -9.120 -11.063  18.485
    7    HG2  MET   1           HG2      MET   1  -9.330 -13.052  17.023
    8    HG3  MET   1           HG1      MET   1  -7.905 -12.532  16.126
    9    HE1  MET   1           HE1      MET   1  -5.870 -11.853  17.100
   10    HE2  MET   1           HE2      MET   1  -5.347 -13.528  16.976
   11    HE3  MET   1           HE3      MET   1  -5.039 -12.623  18.456
   12    H    THR   2           HN       THR   2 -11.114  -9.838  18.436
   13    HA   THR   2           HA       THR   2 -12.093  -7.918  19.318
   14    HB   THR   2           HB       THR   2 -10.531  -6.079  19.741
   15    HG1  THR   2           HG1      THR   2  -8.684  -5.895  18.659
   16   HG21  THR   2          HG21      THR   2 -10.356  -8.182  21.068
   17   HG22  THR   2          HG22      THR   2  -8.815  -7.336  20.926
   18   HG23  THR   2          HG23      THR   2  -9.132  -8.760  19.936
   19    H    LEU   3           HN       LEU   3 -10.076  -6.087  17.112
   20    HA   LEU   3           HA       LEU   3 -12.221  -4.496  16.144
   21    HB2  LEU   3           HB2      LEU   3  -9.426  -4.980  15.071
   22    HB3  LEU   3           HB1      LEU   3 -10.527  -3.790  14.396
   23    HG   LEU   3           HG       LEU   3  -9.786  -3.835  17.334
   24   HD11  LEU   3          HD11      LEU   3  -8.558  -2.143  15.136
   25   HD12  LEU   3          HD12      LEU   3  -7.761  -3.523  15.897
   26   HD13  LEU   3          HD13      LEU   3  -8.149  -2.090  16.851
   27   HD21  LEU   3          HD21      LEU   3 -11.241  -1.946  15.477
   28   HD22  LEU   3          HD22      LEU   3 -10.443  -1.325  16.912
   29   HD23  LEU   3          HD23      LEU   3 -11.715  -2.519  17.074
   30    H    GLU   4           HN       GLU   4 -10.564  -7.310  14.817
   31    HA   GLU   4           HA       GLU   4 -11.767  -7.356  12.263
   32    HB2  GLU   4           HB2      GLU   4  -9.844  -8.788  12.961
   33    HB3  GLU   4           HB1      GLU   4 -10.946  -9.736  13.963
   34    HG2  GLU   4           HG2      GLU   4 -12.272 -10.333  11.984
   35    HG3  GLU   4           HG1      GLU   4 -11.230  -9.343  10.967
   36    H    LEU   5           HN       LEU   5 -12.815  -8.709  15.366
   37    HA   LEU   5           HA       LEU   5 -15.142 -10.050  14.414
   38    HB2  LEU   5           HB2      LEU   5 -14.471  -8.859  17.128
   39    HB3  LEU   5           HB1      LEU   5 -15.891  -9.851  16.822
   40    HG   LEU   5           HG       LEU   5 -13.059 -10.768  16.238
   41   HD11  LEU   5          HD11      LEU   5 -13.437 -12.206  18.307
   42   HD12  LEU   5          HD12      LEU   5 -14.808 -11.162  18.679
   43   HD13  LEU   5          HD13      LEU   5 -13.179 -10.488  18.618
   44   HD21  LEU   5          HD21      LEU   5 -14.410 -13.034  16.481
   45   HD22  LEU   5          HD22      LEU   5 -14.461 -12.143  14.971
   46   HD23  LEU   5          HD23      LEU   5 -15.798 -12.021  16.112
   47    H    GLN   6           HN       GLN   6 -14.615  -6.784  15.679
   48    HA   GLN   6           HA       GLN   6 -17.349  -5.943  15.534
   49    HB2  GLN   6           HB2      GLN   6 -14.732  -4.410  15.592
   50    HB3  GLN   6           HB1      GLN   6 -16.312  -3.624  15.620
   51    HG2  GLN   6           HG2      GLN   6 -16.909  -4.815  17.675
   52    HG3  GLN   6           HG1      GLN   6 -15.386  -5.701  17.631
   53   HE21  GLN   6          HE21      GLN   6 -16.539  -3.592  19.599
   54   HE22  GLN   6          HE22      GLN   6 -15.278  -2.465  19.757
   55    H    LEU   7           HN       LEU   7 -14.638  -5.859  13.278
   56    HA   LEU   7           HA       LEU   7 -15.804  -4.186  11.306
   57    HB2  LEU   7           HB2      LEU   7 -13.398  -4.803  11.355
   58    HB3  LEU   7           HB1      LEU   7 -13.825  -6.454  10.917
   59    HG   LEU   7           HG       LEU   7 -14.942  -5.538   8.847
   60   HD11  LEU   7          HD11      LEU   7 -13.954  -3.164   8.266
   61   HD12  LEU   7          HD12      LEU   7 -13.858  -2.988  10.014
   62   HD13  LEU   7          HD13      LEU   7 -15.412  -3.289   9.240
   63   HD21  LEU   7          HD21      LEU   7 -12.687  -4.854   7.766
   64   HD22  LEU   7          HD22      LEU   7 -12.822  -6.468   8.459
   65   HD23  LEU   7          HD23      LEU   7 -11.996  -5.194   9.354
   66    H    LYS   8           HN       LYS   8 -15.881  -7.698  11.785
   67    HA   LYS   8           HA       LYS   8 -17.274  -8.365   9.399
   68    HB2  LYS   8           HB2      LYS   8 -16.123 -10.020  10.869
   69    HB3  LYS   8           HB1      LYS   8 -17.377  -9.780  12.087
   70    HG2  LYS   8           HG2      LYS   8 -19.093 -10.539  10.497
   71    HG3  LYS   8           HG1      LYS   8 -17.863 -10.738   9.254
   72    HD2  LYS   8           HD2      LYS   8 -16.716 -12.423  10.650
   73    HD3  LYS   8           HD1      LYS   8 -17.962 -12.237  11.885
   74    HE2  LYS   8           HE2      LYS   8 -19.677 -12.987  10.285
   75    HE3  LYS   8           HE1      LYS   8 -18.447 -13.152   9.032
   76    HZ1  LYS   8           HZ1      LYS   8 -17.369 -14.847  10.269
   77    HZ2  LYS   8           HZ2      LYS   8 -19.018 -15.250  10.212
   78    HZ3  LYS   8           HZ3      LYS   8 -18.350 -14.586  11.625
   79    H    HIS   9           HN       HIS   9 -18.400  -7.604  12.679
   80    HA   HIS   9           HA       HIS   9 -21.182  -7.953  12.150
   81    HB2  HIS   9           HB2      HIS   9 -19.733  -6.308  14.247
   82    HB3  HIS   9           HB1      HIS   9 -21.477  -6.575  14.231
   83    HD1  HIS   9           HD1      HIS   9 -21.924  -9.414  13.780
   84    HD2  HIS   9           HD2      HIS   9 -18.596  -8.153  15.946
   85    HE1  HIS   9           HE1      HIS   9 -21.181 -11.397  15.171
   86    H    TYR  10           HN       TYR  10 -19.026  -5.146  12.033
   87    HA   TYR  10           HA       TYR  10 -20.995  -3.170  11.496
   88    HB2  TYR  10           HB2      TYR  10 -18.747  -2.560  12.202
   89    HB3  TYR  10           HB1      TYR  10 -18.053  -3.287  10.753
   90    HD1  TYR  10           HD1      TYR  10 -20.286  -0.573  11.980
   91    HD2  TYR  10           HD2      TYR  10 -17.993  -2.103   8.687
   92    HE1  TYR  10           HE1      TYR  10 -20.619   1.559  10.757
   93    HE2  TYR  10           HE2      TYR  10 -18.325   0.026   7.464
   94    HH   TYR  10           HH       TYR  10 -18.865   2.626   8.419
   95    H    ILE  11           HN       ILE  11 -18.874  -4.986   9.278
   96    HA   ILE  11           HA       ILE  11 -19.912  -3.862   6.876
   97    HB   ILE  11           HB       ILE  11 -18.503  -6.496   7.427
   98   HG12  ILE  11          HG12      ILE  11 -17.525  -3.926   6.141
   99   HG13  ILE  11          HG11      ILE  11 -17.273  -4.331   7.838
  100   HG21  ILE  11          HG21      ILE  11 -19.711  -6.816   5.378
  101   HG22  ILE  11          HG22      ILE  11 -18.066  -6.403   4.911
  102   HG23  ILE  11          HG23      ILE  11 -19.335  -5.183   4.827
  103   HD11  ILE  11          HD11      ILE  11 -15.287  -4.980   6.613
  104   HD12  ILE  11          HD12      ILE  11 -16.253  -5.862   5.431
  105   HD13  ILE  11          HD13      ILE  11 -16.138  -6.453   7.087
  106    H    THR  12           HN       THR  12 -20.675  -6.854   8.616
  107    HA   THR  12           HA       THR  12 -22.650  -7.807   6.793
  108    HB   THR  12           HB       THR  12 -23.340  -9.237   8.760
  109    HG1  THR  12           HG1      THR  12 -21.752  -7.362   9.996
  110   HG21  THR  12          HG21      THR  12 -20.468  -9.015   7.870
  111   HG22  THR  12          HG22      THR  12 -21.683 -10.199   7.390
  112   HG23  THR  12          HG23      THR  12 -20.976 -10.268   9.002
  113    H    ASN  13           HN       ASN  13 -22.853  -5.815   9.721
  114    HA   ASN  13           HA       ASN  13 -25.691  -5.733   9.923
  115    HB2  ASN  13           HB2      ASN  13 -23.490  -3.889  10.878
  116    HB3  ASN  13           HB1      ASN  13 -25.191  -3.535  11.182
  117   HD21  ASN  13          HD21      ASN  13 -23.377  -4.089  13.328
  118   HD22  ASN  13          HD22      ASN  13 -23.833  -5.560  14.042
  119    H    LEU  14           HN       LEU  14 -23.375  -3.616   8.246
  120    HA   LEU  14           HA       LEU  14 -25.281  -1.687   7.386
  121    HB2  LEU  14           HB2      LEU  14 -22.893  -1.183   7.380
  122    HB3  LEU  14           HB1      LEU  14 -22.591  -2.462   6.202
  123    HG   LEU  14           HG       LEU  14 -23.930  -1.279   4.525
  124   HD11  LEU  14          HD11      LEU  14 -24.603   1.162   5.246
  125   HD12  LEU  14          HD12      LEU  14 -24.558   0.496   6.878
  126   HD13  LEU  14          HD13      LEU  14 -25.653  -0.185   5.673
  127   HD21  LEU  14          HD21      LEU  14 -21.640  -0.624   4.507
  128   HD22  LEU  14          HD22      LEU  14 -21.833   0.359   5.960
  129   HD23  LEU  14          HD23      LEU  14 -22.557   0.882   4.439
  130    H    PHE  15           HN       PHE  15 -24.003  -4.620   5.860
  131    HA   PHE  15           HA       PHE  15 -25.909  -4.272   3.603
  132    HB2  PHE  15           HB2      PHE  15 -23.440  -5.973   3.992
  133    HB3  PHE  15           HB1      PHE  15 -24.563  -6.233   2.655
  134    HD1  PHE  15           HD2      PHE  15 -24.910  -4.477   0.942
  135    HD2  PHE  15           HD1      PHE  15 -22.001  -4.032   4.073
  136    HE1  PHE  15           HE2      PHE  15 -23.849  -2.618  -0.309
  137    HE2  PHE  15           HE1      PHE  15 -20.941  -2.172   2.821
  138    HZ   PHE  15           HZ       PHE  15 -21.865  -1.464   0.631
  139    H    ASN  16           HN       ASN  16 -26.179  -5.408   6.544
  140    HA   ASN  16           HA       ASN  16 -27.285  -7.166   7.607
  141    HB2  ASN  16           HB2      ASN  16 -29.508  -7.610   6.612
  142    HB3  ASN  16           HB1      ASN  16 -29.142  -5.887   6.677
  143   HD21  ASN  16          HD21      ASN  16 -29.642  -4.820   4.757
  144   HD22  ASN  16          HD22      ASN  16 -29.611  -5.524   3.212
  145    H    LEU  17           HN       LEU  17 -25.120  -8.220   6.408
  146    HA   LEU  17           HA       LEU  17 -25.995 -10.510   4.787
  147    HB2  LEU  17           HB2      LEU  17 -23.197  -9.742   5.661
  148    HB3  LEU  17           HB1      LEU  17 -23.603 -10.941   4.464
  149    HG   LEU  17           HG       LEU  17 -24.416  -8.047   4.213
  150   HD11  LEU  17          HD11      LEU  17 -22.530  -7.758   2.704
  151   HD12  LEU  17          HD12      LEU  17 -22.083  -9.455   2.878
  152   HD13  LEU  17          HD13      LEU  17 -21.921  -8.355   4.247
  153   HD21  LEU  17          HD21      LEU  17 -25.801  -9.348   2.814
  154   HD22  LEU  17          HD22      LEU  17 -24.505 -10.473   2.415
  155   HD23  LEU  17          HD23      LEU  17 -24.501  -8.849   1.739
  156    HA   PRO  18           HA       PRO  18 -26.169 -13.323   8.174
  157    HB2  PRO  18           HB2      PRO  18 -25.130 -15.595   6.954
  158    HB3  PRO  18           HB1      PRO  18 -26.790 -15.012   6.748
  159    HG2  PRO  18           HG2      PRO  18 -24.415 -14.624   4.977
  160    HG3  PRO  18           HG1      PRO  18 -26.098 -14.990   4.545
  161    HD2  PRO  18           HD2      PRO  18 -25.116 -12.525   4.311
  162    HD3  PRO  18           HD1      PRO  18 -26.790 -12.779   4.829
  163    H    ARG  19           HN       ARG  19 -24.916 -13.621   9.901
  164    HA   ARG  19           HA       ARG  19 -21.988 -13.334   9.658
  165    HB2  ARG  19           HB2      ARG  19 -23.860 -13.363  12.048
  166    HB3  ARG  19           HB1      ARG  19 -22.108 -13.191  12.164
  167    HG2  ARG  19           HG2      ARG  19 -22.200 -11.158  10.781
  168    HG3  ARG  19           HG1      ARG  19 -23.948 -11.324  10.630
  169    HD2  ARG  19           HD2      ARG  19 -22.504 -11.042  13.275
  170    HD3  ARG  19           HD1      ARG  19 -23.217  -9.684  12.408
  171    HE   ARG  19           HE       ARG  19 -24.662 -11.769  13.873
  172   HH11  ARG  19          HH21      ARG  19 -24.779  -9.269  11.458
  173   HH12  ARG  19          HH22      ARG  19 -26.490  -9.044  11.610
  174   HH21  ARG  19          HH11      ARG  19 -26.878 -11.457  14.062
  175   HH22  ARG  19          HH12      ARG  19 -27.672 -10.273  13.077
  176    H    ASP  20           HN       ASP  20 -24.320 -15.786   9.896
  177    HA   ASP  20           HA       ASP  20 -22.670 -17.696  11.374
  178    HB2  ASP  20           HB2      ASP  20 -24.504 -19.290  10.813
  179    HB3  ASP  20           HB1      ASP  20 -25.089 -17.829  11.603
  180    H    GLU  21           HN       GLU  21 -22.367 -16.430   8.406
  181    HA   GLU  21           HA       GLU  21 -21.633 -18.974   7.046
  182    HB2  GLU  21           HB2      GLU  21 -23.131 -17.396   5.837
  183    HB3  GLU  21           HB1      GLU  21 -21.864 -16.170   5.909
  184    HG2  GLU  21           HG2      GLU  21 -20.343 -17.638   4.650
  185    HG3  GLU  21           HG1      GLU  21 -21.574 -18.900   4.612
  186    H    LYS  22           HN       LYS  22 -19.604 -19.560   7.226
  187    HA   LYS  22           HA       LYS  22 -17.495 -17.705   8.002
  188    HB2  LYS  22           HB2      LYS  22 -17.576 -20.041   8.856
  189    HB3  LYS  22           HB1      LYS  22 -17.313 -20.632   7.214
  190    HG2  LYS  22           HG2      LYS  22 -15.157 -19.472   7.110
  191    HG3  LYS  22           HG1      LYS  22 -15.426 -18.782   8.711
  192    HD2  LYS  22           HD2      LYS  22 -15.487 -21.067   9.672
  193    HD3  LYS  22           HD1      LYS  22 -15.173 -21.737   8.071
  194    HE2  LYS  22           HE2      LYS  22 -13.342 -19.777   9.483
  195    HE3  LYS  22           HE1      LYS  22 -13.103 -21.525   9.467
  196    HZ1  LYS  22           HZ1      LYS  22 -13.524 -20.782   6.844
  197    HZ2  LYS  22           HZ2      LYS  22 -12.057 -21.270   7.550
  198    HZ3  LYS  22           HZ3      LYS  22 -12.463 -19.621   7.472
  199    H    TRP  23           HN       TRP  23 -16.019 -16.790   6.712
  200    HA   TRP  23           HA       TRP  23 -16.266 -17.203   3.785
  201    HB2  TRP  23           HB2      TRP  23 -14.623 -15.078   5.179
  202    HB3  TRP  23           HB1      TRP  23 -15.255 -15.073   3.532
  203    HD1  TRP  23           HD1      TRP  23 -18.185 -16.231   4.695
  204    HE1  TRP  23           HE1      TRP  23 -19.799 -14.475   5.654
  205    HE3  TRP  23           HE3      TRP  23 -14.908 -12.412   5.582
  206    HZ2  TRP  23           HZ2      TRP  23 -19.721 -11.802   6.659
  207    HZ3  TRP  23           HZ3      TRP  23 -15.711 -10.272   6.537
  208    HH2  TRP  23           HH2      TRP  23 -18.111  -9.961   7.074
  209    H    GLU  24           HN       GLU  24 -14.013 -16.738   2.694
  210    HA   GLU  24           HA       GLU  24 -12.083 -18.691   3.864
  211    HB2  GLU  24           HB2      GLU  24 -12.594 -17.868   0.989
  212    HB3  GLU  24           HB1      GLU  24 -11.319 -18.972   1.507
  213    HG2  GLU  24           HG2      GLU  24 -14.271 -19.403   2.049
  214    HG3  GLU  24           HG1      GLU  24 -13.384 -20.159   0.726
  215    H    CYS  25           HN       CYS  25 -10.360 -17.795   4.717
  216    HA   CYS  25           HA       CYS  25  -9.569 -15.057   4.144
  217    HB2  CYS  25           HB2      CYS  25  -8.034 -15.307   5.934
  218    HB3  CYS  25           HB1      CYS  25  -9.450 -16.245   6.411
  219    HG   CYS  25           HG       CYS  25  -6.949 -17.511   6.527
  220    H    GLU  26           HN       GLU  26  -7.640 -14.370   3.256
  221    HA   GLU  26           HA       GLU  26  -5.970 -16.387   1.841
  222    HB2  GLU  26           HB2      GLU  26  -7.611 -15.416   0.238
  223    HB3  GLU  26           HB1      GLU  26  -6.985 -13.806   0.607
  224    HG2  GLU  26           HG2      GLU  26  -4.751 -14.473  -0.167
  225    HG3  GLU  26           HG1      GLU  26  -5.332 -16.108  -0.483
  226    H    SER  27           HN       SER  27  -4.111 -16.183   2.879
  227    HA   SER  27           HA       SER  27  -3.093 -13.503   3.643
  228    HB2  SER  27           HB2      SER  27  -3.063 -15.152   5.423
  229    HB3  SER  27           HB1      SER  27  -2.219 -16.310   4.399
  230    HG   SER  27           HG       SER  27  -0.512 -14.711   4.280
  231    H    ILE  28           HN       ILE  28  -1.614 -12.548   2.457
  232    HA   ILE  28           HA       ILE  28   0.468 -14.032   1.052
  233    HB   ILE  28           HB       ILE  28  -1.422 -14.093  -0.553
  234   HG12  ILE  28          HG12      ILE  28   0.696 -12.134  -1.483
  235   HG13  ILE  28          HG11      ILE  28   1.013 -13.857  -1.269
  236   HG21  ILE  28          HG21      ILE  28  -1.183 -11.081  -0.651
  237   HG22  ILE  28          HG22      ILE  28  -2.410 -11.905   0.305
  238   HG23  ILE  28          HG23      ILE  28  -2.382 -12.096  -1.448
  239   HD11  ILE  28          HD11      ILE  28  -1.097 -12.659  -3.091
  240   HD12  ILE  28          HD12      ILE  28  -0.806 -14.383  -2.864
  241   HD13  ILE  28          HD13      ILE  28   0.429 -13.372  -3.612
  242    H    GLU  29           HN       GLU  29   2.216 -12.692   0.445
  243    HA   GLU  29           HA       GLU  29   2.302 -10.120   1.890
  244    HB2  GLU  29           HB2      GLU  29   4.475 -11.718   0.493
  245    HB3  GLU  29           HB1      GLU  29   4.734 -10.220   1.382
  246    HG2  GLU  29           HG2      GLU  29   5.210 -11.837   3.008
  247    HG3  GLU  29           HG1      GLU  29   3.527 -11.452   3.352
  248    H    GLU  30           HN       GLU  30   1.979  -8.255   0.900
  249    HA   GLU  30           HA       GLU  30   2.707  -7.968  -1.969
  250    HB2  GLU  30           HB2      GLU  30   0.061  -7.204  -0.706
  251    HB3  GLU  30           HB1      GLU  30   0.584  -6.674  -2.305
  252    HG2  GLU  30           HG2      GLU  30   0.390  -9.582  -1.488
  253    HG3  GLU  30           HG1      GLU  30  -0.890  -8.721  -2.334
  254    H    VAL  31           HN       VAL  31   3.192  -5.869  -2.618
  255    HA   VAL  31           HA       VAL  31   4.387  -4.189  -0.600
  256    HB   VAL  31           HB       VAL  31   3.891  -3.446  -3.490
  257   HG11  VAL  31          HG11      VAL  31   5.901  -2.106  -3.199
  258   HG12  VAL  31          HG12      VAL  31   6.144  -2.761  -1.580
  259   HG13  VAL  31          HG13      VAL  31   4.766  -1.710  -1.908
  260   HG21  VAL  31          HG21      VAL  31   6.122  -4.494  -3.928
  261   HG22  VAL  31          HG22      VAL  31   4.891  -5.673  -3.477
  262   HG23  VAL  31          HG23      VAL  31   6.092  -5.157  -2.293
  263    H    ALA  32           HN       ALA  32   3.747  -2.195   0.110
  264    HA   ALA  32           HA       ALA  32   0.990  -1.689   0.450
  265    HB1  ALA  32           HB1      ALA  32   1.711   0.512   1.318
  266    HB2  ALA  32           HB2      ALA  32   3.326   0.236   0.669
  267    HB3  ALA  32           HB3      ALA  32   2.705  -0.791   1.963
  268    H    ASP  33           HN       ASP  33   3.325  -0.412  -1.872
  269    HA   ASP  33           HA       ASP  33   1.548   1.539  -3.024
  270    HB2  ASP  33           HB2      ASP  33   4.127   0.273  -3.991
  271    HB3  ASP  33           HB1      ASP  33   3.280   1.534  -4.885
  272    H    ASP  34           HN       ASP  34   1.742  -1.844  -3.272
  273    HA   ASP  34           HA       ASP  34   0.561  -1.960  -5.981
  274    HB2  ASP  34           HB2      ASP  34   1.470  -4.084  -4.019
  275    HB3  ASP  34           HB1      ASP  34   0.680  -4.452  -5.552
  276    H    ILE  35           HN       ILE  35  -0.531  -1.407  -2.922
  277    HA   ILE  35           HA       ILE  35  -3.239  -2.435  -3.597
  278    HB   ILE  35           HB       ILE  35  -2.257  -4.073  -2.063
  279   HG12  ILE  35          HG12      ILE  35  -4.174  -2.311  -0.510
  280   HG13  ILE  35          HG11      ILE  35  -4.686  -3.306  -1.874
  281   HG21  ILE  35          HG21      ILE  35  -1.996  -1.889   0.003
  282   HG22  ILE  35          HG22      ILE  35  -0.657  -2.300  -1.064
  283   HG23  ILE  35          HG23      ILE  35  -1.318  -3.512   0.032
  284   HD11  ILE  35          HD11      ILE  35  -5.012  -4.444   0.324
  285   HD12  ILE  35          HD12      ILE  35  -3.271  -4.367   0.590
  286   HD13  ILE  35          HD13      ILE  35  -3.916  -5.324  -0.742
  287    H    LEU  36           HN       LEU  36  -1.345  -0.436  -1.307
  288    HA   LEU  36           HA       LEU  36  -3.650   1.214  -0.763
  289    HB2  LEU  36           HB2      LEU  36  -0.851   1.172   0.242
  290    HB3  LEU  36           HB1      LEU  36  -1.858   2.586   0.534
  291    HG   LEU  36           HG       LEU  36  -3.007  -0.130   1.134
  292   HD11  LEU  36          HD11      LEU  36  -0.833  -0.232   2.220
  293   HD12  LEU  36          HD12      LEU  36  -2.069   0.056   3.445
  294   HD13  LEU  36          HD13      LEU  36  -1.053   1.386   2.888
  295   HD21  LEU  36          HD21      LEU  36  -4.169   1.182   2.879
  296   HD22  LEU  36          HD22      LEU  36  -4.407   1.905   1.292
  297   HD23  LEU  36          HD23      LEU  36  -3.250   2.613   2.417
  298    HA   PRO  37           HA       PRO  37  -2.948   3.853  -4.337
  299    HB2  PRO  37           HB2      PRO  37  -4.349   5.812  -2.544
  300    HB3  PRO  37           HB1      PRO  37  -4.689   5.390  -4.234
  301    HG2  PRO  37           HG2      PRO  37  -6.203   4.480  -2.221
  302    HG3  PRO  37           HG1      PRO  37  -5.873   3.502  -3.665
  303    HD2  PRO  37           HD2      PRO  37  -4.795   3.206  -0.910
  304    HD3  PRO  37           HD1      PRO  37  -5.045   1.983  -2.191
  305    H    ASP  38           HN       ASP  38  -1.461   5.437  -4.867
  306    HA   ASP  38           HA       ASP  38   0.763   5.905  -3.268
  307    HB2  ASP  38           HB2      ASP  38   0.721   6.325  -5.695
  308    HB3  ASP  38           HB1      ASP  38  -0.331   7.718  -5.440
  309    H    GLN  39           HN       GLN  39  -2.275   7.609  -3.353
  310    HA   GLN  39           HA       GLN  39  -1.533   9.989  -1.985
  311    HB2  GLN  39           HB2      GLN  39  -3.670   9.694  -3.205
  312    HB3  GLN  39           HB1      GLN  39  -4.193   8.522  -1.996
  313    HG2  GLN  39           HG2      GLN  39  -4.150  10.206  -0.254
  314    HG3  GLN  39           HG1      GLN  39  -3.430  11.385  -1.350
  315   HE21  GLN  39          HE21      GLN  39  -5.950  11.833  -0.002
  316   HE22  GLN  39          HE22      GLN  39  -7.168  11.905  -1.184
  317    H    TYR  40           HN       TYR  40  -2.553   6.789  -0.822
  318    HA   TYR  40           HA       TYR  40  -2.441   7.700   1.986
  319    HB2  TYR  40           HB2      TYR  40  -3.290   5.137   0.624
  320    HB3  TYR  40           HB1      TYR  40  -3.049   5.209   2.371
  321    HD1  TYR  40           HD1      TYR  40  -4.310   6.973   3.715
  322    HD2  TYR  40           HD2      TYR  40  -5.275   5.996  -0.355
  323    HE1  TYR  40           HE1      TYR  40  -6.541   8.015   3.995
  324    HE2  TYR  40           HE2      TYR  40  -7.508   7.036  -0.075
  325    HH   TYR  40           HH       TYR  40  -8.317   9.118   1.979
  326    H    VAL  41           HN       VAL  41  -0.179   6.849  -0.206
  327    HA   VAL  41           HA       VAL  41   1.492   5.352   1.770
  328    HB   VAL  41           HB       VAL  41   1.823   5.542  -1.239
  329   HG11  VAL  41          HG11      VAL  41   3.321   3.453  -0.580
  330   HG12  VAL  41          HG12      VAL  41   3.371   4.245   0.991
  331   HG13  VAL  41          HG13      VAL  41   3.966   5.084  -0.442
  332   HG21  VAL  41          HG21      VAL  41  -0.194   4.224  -0.308
  333   HG22  VAL  41          HG22      VAL  41   0.996   3.115   0.369
  334   HG23  VAL  41          HG23      VAL  41   0.904   3.351  -1.377
  335    H    ARG  42           HN       ARG  42   0.958   8.407   0.779
  336    HA   ARG  42           HA       ARG  42   3.474   9.477   0.074
  337    HB2  ARG  42           HB2      ARG  42   1.178  10.711   1.631
  338    HB3  ARG  42           HB1      ARG  42   2.566  11.621   1.037
  339    HG2  ARG  42           HG2      ARG  42   2.040  10.920  -1.277
  340    HG3  ARG  42           HG1      ARG  42   0.641  10.027  -0.682
  341    HD2  ARG  42           HD2      ARG  42   1.037  13.006  -0.283
  342    HD3  ARG  42           HD1      ARG  42   0.072  12.306  -1.581
  343    HE   ARG  42           HE       ARG  42  -0.879  11.199   0.828
  344   HH11  ARG  42          HH21      ARG  42  -0.576  14.292  -0.715
  345   HH12  ARG  42          HH22      ARG  42  -1.975  14.955   0.062
  346   HH21  ARG  42          HH11      ARG  42  -2.697  12.070   1.839
  347   HH22  ARG  42          HH12      ARG  42  -3.172  13.702   1.504
  348    H    LEU  43           HN       LEU  43   2.326   8.219   3.064
  349    HA   LEU  43           HA       LEU  43   3.736   9.561   5.026
  350    HB2  LEU  43           HB2      LEU  43   3.083   6.625   4.704
  351    HB3  LEU  43           HB1      LEU  43   3.970   7.197   6.103
  352    HG   LEU  43           HG       LEU  43   1.499   7.068   6.489
  353   HD11  LEU  43          HD11      LEU  43   3.246   8.869   7.466
  354   HD12  LEU  43          HD12      LEU  43   1.536   8.919   7.862
  355   HD13  LEU  43          HD13      LEU  43   2.178   9.982   6.619
  356   HD21  LEU  43          HD21      LEU  43   0.026   8.622   5.382
  357   HD22  LEU  43          HD22      LEU  43   0.933   7.796   4.121
  358   HD23  LEU  43          HD23      LEU  43   1.374   9.437   4.602
  359    H    GLY  44           HN       GLY  44   5.113   6.438   4.676
  360    HA2  GLY  44           HA2      GLY  44   7.440   6.831   3.221
  361    HA3  GLY  44           HA1      GLY  44   7.797   7.501   4.800
  362    HA   PRO  45           HA       PRO  45   8.659   3.644   6.727
  363    HB2  PRO  45           HB2      PRO  45   6.107   3.724   8.302
  364    HB3  PRO  45           HB1      PRO  45   7.778   3.535   8.871
  365    HG2  PRO  45           HG2      PRO  45   6.450   5.842   9.146
  366    HG3  PRO  45           HG1      PRO  45   8.193   5.798   8.821
  367    HD2  PRO  45           HD2      PRO  45   5.962   6.515   6.977
  368    HD3  PRO  45           HD1      PRO  45   7.640   7.083   6.997
  369    H    LEU  46           HN       LEU  46   5.303   4.019   5.720
  370    HA   LEU  46           HA       LEU  46   4.915   1.129   5.347
  371    HB2  LEU  46           HB2      LEU  46   3.090   3.465   4.659
  372    HB3  LEU  46           HB1      LEU  46   2.641   1.761   4.669
  373    HG   LEU  46           HG       LEU  46   3.565   3.345   7.090
  374   HD11  LEU  46          HD11      LEU  46   1.346   4.044   6.569
  375   HD12  LEU  46          HD12      LEU  46   1.158   2.812   7.815
  376   HD13  LEU  46          HD13      LEU  46   0.855   2.409   6.126
  377   HD21  LEU  46          HD21      LEU  46   4.218   1.134   7.540
  378   HD22  LEU  46          HD22      LEU  46   2.874   0.445   6.627
  379   HD23  LEU  46          HD23      LEU  46   2.592   1.174   8.207
  380    H    SER  47           HN       SER  47   6.213   3.706   3.631
  381    HA   SER  47           HA       SER  47   5.377   3.090   0.958
  382    HB2  SER  47           HB2      SER  47   6.415   5.268   1.799
  383    HB3  SER  47           HB1      SER  47   7.969   4.439   1.731
  384    HG   SER  47           HG       SER  47   6.293   4.253  -0.488
  385    H    ASN  48           HN       ASN  48   6.166   1.737  -0.504
  386    HA   ASN  48           HA       ASN  48   7.267  -0.095  -1.399
  387    HB2  ASN  48           HB2      ASN  48   9.547   1.367  -0.052
  388    HB3  ASN  48           HB1      ASN  48   9.780  -0.035  -1.095
  389   HD21  ASN  48          HD21      ASN  48  10.791   2.604  -1.746
  390   HD22  ASN  48          HD22      ASN  48   9.983   3.133  -3.142
  391    H    LYS  49           HN       LYS  49   6.611   0.110   1.766
  392    HA   LYS  49           HA       LYS  49   8.228  -2.131   2.728
  393    HB2  LYS  49           HB2      LYS  49   7.523  -0.230   4.209
  394    HB3  LYS  49           HB1      LYS  49   5.858  -0.797   4.070
  395    HG2  LYS  49           HG2      LYS  49   6.525  -2.989   4.991
  396    HG3  LYS  49           HG1      LYS  49   8.189  -2.432   5.118
  397    HD2  LYS  49           HD2      LYS  49   7.478  -0.649   6.676
  398    HD3  LYS  49           HD1      LYS  49   5.815  -1.223   6.566
  399    HE2  LYS  49           HE2      LYS  49   6.496  -3.408   7.472
  400    HE3  LYS  49           HE1      LYS  49   8.167  -2.854   7.567
  401    HZ1  LYS  49           HZ1      LYS  49   7.441  -1.095   9.076
  402    HZ2  LYS  49           HZ2      LYS  49   7.086  -2.635   9.698
  403    HZ3  LYS  49           HZ3      LYS  49   5.852  -1.686   9.016
  404    H    ILE  50           HN       ILE  50   7.578  -4.201   2.960
  405    HA   ILE  50           HA       ILE  50   5.216  -5.050   1.456
  406    HB   ILE  50           HB       ILE  50   7.383  -6.607   2.905
  407   HG12  ILE  50          HG12      ILE  50   8.049  -7.206   0.577
  408   HG13  ILE  50          HG11      ILE  50   6.783  -6.148  -0.044
  409   HG21  ILE  50          HG21      ILE  50   5.456  -8.002   2.969
  410   HG22  ILE  50          HG22      ILE  50   6.357  -8.538   1.552
  411   HG23  ILE  50          HG23      ILE  50   4.943  -7.501   1.357
  412   HD11  ILE  50          HD11      ILE  50   7.909  -4.214   0.578
  413   HD12  ILE  50          HD12      ILE  50   9.272  -5.268   0.217
  414   HD13  ILE  50          HD13      ILE  50   8.783  -5.011   1.889
  415    H    LEU  51           HN       LEU  51   3.300  -5.118   2.390
  416    HA   LEU  51           HA       LEU  51   3.093  -5.642   5.319
  417    HB2  LEU  51           HB2      LEU  51   1.405  -4.100   3.354
  418    HB3  LEU  51           HB1      LEU  51   0.654  -4.766   4.803
  419    HG   LEU  51           HG       LEU  51   2.311  -3.596   6.207
  420   HD11  LEU  51          HD11      LEU  51   3.633  -1.741   4.942
  421   HD12  LEU  51          HD12      LEU  51   3.367  -2.745   3.516
  422   HD13  LEU  51          HD13      LEU  51   4.246  -3.391   4.900
  423   HD21  LEU  51          HD21      LEU  51   1.540  -1.245   5.670
  424   HD22  LEU  51          HD22      LEU  51   0.237  -2.428   5.799
  425   HD23  LEU  51          HD23      LEU  51   0.789  -1.892   4.211
  426    H    GLN  52           HN       GLN  52   1.928  -7.339   6.051
  427    HA   GLN  52           HA       GLN  52   1.335  -9.497   4.224
  428    HB2  GLN  52           HB2      GLN  52   2.133  -9.904   6.538
  429    HB3  GLN  52           HB1      GLN  52   0.626  -9.227   7.164
  430    HG2  GLN  52           HG2      GLN  52  -0.678 -10.962   6.100
  431    HG3  GLN  52           HG1      GLN  52   0.737 -11.566   5.241
  432   HE21  GLN  52          HE21      GLN  52  -0.805 -13.257   6.977
  433   HE22  GLN  52          HE22      GLN  52   0.160 -13.667   8.312
  434    H    THR  53           HN       THR  53  -0.288  -9.121   2.860
  435    HA   THR  53           HA       THR  53  -2.733  -7.755   3.623
  436    HB   THR  53           HB       THR  53  -3.427  -8.530   1.268
  437    HG1  THR  53           HG1      THR  53  -0.857  -8.918   0.546
  438   HG21  THR  53          HG21      THR  53  -2.053  -6.829   0.206
  439   HG22  THR  53          HG22      THR  53  -0.873  -6.919   1.513
  440   HG23  THR  53          HG23      THR  53  -2.484  -6.280   1.822
  441    H    ASN  54           HN       ASN  54  -4.630  -8.616   4.196
  442    HA   ASN  54           HA       ASN  54  -5.013 -11.564   3.993
  443    HB2  ASN  54           HB2      ASN  54  -5.384  -9.824   6.439
  444    HB3  ASN  54           HB1      ASN  54  -6.169 -11.392   6.262
  445   HD21  ASN  54          HD21      ASN  54  -4.238 -10.980   8.321
  446   HD22  ASN  54          HD22      ASN  54  -2.857 -11.901   7.963
  447    H    THR  55           HN       THR  55  -6.448 -11.417   2.353
  448    HA   THR  55           HA       THR  55  -8.883  -9.744   2.762
  449    HB   THR  55           HB       THR  55  -7.775 -10.956   0.215
  450    HG1  THR  55           HG1      THR  55  -6.717  -9.165   0.049
  451   HG21  THR  55          HG21      THR  55 -10.177 -10.748   0.083
  452   HG22  THR  55          HG22      THR  55  -9.476  -9.404  -0.816
  453   HG23  THR  55          HG23      THR  55 -10.125  -9.138   0.803
  454    H    TYR  56           HN       TYR  56 -10.793 -10.651   2.974
  455    HA   TYR  56           HA       TYR  56 -11.013 -13.624   2.701
  456    HB2  TYR  56           HB2      TYR  56 -12.819 -11.850   4.352
  457    HB3  TYR  56           HB1      TYR  56 -12.627 -13.595   4.436
  458    HD1  TYR  56           HD1      TYR  56 -10.732 -10.395   4.884
  459    HD2  TYR  56           HD2      TYR  56 -11.081 -14.548   5.932
  460    HE1  TYR  56           HE1      TYR  56  -8.944 -10.120   6.579
  461    HE2  TYR  56           HE2      TYR  56  -9.293 -14.267   7.626
  462    HH   TYR  56           HH       TYR  56  -8.425 -11.878   9.007
  463    H    TYR  57           HN       TYR  57 -12.629 -14.443   1.462
  464    HA   TYR  57           HA       TYR  57 -14.585 -12.549   0.258
  465    HB2  TYR  57           HB2      TYR  57 -14.270 -13.669  -1.927
  466    HB3  TYR  57           HB1      TYR  57 -12.814 -12.839  -1.384
  467    HD1  TYR  57           HD1      TYR  57 -14.426 -16.148  -1.812
  468    HD2  TYR  57           HD2      TYR  57 -10.809 -14.057  -0.810
  469    HE1  TYR  57           HE1      TYR  57 -13.149 -18.265  -2.003
  470    HE2  TYR  57           HE2      TYR  57  -9.533 -16.175  -0.999
  471    HH   TYR  57           HH       TYR  57 -11.095 -19.245  -1.276
  472    H    SER  58           HN       SER  58 -16.567 -13.310  -0.055
  473    HA   SER  58           HA       SER  58 -17.138 -16.185   0.432
  474    HB2  SER  58           HB2      SER  58 -17.455 -14.746   2.526
  475    HB3  SER  58           HB1      SER  58 -18.783 -13.966   1.673
  476    HG   SER  58           HG       SER  58 -19.951 -15.651   2.103
  477    H    ASP  59           HN       ASP  59 -19.422 -16.695  -0.190
  478    HA   ASP  59           HA       ASP  59 -19.926 -15.924  -2.878
  479    HB2  ASP  59           HB2      ASP  59 -21.662 -17.304  -0.806
  480    HB3  ASP  59           HB1      ASP  59 -22.174 -17.060  -2.475
  481    H    THR  60           HN       THR  60 -21.485 -14.983   0.170
  482    HA   THR  60           HA       THR  60 -23.459 -13.278  -1.001
  483    HB   THR  60           HB       THR  60 -23.635 -12.364   1.342
  484    HG1  THR  60           HG1      THR  60 -22.194 -12.914   2.797
  485   HG21  THR  60          HG21      THR  60 -23.504 -15.386   1.231
  486   HG22  THR  60          HG22      THR  60 -24.816 -14.440   0.530
  487   HG23  THR  60          HG23      THR  60 -24.533 -14.398   2.271
  488    H    LEU  61           HN       LEU  61 -20.193 -12.744   0.209
  489    HA   LEU  61           HA       LEU  61 -20.177  -9.907   0.143
  490    HB2  LEU  61           HB2      LEU  61 -17.965 -11.960  -0.117
  491    HB3  LEU  61           HB1      LEU  61 -17.658 -10.235  -0.035
  492    HG   LEU  61           HG       LEU  61 -19.279 -11.709   2.059
  493   HD11  LEU  61          HD11      LEU  61 -17.285 -11.802   3.431
  494   HD12  LEU  61          HD12      LEU  61 -16.353 -10.920   2.221
  495   HD13  LEU  61          HD13      LEU  61 -16.904 -12.560   1.887
  496   HD21  LEU  61          HD21      LEU  61 -18.353  -9.595   3.347
  497   HD22  LEU  61          HD22      LEU  61 -19.742  -9.429   2.293
  498   HD23  LEU  61          HD23      LEU  61 -18.147  -8.930   1.734
  499    H    HIS  62           HN       HIS  62 -19.347 -12.308  -2.315
  500    HA   HIS  62           HA       HIS  62 -18.386 -10.466  -4.278
  501    HB2  HIS  62           HB2      HIS  62 -17.974 -12.929  -4.324
  502    HB3  HIS  62           HB1      HIS  62 -19.676 -13.179  -4.715
  503    HD1  HIS  62           HD1      HIS  62 -20.514 -12.044  -7.009
  504    HD2  HIS  62           HD2      HIS  62 -16.379 -12.285  -6.531
  505    HE1  HIS  62           HE1      HIS  62 -19.506 -11.698  -9.306
  506    H    LYS  63           HN       LYS  63 -21.579 -11.876  -3.649
  507    HA   LYS  63           HA       LYS  63 -22.910 -10.795  -5.921
  508    HB2  LYS  63           HB2      LYS  63 -23.937 -11.609  -3.184
  509    HB3  LYS  63           HB1      LYS  63 -24.989 -11.135  -4.517
  510    HG2  LYS  63           HG2      LYS  63 -24.060 -12.945  -5.911
  511    HG3  LYS  63           HG1      LYS  63 -22.993 -13.422  -4.589
  512    HD2  LYS  63           HD2      LYS  63 -24.949 -13.904  -3.169
  513    HD3  LYS  63           HD1      LYS  63 -26.026 -13.409  -4.473
  514    HE2  LYS  63           HE2      LYS  63 -25.136 -15.211  -5.903
  515    HE3  LYS  63           HE1      LYS  63 -24.047 -15.705  -4.606
  516    HZ1  LYS  63           HZ1      LYS  63 -25.702 -16.667  -3.461
  517    HZ2  LYS  63           HZ2      LYS  63 -26.481 -16.725  -4.969
  518    HZ3  LYS  63           HZ3      LYS  63 -26.841 -15.480  -3.872
  519    H    SER  64           HN       SER  64 -22.431  -9.579  -2.632
  520    HA   SER  64           HA       SER  64 -23.940  -7.137  -3.077
  521    HB2  SER  64           HB2      SER  64 -23.191  -6.530  -0.847
  522    HB3  SER  64           HB1      SER  64 -23.668  -8.223  -0.833
  523    HG   SER  64           HG       SER  64 -21.428  -7.309  -0.009
  524    H    ASN  65           HN       ASN  65 -20.964  -8.212  -4.075
  525    HA   ASN  65           HA       ASN  65 -19.134  -7.200  -5.058
  526    HB2  ASN  65           HB2      ASN  65 -20.828  -4.690  -5.028
  527    HB3  ASN  65           HB1      ASN  65 -19.464  -5.043  -6.082
  528   HD21  ASN  65          HD21      ASN  65 -20.313  -7.909  -6.442
  529   HD22  ASN  65          HD22      ASN  65 -21.649  -7.853  -7.488
  530    H    ILE  66           HN       ILE  66 -19.429  -7.254  -2.137
  531    HA   ILE  66           HA       ILE  66 -17.743  -4.886  -1.418
  532    HB   ILE  66           HB       ILE  66 -19.410  -6.600   0.454
  533   HG12  ILE  66          HG12      ILE  66 -20.918  -5.368  -1.001
  534   HG13  ILE  66          HG11      ILE  66 -20.889  -4.569   0.563
  535   HG21  ILE  66          HG21      ILE  66 -18.969  -4.690   2.010
  536   HG22  ILE  66          HG22      ILE  66 -17.911  -3.981   0.789
  537   HG23  ILE  66          HG23      ILE  66 -17.495  -5.529   1.528
  538   HD11  ILE  66          HD11      ILE  66 -19.669  -3.679  -2.034
  539   HD12  ILE  66          HD12      ILE  66 -18.971  -3.119  -0.516
  540   HD13  ILE  66          HD13      ILE  66 -20.648  -2.760  -0.895
  541    H    TYR  67           HN       TYR  67 -15.714  -5.307  -0.896
  542    HA   TYR  67           HA       TYR  67 -14.977  -8.095  -0.258
  543    HB2  TYR  67           HB2      TYR  67 -13.463  -6.057  -1.829
  544    HB3  TYR  67           HB1      TYR  67 -12.764  -7.571  -1.261
  545    HD1  TYR  67           HD2      TYR  67 -13.756  -9.761  -2.001
  546    HD2  TYR  67           HD1      TYR  67 -14.948  -6.002  -3.707
  547    HE1  TYR  67           HE2      TYR  67 -14.763 -10.954  -3.930
  548    HE2  TYR  67           HE1      TYR  67 -15.954  -7.196  -5.634
  549    HH   TYR  67           HH       TYR  67 -15.300 -10.342  -6.393
  550    HA   PRO  68           HA       PRO  68 -13.555  -5.980   3.487
  551    HB2  PRO  68           HB2      PRO  68 -13.183  -8.216   4.987
  552    HB3  PRO  68           HB1      PRO  68 -14.793  -7.545   4.664
  553    HG2  PRO  68           HG2      PRO  68 -13.420  -9.858   3.385
  554    HG3  PRO  68           HG1      PRO  68 -15.123  -9.671   3.841
  555    HD2  PRO  68           HD2      PRO  68 -14.158  -9.360   1.280
  556    HD3  PRO  68           HD1      PRO  68 -15.659  -8.602   1.880
  557    H    PHE  69           HN       PHE  69 -11.526  -5.199   3.514
  558    HA   PHE  69           HA       PHE  69  -9.260  -7.106   3.087
  559    HB2  PHE  69           HB2      PHE  69  -9.914  -5.083   1.383
  560    HB3  PHE  69           HB1      PHE  69  -8.853  -4.204   2.480
  561    HD1  PHE  69           HD1      PHE  69  -6.704  -5.764   3.239
  562    HD2  PHE  69           HD2      PHE  69  -8.843  -5.998  -0.479
  563    HE1  PHE  69           HE1      PHE  69  -4.729  -6.802   2.166
  564    HE2  PHE  69           HE2      PHE  69  -6.867  -7.028  -1.552
  565    HZ   PHE  69           HZ       PHE  69  -4.808  -7.434  -0.234
  566    H    ILE  70           HN       ILE  70  -7.843  -7.229   4.654
  567    HA   ILE  70           HA       ILE  70  -7.606  -5.000   6.625
  568    HB   ILE  70           HB       ILE  70  -7.617  -7.960   7.294
  569   HG12  ILE  70          HG12      ILE  70  -9.679  -5.820   7.934
  570   HG13  ILE  70          HG11      ILE  70  -9.862  -7.013   6.649
  571   HG21  ILE  70          HG21      ILE  70  -7.604  -7.108   9.625
  572   HG22  ILE  70          HG22      ILE  70  -7.500  -5.457   9.013
  573   HG23  ILE  70          HG23      ILE  70  -6.173  -6.578   8.743
  574   HD11  ILE  70          HD11      ILE  70  -9.716  -7.499   9.628
  575   HD12  ILE  70          HD12      ILE  70  -9.471  -8.793   8.456
  576   HD13  ILE  70          HD13      ILE  70 -11.010  -7.939   8.515
  577    H    LEU  71           HN       LEU  71  -5.582  -4.430   7.077
  578    HA   LEU  71           HA       LEU  71  -3.368  -5.984   5.838
  579    HB2  LEU  71           HB2      LEU  71  -3.298  -3.149   6.911
  580    HB3  LEU  71           HB1      LEU  71  -2.101  -3.941   5.887
  581    HG   LEU  71           HG       LEU  71  -4.945  -3.226   5.119
  582   HD11  LEU  71          HD11      LEU  71  -3.152  -1.415   5.165
  583   HD12  LEU  71          HD12      LEU  71  -3.942  -1.662   3.607
  584   HD13  LEU  71          HD13      LEU  71  -2.330  -2.319   3.892
  585   HD21  LEU  71          HD21      LEU  71  -4.056  -4.043   2.813
  586   HD22  LEU  71          HD22      LEU  71  -4.547  -5.260   3.984
  587   HD23  LEU  71          HD23      LEU  71  -2.834  -4.900   3.752
  588    H    TYR  72           HN       TYR  72  -1.821  -6.869   6.989
  589    HA   TYR  72           HA       TYR  72  -1.609  -6.282   9.903
  590    HB2  TYR  72           HB2      TYR  72  -1.806  -8.970   8.524
  591    HB3  TYR  72           HB1      TYR  72  -1.092  -8.792  10.129
  592    HD1  TYR  72           HD1      TYR  72  -2.498  -7.527  11.911
  593    HD2  TYR  72           HD2      TYR  72  -4.140  -9.177   8.305
  594    HE1  TYR  72           HE1      TYR  72  -4.759  -7.500  12.928
  595    HE2  TYR  72           HE2      TYR  72  -6.402  -9.151   9.319
  596    HH   TYR  72           HH       TYR  72  -6.975  -8.884  12.520
  597    H    TYR  73           HN       TYR  73   0.476  -6.788  10.794
  598    HA   TYR  73           HA       TYR  73   2.675  -7.283   8.887
  599    HB2  TYR  73           HB2      TYR  73   2.502  -4.868   8.851
  600    HB3  TYR  73           HB1      TYR  73   2.470  -4.802  10.613
  601    HD1  TYR  73           HD2      TYR  73   4.571  -6.095   7.783
  602    HD2  TYR  73           HD1      TYR  73   4.487  -4.522  11.780
  603    HE1  TYR  73           HE2      TYR  73   7.050  -6.040   7.816
  604    HE2  TYR  73           HE1      TYR  73   6.964  -4.466  11.811
  605    HH   TYR  73           HH       TYR  73   8.819  -4.309   9.985
  606    H    GLN  74           HN       GLN  74   3.674  -8.930   9.756
  607    HA   GLN  74           HA       GLN  74   4.712 -10.358  11.248
  608    HB2  GLN  74           HB2      GLN  74   5.071  -7.748  12.743
  609    HB3  GLN  74           HB1      GLN  74   5.815  -9.272  13.230
  610    HG2  GLN  74           HG2      GLN  74   6.951  -9.436  11.054
  611    HG3  GLN  74           HG1      GLN  74   6.195  -7.930  10.537
  612   HE21  GLN  74          HE21      GLN  74   8.781  -7.586  10.372
  613   HE22  GLN  74          HE22      GLN  74   9.470  -6.827  11.725
  614    H    LYS  75           HN       LYS  75   3.161  -8.063  13.495
  615    HA   LYS  75           HA       LYS  75   1.076  -9.931  14.223
  616    HB2  LYS  75           HB2      LYS  75   3.171 -10.832  15.364
  617    HB3  LYS  75           HB1      LYS  75   3.144  -9.378  16.359
  618    HG2  LYS  75           HG2      LYS  75   0.914  -9.915  17.175
  619    HG3  LYS  75           HG1      LYS  75   0.808 -11.298  16.087
  620    HD2  LYS  75           HD2      LYS  75   3.122 -11.162  18.009
  621    HD3  LYS  75           HD1      LYS  75   1.539 -11.620  18.631
  622    HE2  LYS  75           HE2      LYS  75   2.733 -12.950  16.194
  623    HE3  LYS  75           HE1      LYS  75   3.052 -13.532  17.825
  624    HZ1  LYS  75           HZ1      LYS  75   1.203 -14.726  17.009
  625    HZ2  LYS  75           HZ2      LYS  75   0.430 -13.316  16.455
  626    HZ3  LYS  75           HZ3      LYS  75   0.584 -13.608  18.123
  627    H    GLN  76           HN       GLN  76   0.441  -7.603  13.385
  628    HA   GLN  76           HA       GLN  76  -0.768  -6.249  15.590
  629    HB2  GLN  76           HB2      GLN  76   1.508  -5.388  15.942
  630    HB3  GLN  76           HB1      GLN  76   1.548  -4.792  14.281
  631    HG2  GLN  76           HG2      GLN  76  -0.302  -3.274  14.728
  632    HG3  GLN  76           HG1      GLN  76  -0.510  -3.952  16.343
  633   HE21  GLN  76          HE21      GLN  76   0.005  -1.173  15.999
  634   HE22  GLN  76          HE22      GLN  76   1.555  -0.826  16.600
  635    H    LEU  77           HN       LEU  77  -2.266  -4.722  14.944
  636    HA   LEU  77           HA       LEU  77  -3.169  -4.945  12.206
  637    HB2  LEU  77           HB2      LEU  77  -4.750  -4.878  14.116
  638    HB3  LEU  77           HB1      LEU  77  -4.224  -3.237  14.483
  639    HG   LEU  77           HG       LEU  77  -4.958  -2.536  12.190
  640   HD11  LEU  77          HD11      LEU  77  -6.623  -4.274  11.149
  641   HD12  LEU  77          HD12      LEU  77  -5.700  -5.455  12.074
  642   HD13  LEU  77          HD13      LEU  77  -4.904  -4.461  10.854
  643   HD21  LEU  77          HD21      LEU  77  -7.256  -2.395  12.741
  644   HD22  LEU  77          HD22      LEU  77  -6.428  -2.480  14.291
  645   HD23  LEU  77          HD23      LEU  77  -7.222  -3.913  13.637
  646    H    ILE  78           HN       ILE  78  -2.853  -3.560  10.583
  647    HA   ILE  78           HA       ILE  78  -1.376  -1.034  11.139
  648    HB   ILE  78           HB       ILE  78  -1.717  -2.576   8.541
  649   HG12  ILE  78          HG12      ILE  78  -0.364  -3.825  10.163
  650   HG13  ILE  78          HG11      ILE  78   0.676  -3.175   8.897
  651   HG21  ILE  78          HG21      ILE  78  -0.132  -0.115   9.311
  652   HG22  ILE  78          HG22      ILE  78  -1.330  -0.270   8.025
  653   HG23  ILE  78          HG23      ILE  78   0.236  -1.068   7.873
  654   HD11  ILE  78          HD11      ILE  78   0.891  -1.124  10.600
  655   HD12  ILE  78          HD12      ILE  78   1.889  -2.552  10.778
  656   HD13  ILE  78          HD13      ILE  78   0.447  -2.359  11.770
  657    H    ALA  79           HN       ALA  79  -4.054  -2.323   9.149
  658    HA   ALA  79           HA       ALA  79  -5.585   0.115   9.555
  659    HB1  ALA  79           HB1      ALA  79  -5.655   0.841   7.256
  660    HB2  ALA  79           HB2      ALA  79  -4.674  -0.527   6.738
  661    HB3  ALA  79           HB3      ALA  79  -3.963   0.740   7.739
  662    H    ILE  80           HN       ILE  80  -7.699   0.006   8.614
  663    HA   ILE  80           HA       ILE  80  -8.567  -2.697   7.707
  664    HB   ILE  80           HB       ILE  80  -9.898  -0.968   9.816
  665   HG12  ILE  80          HG12      ILE  80  -8.863  -3.812   9.985
  666   HG13  ILE  80          HG11      ILE  80  -7.915  -2.411  10.484
  667   HG21  ILE  80          HG21      ILE  80 -11.648  -1.917   8.492
  668   HG22  ILE  80          HG22      ILE  80 -11.489  -2.970   9.896
  669   HG23  ILE  80          HG23      ILE  80 -10.797  -3.455   8.346
  670   HD11  ILE  80          HD11      ILE  80  -9.451  -1.858  12.215
  671   HD12  ILE  80          HD12      ILE  80  -9.255  -3.609  12.322
  672   HD13  ILE  80          HD13      ILE  80 -10.692  -2.925  11.563
  673    H    GLY  81           HN       GLY  81  -9.922  -2.656   6.011
  674    HA2  GLY  81           HA2      GLY  81 -11.777  -0.583   5.421
  675    HA3  GLY  81           HA1      GLY  81 -10.319  -0.329   4.471
  676    H    PHE  82           HN       PHE  82 -13.042  -1.029   3.641
  677    HA   PHE  82           HA       PHE  82 -12.505  -3.625   2.268
  678    HB2  PHE  82           HB2      PHE  82 -14.997  -3.790   2.047
  679    HB3  PHE  82           HB1      PHE  82 -14.426  -3.867   3.710
  680    HD1  PHE  82           HD1      PHE  82 -15.972  -1.639   1.170
  681    HD2  PHE  82           HD2      PHE  82 -15.042  -2.226   5.322
  682    HE1  PHE  82           HE1      PHE  82 -17.428   0.278   1.769
  683    HE2  PHE  82           HE2      PHE  82 -16.494  -0.306   5.920
  684    HZ   PHE  82           HZ       PHE  82 -17.688   0.944   4.142
  685    H    ILE  83           HN       ILE  83 -13.048  -3.774   0.088
  686    HA   ILE  83           HA       ILE  83 -12.943  -1.176  -1.336
  687    HB   ILE  83           HB       ILE  83 -12.542  -3.996  -2.383
  688   HG12  ILE  83          HG12      ILE  83 -10.500  -1.849  -1.730
  689   HG13  ILE  83          HG11      ILE  83 -10.848  -3.223  -0.685
  690   HG21  ILE  83          HG21      ILE  83 -11.522  -2.773  -4.311
  691   HG22  ILE  83          HG22      ILE  83 -12.050  -1.255  -3.587
  692   HG23  ILE  83          HG23      ILE  83 -13.244  -2.436  -4.128
  693   HD11  ILE  83          HD11      ILE  83  -9.894  -3.430  -3.556
  694   HD12  ILE  83          HD12      ILE  83 -10.173  -4.777  -2.452
  695   HD13  ILE  83          HD13      ILE  83  -8.871  -3.630  -2.133
  696    H    ASP  84           HN       ASP  84 -14.738  -0.346  -2.073
  697    HA   ASP  84           HA       ASP  84 -17.185  -1.928  -2.330
  698    HB2  ASP  84           HB2      ASP  84 -16.555   1.014  -2.660
  699    HB3  ASP  84           HB1      ASP  84 -18.144   0.338  -3.015
  700    H    GLU  85           HN       GLU  85 -18.313  -2.275  -4.198
  701    HA   GLU  85           HA       GLU  85 -18.463  -2.975  -6.419
  702    HB2  GLU  85           HB2      GLU  85 -17.492  -0.121  -6.692
  703    HB3  GLU  85           HB1      GLU  85 -18.124  -1.083  -8.028
  704    HG2  GLU  85           HG2      GLU  85 -20.264  -1.349  -6.862
  705    HG3  GLU  85           HG1      GLU  85 -19.643  -0.441  -5.485
  706    H    ASN  86           HN       ASN  86 -16.203  -0.960  -7.821
  707    HA   ASN  86           HA       ASN  86 -14.190  -3.161  -8.003
  708    HB2  ASN  86           HB2      ASN  86 -15.537  -2.561 -10.079
  709    HB3  ASN  86           HB1      ASN  86 -14.720  -0.999 -10.055
  710   HD21  ASN  86          HD21      ASN  86 -13.655  -1.566 -12.117
  711   HD22  ASN  86          HD22      ASN  86 -12.348  -2.648 -12.141
  712    H    HIS  87           HN       HIS  87 -14.778  -0.000  -6.908
  713    HA   HIS  87           HA       HIS  87 -11.913   0.392  -6.347
  714    HB2  HIS  87           HB2      HIS  87 -12.598   1.550  -8.594
  715    HB3  HIS  87           HB1      HIS  87 -13.442   2.705  -7.563
  716    HD1  HIS  87           HD1      HIS  87 -11.094   3.790  -9.124
  717    HD2  HIS  87           HD2      HIS  87 -10.657   2.100  -5.338
  718    HE1  HIS  87           HE1      HIS  87  -8.935   4.710  -8.173
  719    H    ASP  88           HN       ASP  88 -12.493   3.226  -5.725
  720    HA   ASP  88           HA       ASP  88 -12.994   4.467  -3.831
  721    HB2  ASP  88           HB2      ASP  88 -15.262   4.129  -4.887
  722    HB3  ASP  88           HB1      ASP  88 -15.505   2.786  -3.771
  723    H    MET  89           HN       MET  89 -11.360   3.642  -2.483
  724    HA   MET  89           HA       MET  89 -11.881   1.265  -0.853
  725    HB2  MET  89           HB2      MET  89  -9.591   3.259  -0.865
  726    HB3  MET  89           HB1      MET  89  -9.673   1.840   0.181
  727    HG2  MET  89           HG2      MET  89  -9.826   0.382  -1.804
  728    HG3  MET  89           HG1      MET  89  -9.723   1.797  -2.851
  729    HE1  MET  89           HE1      MET  89  -6.373   0.053  -3.392
  730    HE2  MET  89           HE2      MET  89  -7.280   1.351  -4.163
  731    HE3  MET  89           HE3      MET  89  -8.115  -0.112  -3.645
  732    H    ASP  90           HN       ASP  90 -12.793   1.271   1.082
  733    HA   ASP  90           HA       ASP  90 -13.183   3.879   2.494
  734    HB2  ASP  90           HB2      ASP  90 -15.266   2.818   1.667
  735    HB3  ASP  90           HB1      ASP  90 -14.895   1.383   2.619
  736    H    PHE  91           HN       PHE  91 -11.727   4.018   4.056
  737    HA   PHE  91           HA       PHE  91 -10.947   1.609   5.604
  738    HB2  PHE  91           HB2      PHE  91  -9.768   4.393   5.378
  739    HB3  PHE  91           HB1      PHE  91  -9.218   3.204   6.561
  740    HD1  PHE  91           HD2      PHE  91  -8.123   1.118   5.851
  741    HD2  PHE  91           HD1      PHE  91  -9.325   4.102   3.004
  742    HE1  PHE  91           HE2      PHE  91  -6.718   0.033   4.118
  743    HE2  PHE  91           HE1      PHE  91  -7.920   3.017   1.273
  744    HZ   PHE  91           HZ       PHE  91  -6.617   0.982   1.831
  745    H    LEU  92           HN       LEU  92 -11.613   1.307   7.626
  746    HA   LEU  92           HA       LEU  92 -13.315   3.384   8.907
  747    HB2  LEU  92           HB2      LEU  92 -13.016   0.445   9.623
  748    HB3  LEU  92           HB1      LEU  92 -14.245   1.555  10.210
  749    HG   LEU  92           HG       LEU  92 -15.279   0.260   8.469
  750   HD11  LEU  92          HD11      LEU  92 -16.063   1.990   7.063
  751   HD12  LEU  92          HD12      LEU  92 -14.510   2.812   7.052
  752   HD13  LEU  92          HD13      LEU  92 -15.525   2.844   8.503
  753   HD21  LEU  92          HD21      LEU  92 -14.233  -0.421   6.550
  754   HD22  LEU  92          HD22      LEU  92 -12.765  -0.073   7.435
  755   HD23  LEU  92          HD23      LEU  92 -13.419   1.111   6.308
  756    H    TYR  93           HN       TYR  93 -10.269   1.858   9.135
  757    HA   TYR  93           HA       TYR  93  -9.602   3.463  11.468
  758    HB2  TYR  93           HB2      TYR  93 -10.626   1.522  12.556
  759    HB3  TYR  93           HB1      TYR  93  -9.566   0.438  11.652
  760    HD1  TYR  93           HD1      TYR  93  -9.537   3.284  14.078
  761    HD2  TYR  93           HD2      TYR  93  -7.401  -0.069  12.449
  762    HE1  TYR  93           HE1      TYR  93  -7.775   3.569  15.800
  763    HE2  TYR  93           HE2      TYR  93  -5.640   0.217  14.170
  764    HH   TYR  93           HH       TYR  93  -5.365   2.999  16.070
  765    H    LEU  94           HN       LEU  94  -7.734   4.294  10.872
  766    HA   LEU  94           HA       LEU  94  -5.769   2.584   9.424
  767    HB2  LEU  94           HB2      LEU  94  -6.492   4.437   8.030
  768    HB3  LEU  94           HB1      LEU  94  -6.191   5.589   9.333
  769    HG   LEU  94           HG       LEU  94  -3.794   5.111   9.260
  770   HD11  LEU  94          HD11      LEU  94  -3.056   3.597   7.251
  771   HD12  LEU  94          HD12      LEU  94  -4.686   2.943   7.370
  772   HD13  LEU  94          HD13      LEU  94  -3.586   2.831   8.745
  773   HD21  LEU  94          HD21      LEU  94  -4.874   6.716   7.594
  774   HD22  LEU  94          HD22      LEU  94  -4.729   5.424   6.402
  775   HD23  LEU  94          HD23      LEU  94  -3.282   6.100   7.151
  776    H    HIS  95           HN       HIS  95  -4.028   2.075  10.521
  777    HA   HIS  95           HA       HIS  95  -3.017   3.911  12.633
  778    HB2  HIS  95           HB2      HIS  95  -4.227   2.082  13.731
  779    HB3  HIS  95           HB1      HIS  95  -3.260   0.901  12.847
  780    HD1  HIS  95           HD1      HIS  95  -0.872   3.378  13.457
  781    HD2  HIS  95           HD2      HIS  95  -2.757   0.636  15.971
  782    HE1  HIS  95           HE1      HIS  95   0.624   3.131  15.490
  783    H    ASN  96           HN       ASN  96  -1.209   4.632  11.735
  784    HA   ASN  96           HA       ASN  96   0.514   2.911  10.109
  785    HB2  ASN  96           HB2      ASN  96   0.721   5.801  11.011
  786    HB3  ASN  96           HB1      ASN  96   1.972   4.992  10.068
  787   HD21  ASN  96          HD21      ASN  96   0.604   7.230   8.981
  788   HD22  ASN  96          HD22      ASN  96  -0.380   6.707   7.699
  789    H    THR  97           HN       THR  97   2.906   2.946  10.674
  790    HA   THR  97           HA       THR  97   3.301   1.695  13.199
  791    HB   THR  97           HB       THR  97   5.731   1.860  12.640
  792    HG1  THR  97           HG1      THR  97   6.203   3.521  11.462
  793   HG21  THR  97          HG21      THR  97   4.316   0.044  11.726
  794   HG22  THR  97          HG22      THR  97   5.604   0.493  10.609
  795   HG23  THR  97          HG23      THR  97   3.956   1.050  10.321
  796    H    VAL  98           HN       VAL  98   3.598   5.012  12.126
  797    HA   VAL  98           HA       VAL  98   4.942   5.861  14.595
  798    HB   VAL  98           HB       VAL  98   3.875   7.466  12.247
  799   HG11  VAL  98          HG11      VAL  98   5.451   9.209  13.215
  800   HG12  VAL  98          HG12      VAL  98   5.567   8.197  14.653
  801   HG13  VAL  98          HG13      VAL  98   4.014   8.888  14.185
  802   HG21  VAL  98          HG21      VAL  98   5.672   6.035  11.512
  803   HG22  VAL  98          HG22      VAL  98   6.622   6.390  12.954
  804   HG23  VAL  98          HG23      VAL  98   6.360   7.644  11.741
  805    H    MET  99           HN       MET  99   1.864   6.635  12.941
  806    HA   MET  99           HA       MET  99   0.382   6.563  15.385
  807    HB2  MET  99           HB2      MET  99  -0.098   8.968  15.590
  808    HB3  MET  99           HB1      MET  99   1.623   8.661  15.759
  809    HG2  MET  99           HG2      MET  99   1.803   9.156  13.248
  810    HG3  MET  99           HG1      MET  99   0.155   9.776  13.360
  811    HE1  MET  99           HE1      MET  99   1.308  11.609  12.223
  812    HE2  MET  99           HE2      MET  99   1.980  13.016  13.043
  813    HE3  MET  99           HE3      MET  99   0.280  12.608  13.260
  814    HA   PRO 100           HA       PRO 100  -2.819   6.192  12.345
  815    HB2  PRO 100           HB2      PRO 100  -5.015   6.952  13.854
  816    HB3  PRO 100           HB1      PRO 100  -4.256   5.355  13.949
  817    HG2  PRO 100           HG2      PRO 100  -3.969   7.693  15.767
  818    HG3  PRO 100           HG1      PRO 100  -4.006   5.961  16.146
  819    HD2  PRO 100           HD2      PRO 100  -1.692   7.413  16.080
  820    HD3  PRO 100           HD1      PRO 100  -1.747   5.678  15.712
  821    H    LEU 101           HN       LEU 101  -3.963   7.472  10.878
  822    HA   LEU 101           HA       LEU 101  -3.516  10.395  11.160
  823    HB2  LEU 101           HB2      LEU 101  -4.343   8.803   8.710
  824    HB3  LEU 101           HB1      LEU 101  -3.838  10.492   8.756
  825    HG   LEU 101           HG       LEU 101  -2.100   8.143   9.574
  826   HD11  LEU 101          HD11      LEU 101  -1.781   9.947   7.165
  827   HD12  LEU 101          HD12      LEU 101  -2.627   8.401   7.086
  828   HD13  LEU 101          HD13      LEU 101  -0.919   8.449   7.519
  829   HD21  LEU 101          HD21      LEU 101  -0.342  10.092   9.328
  830   HD22  LEU 101          HD22      LEU 101  -1.283   9.957  10.807
  831   HD23  LEU 101          HD23      LEU 101  -1.741  11.136   9.574
  832    H    LEU 102           HN       LEU 102  -6.103   8.458   9.610
  833    HA   LEU 102           HA       LEU 102  -8.053  10.551  10.215
  834    HB2  LEU 102           HB2      LEU 102  -8.453   7.841   8.907
  835    HB3  LEU 102           HB1      LEU 102  -9.599   9.179   8.910
  836    HG   LEU 102           HG       LEU 102  -6.814   9.290   7.706
  837   HD11  LEU 102          HD11      LEU 102  -7.968   9.272   5.544
  838   HD12  LEU 102          HD12      LEU 102  -9.529   9.156   6.356
  839   HD13  LEU 102          HD13      LEU 102  -8.384   7.818   6.452
  840   HD21  LEU 102          HD21      LEU 102  -9.061  11.275   8.028
  841   HD22  LEU 102          HD22      LEU 102  -7.998  11.389   6.627
  842   HD23  LEU 102          HD23      LEU 102  -7.326  11.509   8.247
  843    H    ASP 103           HN       ASP 103  -8.583   7.069  10.557
  844    HA   ASP 103           HA       ASP 103  -9.625   5.803  12.190
  845    HB2  ASP 103           HB2      ASP 103  -8.129   7.817  13.862
  846    HB3  ASP 103           HB1      ASP 103  -9.132   6.574  14.606
  847    H    GLN 104           HN       GLN 104 -11.181   7.802  10.911
  848    HA   GLN 104           HA       GLN 104 -12.750   9.342  12.719
  849    HB2  GLN 104           HB2      GLN 104 -13.345   8.255   9.954
  850    HB3  GLN 104           HB1      GLN 104 -14.401   9.378  10.816
  851    HG2  GLN 104           HG2      GLN 104 -12.556  11.003  10.984
  852    HG3  GLN 104           HG1      GLN 104 -11.490   9.888  10.131
  853   HE21  GLN 104          HE21      GLN 104 -11.201  10.860   8.102
  854   HE22  GLN 104          HE22      GLN 104 -12.469  11.366   7.092
  855    H    ARG 105           HN       ARG 105 -13.989   8.598  14.275
  856    HA   ARG 105           HA       ARG 105 -14.852   5.873  14.496
  857    HB2  ARG 105           HB2      ARG 105 -16.102   6.665  16.467
  858    HB3  ARG 105           HB1      ARG 105 -14.454   7.290  16.469
  859    HG2  ARG 105           HG2      ARG 105 -15.283   9.419  15.486
  860    HG3  ARG 105           HG1      ARG 105 -16.932   8.794  15.564
  861    HD2  ARG 105           HD2      ARG 105 -16.730   8.548  18.015
  862    HD3  ARG 105           HD1      ARG 105 -15.086   9.180  17.942
  863    HE   ARG 105           HE       ARG 105 -17.022  10.988  16.753
  864   HH11  ARG 105          HH21      ARG 105 -15.573   9.867  19.703
  865   HH12  ARG 105          HH22      ARG 105 -15.873  11.345  20.555
  866   HH21  ARG 105          HH11      ARG 105 -17.410  12.904  17.869
  867   HH22  ARG 105          HH12      ARG 105 -16.910  13.059  19.521
  868    H    TYR 106           HN       TYR 106 -16.241   8.727  13.079
  869    HA   TYR 106           HA       TYR 106 -18.991   8.038  13.133
  870    HB2  TYR 106           HB2      TYR 106 -17.467   9.581  11.001
  871    HB3  TYR 106           HB1      TYR 106 -19.214   9.589  11.230
  872    HD1  TYR 106           HD2      TYR 106 -20.208  10.547  13.316
  873    HD2  TYR 106           HD1      TYR 106 -16.019  10.881  12.420
  874    HE1  TYR 106           HE2      TYR 106 -19.988  12.342  15.012
  875    HE2  TYR 106           HE1      TYR 106 -15.801  12.676  14.118
  876    HH   TYR 106           HH       TYR 106 -18.606  13.713  16.063
  877    H    LEU 107           HN       LEU 107 -16.498   7.395  10.679
  878    HA   LEU 107           HA       LEU 107 -18.178   5.898   8.915
  879    HB2  LEU 107           HB2      LEU 107 -15.170   5.920   9.323
  880    HB3  LEU 107           HB1      LEU 107 -15.972   5.074   8.007
  881    HG   LEU 107           HG       LEU 107 -16.276   8.045   8.537
  882   HD11  LEU 107          HD11      LEU 107 -14.653   6.729   6.348
  883   HD12  LEU 107          HD12      LEU 107 -13.937   7.266   7.867
  884   HD13  LEU 107          HD13      LEU 107 -14.692   8.436   6.785
  885   HD21  LEU 107          HD21      LEU 107 -16.977   7.786   5.988
  886   HD22  LEU 107          HD22      LEU 107 -18.138   7.456   7.261
  887   HD23  LEU 107          HD23      LEU 107 -17.309   6.123   6.459
  888    H    LEU 108           HN       LEU 108 -16.015   5.024  11.572
  889    HA   LEU 108           HA       LEU 108 -16.222   2.203  11.290
  890    HB2  LEU 108           HB2      LEU 108 -14.672   3.736  12.821
  891    HB3  LEU 108           HB1      LEU 108 -15.942   3.474  14.013
  892    HG   LEU 108           HG       LEU 108 -14.485   1.270  12.519
  893   HD11  LEU 108          HD11      LEU 108 -13.548   0.796  14.811
  894   HD12  LEU 108          HD12      LEU 108 -14.210   2.347  15.329
  895   HD13  LEU 108          HD13      LEU 108 -12.967   2.293  14.079
  896   HD21  LEU 108          HD21      LEU 108 -16.755   1.332  14.493
  897   HD22  LEU 108          HD22      LEU 108 -15.631  -0.020  14.531
  898   HD23  LEU 108          HD23      LEU 108 -16.534   0.317  13.067
  899    H    THR 109           HN       THR 109 -18.108   4.541  13.197
  900    HA   THR 109           HA       THR 109 -19.970   2.404  14.042
  901    HB   THR 109           HB       THR 109 -20.946   4.096  15.487
  902    HG1  THR 109           HG1      THR 109 -19.094   5.930  14.396
  903   HG21  THR 109          HG21      THR 109 -18.898   3.010  16.287
  904   HG22  THR 109          HG22      THR 109 -18.956   4.684  16.838
  905   HG23  THR 109          HG23      THR 109 -17.918   4.237  15.483
  906    H    GLY 110           HN       GLY 110 -19.578   4.299  11.379
  907    HA2  GLY 110           HA2      GLY 110 -21.002   4.550   9.535
  908    HA3  GLY 110           HA1      GLY 110 -22.310   3.854  10.489
  909    H    GLY 111           HN       GLY 111 -23.267   5.763   9.144
  910    HA2  GLY 111           HA2      GLY 111 -22.878   8.426  10.256
  911    HA3  GLY 111           HA1      GLY 111 -24.056   7.971   9.026
  912    H    GLN 112           HN       GLN 112 -24.382   5.745  11.409
  913    HA   GLN 112           HA       GLN 112 -26.933   6.664  12.265
  914    HB2  GLN 112           HB2      GLN 112 -25.057   4.530  13.313
  915    HB3  GLN 112           HB1      GLN 112 -26.625   4.847  14.057
  916    HG2  GLN 112           HG2      GLN 112 -26.912   3.069  12.437
  917    HG3  GLN 112           HG1      GLN 112 -27.693   4.516  11.806
  918   HE21  GLN 112          HE21      GLN 112 -24.798   2.466  11.487
  919   HE22  GLN 112          HE22      GLN 112 -24.352   3.044   9.954
  920    H    LEU 113           HN       LEU 113 -27.622   7.372  14.319
  921    HA   LEU 113           HA       LEU 113 -26.011   9.425  15.467
  922    HB2  LEU 113           HB2      LEU 113 -28.459   9.565  15.472
  923    HB3  LEU 113           HB1      LEU 113 -28.561   8.136  16.503
  924    HG   LEU 113           HG       LEU 113 -27.358   9.330  18.298
  925   HD11  LEU 113          HD11      LEU 113 -25.901  10.841  17.271
  926   HD12  LEU 113          HD12      LEU 113 -27.165  11.919  17.847
  927   HD13  LEU 113          HD13      LEU 113 -27.132  11.430  16.153
  928   HD21  LEU 113          HD21      LEU 113 -29.739   9.548  18.394
  929   HD22  LEU 113          HD22      LEU 113 -29.744  10.750  17.102
  930   HD23  LEU 113          HD23      LEU 113 -29.081  11.159  18.684
  931    H    GLU 114           HN       GLU 114 -24.670   9.428  17.164
  932    HA   GLU 114           HA       GLU 114 -23.671   6.993  18.259
  933    HB2  GLU 114           HB2      GLU 114 -22.286   8.408  19.677
  934    HB3  GLU 114           HB1      GLU 114 -22.337   9.089  18.052
  935    HG2  GLU 114           HG2      GLU 114 -24.175  10.620  18.821
  936    HG3  GLU 114           HG1      GLU 114 -23.948  10.005  20.456
  937    H    HIS 115           HN       HIS 115 -24.093   5.924  20.094
  938    HA   HIS 115           HA       HIS 115 -26.532   6.629  21.578
  939    HB2  HIS 115           HB2      HIS 115 -26.302   4.405  22.579
  940    HB3  HIS 115           HB1      HIS 115 -26.185   4.300  20.824
  941    HD1  HIS 115           HD1      HIS 115 -23.832   3.786  19.808
  942    HD2  HIS 115           HD2      HIS 115 -23.907   3.768  23.978
  943    HE1  HIS 115           HE1      HIS 115 -21.645   2.752  20.561
  944    H    HIS 116           HN       HIS 116 -23.838   8.022  21.827
  945    HA   HIS 116           HA       HIS 116 -22.611   9.053  23.494
  946    HB2  HIS 116           HB2      HIS 116 -24.935   9.518  24.344
  947    HB3  HIS 116           HB1      HIS 116 -24.789   8.080  25.356
  948    HD1  HIS 116           HD1      HIS 116 -23.032   8.147  27.297
  949    HD2  HIS 116           HD2      HIS 116 -23.412  11.742  25.222
  950    HE1  HIS 116           HE1      HIS 116 -21.855   9.906  28.689
  951    H    HIS 117           HN       HIS 117 -21.138   8.605  25.196
  952    HA   HIS 117           HA       HIS 117 -20.300   5.819  25.265
  953    HB2  HIS 117           HB2      HIS 117 -19.155   8.270  26.652
  954    HB3  HIS 117           HB1      HIS 117 -18.400   6.676  26.611
  955    HD1  HIS 117           HD1      HIS 117 -17.906   5.735  24.093
  956    HD2  HIS 117           HD2      HIS 117 -18.519   9.842  24.458
  957    HE1  HIS 117           HE1      HIS 117 -16.987   6.787  21.980
  958    H    HIS 118           HN       HIS 118 -20.527   4.404  26.885
  959    HA   HIS 118           HA       HIS 118 -21.249   5.230  29.588
  960    HB2  HIS 118           HB2      HIS 118 -23.444   5.263  28.475
  961    HB3  HIS 118           HB1      HIS 118 -23.195   3.607  27.920
  962    HD1  HIS 118           HD1      HIS 118 -23.399   5.566  31.182
  963    HD2  HIS 118           HD2      HIS 118 -23.963   1.684  29.771
  964    HE1  HIS 118           HE1      HIS 118 -24.342   4.231  33.117
  965    H    HIS 119           HN       HIS 119 -19.203   4.163  29.874
  966    HA   HIS 119           HA       HIS 119 -19.432   1.182  29.915
  967    HB2  HIS 119           HB2      HIS 119 -17.792   2.034  28.216
  968    HB3  HIS 119           HB1      HIS 119 -16.878   2.773  29.533
  969    HD1  HIS 119           HD1      HIS 119 -18.206  -0.665  28.536
  970    HD2  HIS 119           HD2      HIS 119 -15.092   1.030  30.728
  971    HE1  HIS 119           HE1      HIS 119 -16.730  -2.582  29.285
  972    H    HIS 120           HN       HIS 120 -19.321   0.330  31.852
  973    HA   HIS 120           HA       HIS 120 -17.554   1.311  33.925
  974    HB2  HIS 120           HB2      HIS 120 -19.407   2.915  34.176
  975    HB3  HIS 120           HB1      HIS 120 -20.552   1.582  34.330
  976    HD1  HIS 120           HD1      HIS 120 -17.398   2.866  36.055
  977    HD2  HIS 120           HD2      HIS 120 -20.852   0.706  36.946
  978    HE1  HIS 120           HE1      HIS 120 -17.371   2.471  38.556
  Start of MODEL   17
    1    H1   MET   1           HT1      MET   1  -8.070 -11.544  19.016
    2    H2   MET   1           HT2      MET   1  -8.303 -10.540  20.366
    3    H3   MET   1           HT3      MET   1  -6.769 -10.656  19.646
    4    HA   MET   1           HA       MET   1  -7.777  -8.592  19.005
    5    HB2  MET   1           HB2      MET   1  -7.974  -9.132  16.450
    6    HB3  MET   1           HB1      MET   1  -6.429  -9.390  17.256
    7    HG2  MET   1           HG2      MET   1  -6.945 -11.776  17.529
    8    HG3  MET   1           HG1      MET   1  -8.522 -11.534  16.777
    9    HE1  MET   1           HE1      MET   1  -6.495 -13.733  15.638
   10    HE2  MET   1           HE2      MET   1  -6.901 -13.451  13.947
   11    HE3  MET   1           HE3      MET   1  -8.156 -13.335  15.177
   12    H    THR   2           HN       THR   2  -9.699  -7.551  19.016
   13    HA   THR   2           HA       THR   2 -12.193  -9.118  18.517
   14    HB   THR   2           HB       THR   2 -11.795  -6.368  19.747
   15    HG1  THR   2           HG1      THR   2 -11.739  -7.369  21.611
   16   HG21  THR   2          HG21      THR   2 -14.207  -8.123  19.293
   17   HG22  THR   2          HG22      THR   2 -13.998  -6.416  18.902
   18   HG23  THR   2          HG23      THR   2 -14.177  -6.919  20.582
   19    H    LEU   3           HN       LEU   3 -10.084  -7.013  16.953
   20    HA   LEU   3           HA       LEU   3 -11.883  -5.336  15.485
   21    HB2  LEU   3           HB2      LEU   3  -9.078  -6.343  15.034
   22    HB3  LEU   3           HB1      LEU   3  -9.887  -5.404  13.782
   23    HG   LEU   3           HG       LEU   3  -8.484  -4.030  15.355
   24   HD11  LEU   3          HD11      LEU   3 -11.287  -3.112  15.865
   25   HD12  LEU   3          HD12      LEU   3 -10.810  -3.319  14.181
   26   HD13  LEU   3          HD13      LEU   3  -9.905  -2.229  15.225
   27   HD21  LEU   3          HD21      LEU   3  -9.135  -5.517  17.342
   28   HD22  LEU   3          HD22      LEU   3 -10.639  -4.598  17.398
   29   HD23  LEU   3          HD23      LEU   3  -9.097  -3.778  17.642
   30    H    GLU   4           HN       GLU   4 -10.574  -8.577  14.852
   31    HA   GLU   4           HA       GLU   4 -11.582  -8.918  12.229
   32    HB2  GLU   4           HB2      GLU   4 -11.218 -10.920  14.479
   33    HB3  GLU   4           HB1      GLU   4 -11.542 -11.365  12.804
   34    HG2  GLU   4           HG2      GLU   4  -9.181  -9.680  13.688
   35    HG3  GLU   4           HG1      GLU   4  -9.104 -11.417  13.390
   36    H    LEU   5           HN       LEU   5 -13.096  -9.653  15.378
   37    HA   LEU   5           HA       LEU   5 -15.567 -10.585  14.275
   38    HB2  LEU   5           HB2      LEU   5 -14.940 -11.062  16.593
   39    HB3  LEU   5           HB1      LEU   5 -14.964  -9.342  16.975
   40    HG   LEU   5           HG       LEU   5 -17.370  -9.238  16.508
   41   HD11  LEU   5          HD11      LEU   5 -17.816 -10.791  14.810
   42   HD12  LEU   5          HD12      LEU   5 -18.502 -11.589  16.223
   43   HD13  LEU   5          HD13      LEU   5 -16.922 -12.081  15.612
   44   HD21  LEU   5          HD21      LEU   5 -16.824  -9.771  18.775
   45   HD22  LEU   5          HD22      LEU   5 -16.476 -11.451  18.368
   46   HD23  LEU   5          HD23      LEU   5 -18.135 -10.856  18.315
   47    H    GLN   6           HN       GLN   6 -14.496  -7.398  15.411
   48    HA   GLN   6           HA       GLN   6 -17.003  -6.076  15.040
   49    HB2  GLN   6           HB2      GLN   6 -15.080  -5.190  16.375
   50    HB3  GLN   6           HB1      GLN   6 -14.215  -4.894  14.869
   51    HG2  GLN   6           HG2      GLN   6 -15.287  -2.831  15.580
   52    HG3  GLN   6           HG1      GLN   6 -16.100  -3.420  14.132
   53   HE21  GLN   6          HE21      GLN   6 -18.229  -2.658  14.537
   54   HE22  GLN   6          HE22      GLN   6 -19.146  -3.114  15.891
   55    H    LEU   7           HN       LEU   7 -14.270  -6.676  12.858
   56    HA   LEU   7           HA       LEU   7 -15.115  -4.938  10.771
   57    HB2  LEU   7           HB2      LEU   7 -12.882  -5.961  10.804
   58    HB3  LEU   7           HB1      LEU   7 -13.594  -7.561  10.604
   59    HG   LEU   7           HG       LEU   7 -14.477  -6.925   8.403
   60   HD11  LEU   7          HD11      LEU   7 -13.428  -4.220   9.207
   61   HD12  LEU   7          HD12      LEU   7 -14.977  -4.639   8.479
   62   HD13  LEU   7          HD13      LEU   7 -13.514  -4.650   7.500
   63   HD21  LEU   7          HD21      LEU   7 -11.579  -6.073   8.555
   64   HD22  LEU   7          HD22      LEU   7 -12.401  -6.874   7.216
   65   HD23  LEU   7          HD23      LEU   7 -12.091  -7.754   8.712
   66    H    LYS   8           HN       LYS   8 -15.783  -8.407  11.302
   67    HA   LYS   8           HA       LYS   8 -17.422  -8.713   8.974
   68    HB2  LYS   8           HB2      LYS   8 -17.343 -10.243  11.589
   69    HB3  LYS   8           HB1      LYS   8 -18.279 -10.749  10.180
   70    HG2  LYS   8           HG2      LYS   8 -16.188 -10.772   8.831
   71    HG3  LYS   8           HG1      LYS   8 -15.271 -10.356  10.279
   72    HD2  LYS   8           HD2      LYS   8 -17.017 -12.821   9.989
   73    HD3  LYS   8           HD1      LYS   8 -15.263 -12.809   9.811
   74    HE2  LYS   8           HE2      LYS   8 -15.438 -13.407  12.049
   75    HE3  LYS   8           HE1      LYS   8 -15.375 -11.654  12.219
   76    HZ1  LYS   8           HZ1      LYS   8 -17.432 -11.632  13.015
   77    HZ2  LYS   8           HZ2      LYS   8 -17.380 -13.330  13.077
   78    HZ3  LYS   8           HZ3      LYS   8 -18.027 -12.546  11.715
   79    H    HIS   9           HN       HIS   9 -18.145  -7.879  12.337
   80    HA   HIS   9           HA       HIS   9 -20.998  -7.824  12.060
   81    HB2  HIS   9           HB2      HIS   9 -19.790  -7.891  14.235
   82    HB3  HIS   9           HB1      HIS   9 -19.223  -6.246  13.949
   83    HD1  HIS   9           HD1      HIS   9 -22.546  -8.119  14.153
   84    HD2  HIS   9           HD2      HIS   9 -20.968  -4.334  14.899
   85    HE1  HIS   9           HE1      HIS   9 -24.414  -6.754  15.182
   86    H    TYR  10           HN       TYR  10 -18.488  -5.320  11.730
   87    HA   TYR  10           HA       TYR  10 -20.240  -3.120  11.269
   88    HB2  TYR  10           HB2      TYR  10 -17.877  -2.787  11.756
   89    HB3  TYR  10           HB1      TYR  10 -17.419  -3.645  10.285
   90    HD1  TYR  10           HD1      TYR  10 -19.504  -0.735  11.417
   91    HD2  TYR  10           HD2      TYR  10 -17.035  -2.414   8.328
   92    HE1  TYR  10           HE1      TYR  10 -19.657   1.385  10.140
   93    HE2  TYR  10           HE2      TYR  10 -17.191  -0.295   7.055
   94    HH   TYR  10           HH       TYR  10 -18.718   1.643   6.889
   95    H    ILE  11           HN       ILE  11 -18.588  -5.285   8.942
   96    HA   ILE  11           HA       ILE  11 -19.728  -4.074   6.609
   97    HB   ILE  11           HB       ILE  11 -18.659  -6.865   7.107
   98   HG12  ILE  11          HG12      ILE  11 -17.007  -5.064   7.392
   99   HG13  ILE  11          HG11      ILE  11 -16.650  -6.015   5.958
  100   HG21  ILE  11          HG21      ILE  11 -19.558  -5.511   4.565
  101   HG22  ILE  11          HG22      ILE  11 -20.023  -7.094   5.188
  102   HG23  ILE  11          HG23      ILE  11 -18.397  -6.836   4.556
  103   HD11  ILE  11          HD11      ILE  11 -17.553  -3.180   6.179
  104   HD12  ILE  11          HD12      ILE  11 -18.158  -4.094   4.802
  105   HD13  ILE  11          HD13      ILE  11 -16.425  -3.914   5.049
  106    H    THR  12           HN       THR  12 -20.747  -6.894   8.551
  107    HA   THR  12           HA       THR  12 -22.976  -7.551   6.877
  108    HB   THR  12           HB       THR  12 -23.798  -8.747   8.967
  109    HG1  THR  12           HG1      THR  12 -22.604  -7.159  10.302
  110   HG21  THR  12          HG21      THR  12 -21.711 -10.261   9.014
  111   HG22  THR  12          HG22      THR  12 -21.032  -9.152   7.824
  112   HG23  THR  12          HG23      THR  12 -22.510 -10.043   7.459
  113    H    ASN  13           HN       ASN  13 -22.754  -5.596   9.857
  114    HA   ASN  13           HA       ASN  13 -25.552  -4.970   9.963
  115    HB2  ASN  13           HB2      ASN  13 -23.062  -3.709  11.120
  116    HB3  ASN  13           HB1      ASN  13 -24.643  -2.960  11.346
  117   HD21  ASN  13          HD21      ASN  13 -24.607  -6.439  11.095
  118   HD22  ASN  13          HD22      ASN  13 -24.838  -6.762  12.746
  119    H    LEU  14           HN       LEU  14 -22.769  -3.340   8.474
  120    HA   LEU  14           HA       LEU  14 -24.140  -0.983   7.663
  121    HB2  LEU  14           HB2      LEU  14 -21.685  -1.197   7.637
  122    HB3  LEU  14           HB1      LEU  14 -21.796  -2.399   6.353
  123    HG   LEU  14           HG       LEU  14 -22.811  -0.725   4.855
  124   HD11  LEU  14          HD11      LEU  14 -22.697   0.967   7.345
  125   HD12  LEU  14          HD12      LEU  14 -24.008   0.789   6.176
  126   HD13  LEU  14          HD13      LEU  14 -22.584   1.738   5.762
  127   HD21  LEU  14          HD21      LEU  14 -20.308  -0.994   5.070
  128   HD22  LEU  14          HD22      LEU  14 -20.313   0.401   6.149
  129   HD23  LEU  14          HD23      LEU  14 -20.821   0.582   4.470
  130    H    PHE  15           HN       PHE  15 -23.621  -4.077   5.970
  131    HA   PHE  15           HA       PHE  15 -25.438  -3.170   3.791
  132    HB2  PHE  15           HB2      PHE  15 -23.509  -5.487   4.094
  133    HB3  PHE  15           HB1      PHE  15 -24.667  -5.395   2.764
  134    HD1  PHE  15           HD2      PHE  15 -21.667  -3.864   4.280
  135    HD2  PHE  15           HD1      PHE  15 -24.469  -3.699   1.026
  136    HE1  PHE  15           HE2      PHE  15 -20.159  -2.317   3.059
  137    HE2  PHE  15           HE1      PHE  15 -22.962  -2.153  -0.193
  138    HZ   PHE  15           HZ       PHE  15 -20.808  -1.462   0.822
  139    H    ASN  16           HN       ASN  16 -25.728  -4.520   6.750
  140    HA   ASN  16           HA       ASN  16 -27.364  -5.810   7.802
  141    HB2  ASN  16           HB2      ASN  16 -28.948  -5.230   5.281
  142    HB3  ASN  16           HB1      ASN  16 -29.599  -5.692   6.854
  143   HD21  ASN  16          HD21      ASN  16 -29.303  -3.010   4.995
  144   HD22  ASN  16          HD22      ASN  16 -29.081  -1.830   6.196
  145    H    LEU  17           HN       LEU  17 -25.386  -7.235   6.297
  146    HA   LEU  17           HA       LEU  17 -26.855  -9.331   4.862
  147    HB2  LEU  17           HB2      LEU  17 -23.904  -9.158   5.484
  148    HB3  LEU  17           HB1      LEU  17 -24.661 -10.266   4.346
  149    HG   LEU  17           HG       LEU  17 -24.989  -7.279   4.063
  150   HD11  LEU  17          HD11      LEU  17 -23.091  -7.285   2.503
  151   HD12  LEU  17          HD12      LEU  17 -22.800  -8.991   2.850
  152   HD13  LEU  17          HD13      LEU  17 -22.564  -7.781   4.111
  153   HD21  LEU  17          HD21      LEU  17 -25.263  -7.964   1.649
  154   HD22  LEU  17          HD22      LEU  17 -26.508  -8.600   2.717
  155   HD23  LEU  17          HD23      LEU  17 -25.196  -9.644   2.174
  156    HA   PRO  18           HA       PRO  18 -27.271 -12.144   8.294
  157    HB2  PRO  18           HB2      PRO  18 -26.200 -14.317   6.537
  158    HB3  PRO  18           HB1      PRO  18 -27.734 -14.240   7.422
  159    HG2  PRO  18           HG2      PRO  18 -27.641 -13.926   4.778
  160    HG3  PRO  18           HG1      PRO  18 -28.767 -12.993   5.782
  161    HD2  PRO  18           HD2      PRO  18 -26.206 -12.100   4.493
  162    HD3  PRO  18           HD1      PRO  18 -27.732 -11.223   4.743
  163    H    ARG  19           HN       ARG  19 -26.022 -12.992   9.954
  164    HA   ARG  19           HA       ARG  19 -23.100 -12.648   9.747
  165    HB2  ARG  19           HB2      ARG  19 -24.985 -13.258  12.037
  166    HB3  ARG  19           HB1      ARG  19 -23.235 -13.197  12.234
  167    HG2  ARG  19           HG2      ARG  19 -24.629 -10.869  10.919
  168    HG3  ARG  19           HG1      ARG  19 -24.715 -11.031  12.670
  169    HD2  ARG  19           HD2      ARG  19 -22.092 -11.113  11.160
  170    HD3  ARG  19           HD1      ARG  19 -22.781  -9.622  11.803
  171    HE   ARG  19           HE       ARG  19 -22.744 -11.521  13.907
  172   HH11  ARG  19          HH21      ARG  19 -20.599  -9.782  11.837
  173   HH12  ARG  19          HH22      ARG  19 -19.317  -9.721  13.001
  174   HH21  ARG  19          HH11      ARG  19 -21.086 -11.447  15.432
  175   HH22  ARG  19          HH12      ARG  19 -19.594 -10.664  15.036
  176    H    ASP  20           HN       ASP  20 -25.251 -15.118   9.134
  177    HA   ASP  20           HA       ASP  20 -23.624 -17.300  10.259
  178    HB2  ASP  20           HB2      ASP  20 -25.318 -18.765   9.369
  179    HB3  ASP  20           HB1      ASP  20 -26.145 -17.380  10.079
  180    H    GLU  21           HN       GLU  21 -23.128 -15.276   7.760
  181    HA   GLU  21           HA       GLU  21 -22.568 -17.072   5.580
  182    HB2  GLU  21           HB2      GLU  21 -21.529 -14.287   6.184
  183    HB3  GLU  21           HB1      GLU  21 -21.289 -15.131   4.655
  184    HG2  GLU  21           HG2      GLU  21 -23.994 -14.522   5.871
  185    HG3  GLU  21           HG1      GLU  21 -23.237 -13.567   4.599
  186    H    LYS  22           HN       LYS  22 -20.631 -18.031   4.957
  187    HA   LYS  22           HA       LYS  22 -18.638 -18.389   7.103
  188    HB2  LYS  22           HB2      LYS  22 -19.462 -20.335   5.801
  189    HB3  LYS  22           HB1      LYS  22 -18.794 -19.620   4.334
  190    HG2  LYS  22           HG2      LYS  22 -16.537 -19.707   5.280
  191    HG3  LYS  22           HG1      LYS  22 -17.176 -20.340   6.798
  192    HD2  LYS  22           HD2      LYS  22 -18.028 -22.331   5.604
  193    HD3  LYS  22           HD1      LYS  22 -17.369 -21.703   4.093
  194    HE2  LYS  22           HE2      LYS  22 -15.100 -21.751   5.053
  195    HE3  LYS  22           HE1      LYS  22 -15.752 -22.362   6.574
  196    HZ1  LYS  22           HZ1      LYS  22 -14.957 -24.201   5.325
  197    HZ2  LYS  22           HZ2      LYS  22 -15.793 -23.709   3.931
  198    HZ3  LYS  22           HZ3      LYS  22 -16.651 -24.269   5.287
  199    H    TRP  23           HN       TRP  23 -16.641 -17.442   7.103
  200    HA   TRP  23           HA       TRP  23 -15.913 -15.705   4.767
  201    HB2  TRP  23           HB2      TRP  23 -15.234 -15.606   7.718
  202    HB3  TRP  23           HB1      TRP  23 -14.360 -14.653   6.517
  203    HD1  TRP  23           HD1      TRP  23 -18.135 -15.368   7.041
  204    HE1  TRP  23           HE1      TRP  23 -19.391 -13.121   6.964
  205    HE3  TRP  23           HE3      TRP  23 -14.199 -12.180   6.404
  206    HZ2  TRP  23           HZ2      TRP  23 -18.806 -10.337   6.673
  207    HZ3  TRP  23           HZ3      TRP  23 -14.575  -9.738   6.230
  208    HH2  TRP  23           HH2      TRP  23 -16.872  -8.812   6.364
  209    H    GLU  24           HN       GLU  24 -13.975 -16.099   3.713
  210    HA   GLU  24           HA       GLU  24 -12.374 -18.444   4.686
  211    HB2  GLU  24           HB2      GLU  24 -12.775 -17.256   1.929
  212    HB3  GLU  24           HB1      GLU  24 -11.587 -18.513   2.288
  213    HG2  GLU  24           HG2      GLU  24 -13.362 -19.992   3.106
  214    HG3  GLU  24           HG1      GLU  24 -14.563 -18.732   2.830
  215    H    CYS  25           HN       CYS  25 -10.514 -17.896   5.631
  216    HA   CYS  25           HA       CYS  25  -9.375 -15.229   5.338
  217    HB2  CYS  25           HB2      CYS  25  -9.318 -16.517   7.475
  218    HB3  CYS  25           HB1      CYS  25  -8.250 -17.691   6.707
  219    HG   CYS  25           HG       CYS  25  -7.395 -14.984   7.778
  220    H    GLU  26           HN       GLU  26  -8.000 -14.672   3.726
  221    HA   GLU  26           HA       GLU  26  -6.281 -16.812   2.498
  222    HB2  GLU  26           HB2      GLU  26  -8.188 -16.047   1.025
  223    HB3  GLU  26           HB1      GLU  26  -7.484 -14.430   1.057
  224    HG2  GLU  26           HG2      GLU  26  -6.678 -15.513  -0.935
  225    HG3  GLU  26           HG1      GLU  26  -5.334 -15.459   0.205
  226    H    SER  27           HN       SER  27  -4.402 -16.295   3.590
  227    HA   SER  27           HA       SER  27  -3.571 -13.520   3.934
  228    HB2  SER  27           HB2      SER  27  -2.396 -16.199   4.628
  229    HB3  SER  27           HB1      SER  27  -1.425 -14.736   4.761
  230    HG   SER  27           HG       SER  27  -2.416 -14.426   6.578
  231    H    ILE  28           HN       ILE  28  -2.173 -12.407   2.648
  232    HA   ILE  28           HA       ILE  28  -0.464 -13.848   0.718
  233    HB   ILE  28           HB       ILE  28  -1.256 -12.395  -1.165
  234   HG12  ILE  28          HG12      ILE  28  -3.600 -11.805   0.666
  235   HG13  ILE  28          HG11      ILE  28  -2.296 -10.659   0.354
  236   HG21  ILE  28          HG21      ILE  28  -2.078 -14.764  -0.700
  237   HG22  ILE  28          HG22      ILE  28  -3.136 -13.770  -1.700
  238   HG23  ILE  28          HG23      ILE  28  -3.515 -14.027   0.003
  239   HD11  ILE  28          HD11      ILE  28  -2.791 -10.779  -2.073
  240   HD12  ILE  28          HD12      ILE  28  -4.185 -10.216  -1.151
  241   HD13  ILE  28          HD13      ILE  28  -4.126 -11.880  -1.733
  242    H    GLU  29           HN       GLU  29   1.340 -12.603   0.077
  243    HA   GLU  29           HA       GLU  29   1.744 -10.116   1.696
  244    HB2  GLU  29           HB2      GLU  29   3.322 -12.004   2.074
  245    HB3  GLU  29           HB1      GLU  29   3.796 -11.916   0.377
  246    HG2  GLU  29           HG2      GLU  29   4.576  -9.630   0.667
  247    HG3  GLU  29           HG1      GLU  29   3.997  -9.616   2.333
  248    H    GLU  30           HN       GLU  30   1.599  -8.248   0.570
  249    HA   GLU  30           HA       GLU  30   2.695  -8.151  -2.198
  250    HB2  GLU  30           HB2      GLU  30  -0.116  -7.334  -1.409
  251    HB3  GLU  30           HB1      GLU  30   0.661  -6.825  -2.908
  252    HG2  GLU  30           HG2      GLU  30   0.952  -9.173  -3.575
  253    HG3  GLU  30           HG1      GLU  30   0.214  -9.704  -2.063
  254    H    VAL  31           HN       VAL  31   2.974  -5.889  -2.930
  255    HA   VAL  31           HA       VAL  31   4.162  -4.276  -0.869
  256    HB   VAL  31           HB       VAL  31   3.479  -3.678  -3.759
  257   HG11  VAL  31          HG11      VAL  31   5.212  -1.836  -3.421
  258   HG12  VAL  31          HG12      VAL  31   5.017  -2.095  -1.688
  259   HG13  VAL  31          HG13      VAL  31   3.646  -1.557  -2.659
  260   HG21  VAL  31          HG21      VAL  31   5.744  -4.237  -4.217
  261   HG22  VAL  31          HG22      VAL  31   5.190  -5.500  -3.118
  262   HG23  VAL  31          HG23      VAL  31   6.186  -4.178  -2.512
  263    H    ALA  32           HN       ALA  32   3.373  -2.464   0.167
  264    HA   ALA  32           HA       ALA  32   0.577  -2.148   0.547
  265    HB1  ALA  32           HB1      ALA  32   1.172  -0.147   1.793
  266    HB2  ALA  32           HB2      ALA  32   2.747  -0.086   1.007
  267    HB3  ALA  32           HB3      ALA  32   2.368  -1.401   2.119
  268    H    ASP  33           HN       ASP  33   2.847  -0.347  -1.532
  269    HA   ASP  33           HA       ASP  33   0.902   1.604  -2.387
  270    HB2  ASP  33           HB2      ASP  33   3.462   1.744  -2.510
  271    HB3  ASP  33           HB1      ASP  33   3.341   0.732  -3.946
  272    H    ASP  34           HN       ASP  34   1.264  -1.688  -3.112
  273    HA   ASP  34           HA       ASP  34   0.044  -1.445  -5.815
  274    HB2  ASP  34           HB2      ASP  34   1.174  -3.783  -4.261
  275    HB3  ASP  34           HB1      ASP  34   0.358  -3.957  -5.816
  276    H    ILE  35           HN       ILE  35  -1.092  -1.352  -2.772
  277    HA   ILE  35           HA       ILE  35  -3.681  -2.591  -3.581
  278    HB   ILE  35           HB       ILE  35  -3.920  -3.582  -1.315
  279   HG12  ILE  35          HG12      ILE  35  -0.989  -2.861  -1.007
  280   HG13  ILE  35          HG11      ILE  35  -2.305  -2.038  -0.175
  281   HG21  ILE  35          HG21      ILE  35  -2.530  -5.492  -1.721
  282   HG22  ILE  35          HG22      ILE  35  -1.361  -4.528  -2.623
  283   HG23  ILE  35          HG23      ILE  35  -2.958  -4.842  -3.303
  284   HD11  ILE  35          HD11      ILE  35  -2.985  -4.368   0.686
  285   HD12  ILE  35          HD12      ILE  35  -1.544  -3.636   1.389
  286   HD13  ILE  35          HD13      ILE  35  -1.385  -4.889   0.159
  287    H    LEU  36           HN       LEU  36  -1.883  -0.323  -1.561
  288    HA   LEU  36           HA       LEU  36  -4.408   0.826  -0.578
  289    HB2  LEU  36           HB2      LEU  36  -1.512   1.180   0.109
  290    HB3  LEU  36           HB1      LEU  36  -2.649   2.444   0.567
  291    HG   LEU  36           HG       LEU  36  -3.317  -0.428   1.218
  292   HD11  LEU  36          HD11      LEU  36  -2.198   0.048   3.482
  293   HD12  LEU  36          HD12      LEU  36  -1.333   1.343   2.654
  294   HD13  LEU  36          HD13      LEU  36  -1.129  -0.329   2.131
  295   HD21  LEU  36          HD21      LEU  36  -3.835   2.216   2.629
  296   HD22  LEU  36          HD22      LEU  36  -4.483   0.647   3.106
  297   HD23  LEU  36          HD23      LEU  36  -4.987   1.382   1.587
  298    HA   PRO  37           HA       PRO  37  -4.757   4.187  -3.462
  299    HB2  PRO  37           HB2      PRO  37  -4.792   6.075  -1.131
  300    HB3  PRO  37           HB1      PRO  37  -5.966   5.892  -2.451
  301    HG2  PRO  37           HG2      PRO  37  -6.475   4.977   0.001
  302    HG3  PRO  37           HG1      PRO  37  -7.013   4.103  -1.446
  303    HD2  PRO  37           HD2      PRO  37  -4.762   3.447   0.420
  304    HD3  PRO  37           HD1      PRO  37  -5.835   2.376  -0.506
  305    H    ASP  38           HN       ASP  38  -3.428   5.632  -4.552
  306    HA   ASP  38           HA       ASP  38  -0.648   5.782  -3.819
  307    HB2  ASP  38           HB2      ASP  38  -0.468   7.305  -5.775
  308    HB3  ASP  38           HB1      ASP  38  -1.362   5.835  -6.162
  309    H    GLN  39           HN       GLN  39  -3.402   7.956  -3.408
  310    HA   GLN  39           HA       GLN  39  -1.918  10.302  -2.707
  311    HB2  GLN  39           HB2      GLN  39  -4.357  10.267  -3.266
  312    HB3  GLN  39           HB1      GLN  39  -4.664   9.476  -1.718
  313    HG2  GLN  39           HG2      GLN  39  -3.659  11.397  -0.534
  314    HG3  GLN  39           HG1      GLN  39  -3.359  12.192  -2.080
  315   HE21  GLN  39          HE21      GLN  39  -4.841  13.924  -1.990
  316   HE22  GLN  39          HE22      GLN  39  -6.514  13.729  -1.781
  317    H    TYR  40           HN       TYR  40  -3.138   7.581  -0.783
  318    HA   TYR  40           HA       TYR  40  -2.146   8.764   1.717
  319    HB2  TYR  40           HB2      TYR  40  -4.121   7.472   1.959
  320    HB3  TYR  40           HB1      TYR  40  -3.490   6.165   0.961
  321    HD1  TYR  40           HD2      TYR  40  -2.522   8.045   4.080
  322    HD2  TYR  40           HD1      TYR  40  -2.779   4.245   2.085
  323    HE1  TYR  40           HE2      TYR  40  -1.654   6.913   6.109
  324    HE2  TYR  40           HE1      TYR  40  -1.912   3.120   4.116
  325    HH   TYR  40           HH       TYR  40  -1.999   4.008   6.884
  326    H    VAL  41           HN       VAL  41  -0.757   7.108  -0.861
  327    HA   VAL  41           HA       VAL  41   1.495   6.125   0.869
  328    HB   VAL  41           HB       VAL  41   0.393   4.976  -1.714
  329   HG11  VAL  41          HG11      VAL  41   2.942   4.454  -0.181
  330   HG12  VAL  41          HG12      VAL  41   2.739   4.725  -1.911
  331   HG13  VAL  41          HG13      VAL  41   2.212   3.205  -1.190
  332   HG21  VAL  41          HG21      VAL  41  -0.807   4.425   0.419
  333   HG22  VAL  41          HG22      VAL  41   0.704   3.783   1.062
  334   HG23  VAL  41          HG23      VAL  41  -0.059   3.014  -0.329
  335    H    ARG  42           HN       ARG  42   2.898   7.834   0.677
  336    HA   ARG  42           HA       ARG  42   3.834   8.517  -2.086
  337    HB2  ARG  42           HB2      ARG  42   3.413  10.441   0.230
  338    HB3  ARG  42           HB1      ARG  42   4.116  10.865  -1.330
  339    HG2  ARG  42           HG2      ARG  42   1.353   9.658  -1.084
  340    HG3  ARG  42           HG1      ARG  42   1.623  11.397  -0.994
  341    HD2  ARG  42           HD2      ARG  42   2.794  11.252  -3.225
  342    HD3  ARG  42           HD1      ARG  42   2.278   9.569  -3.317
  343    HE   ARG  42           HE       ARG  42   0.142  11.556  -2.863
  344   HH11  ARG  42          HH21      ARG  42   1.920   9.521  -5.021
  345   HH12  ARG  42          HH22      ARG  42   0.695   9.528  -6.241
  346   HH21  ARG  42          HH11      ARG  42  -1.451  11.582  -4.457
  347   HH22  ARG  42          HH12      ARG  42  -1.209  10.698  -5.926
  348    H    LEU  43           HN       LEU  43   5.150  10.213   0.598
  349    HA   LEU  43           HA       LEU  43   7.685   8.681   0.304
  350    HB2  LEU  43           HB2      LEU  43   7.127  11.312   1.715
  351    HB3  LEU  43           HB1      LEU  43   8.714  10.618   1.388
  352    HG   LEU  43           HG       LEU  43   6.690  11.440  -0.717
  353   HD11  LEU  43          HD11      LEU  43   9.249  12.726   0.269
  354   HD12  LEU  43          HD12      LEU  43   7.624  13.411   0.293
  355   HD13  LEU  43          HD13      LEU  43   8.458  13.173  -1.243
  356   HD21  LEU  43          HD21      LEU  43   7.921   9.727  -1.741
  357   HD22  LEU  43          HD22      LEU  43   9.390  10.100  -0.840
  358   HD23  LEU  43          HD23      LEU  43   8.875  11.148  -2.161
  359    H    GLY  44           HN       GLY  44   4.983   8.573   2.189
  360    HA2  GLY  44           HA2      GLY  44   5.911   8.492   4.854
  361    HA3  GLY  44           HA1      GLY  44   4.537   7.563   4.254
  362    HA   PRO  45           HA       PRO  45   8.288   4.783   5.175
  363    HB2  PRO  45           HB2      PRO  45   7.397   3.642   7.519
  364    HB3  PRO  45           HB1      PRO  45   8.410   5.098   7.466
  365    HG2  PRO  45           HG2      PRO  45   5.468   4.856   7.879
  366    HG3  PRO  45           HG1      PRO  45   6.626   5.968   8.630
  367    HD2  PRO  45           HD2      PRO  45   4.946   6.698   6.568
  368    HD3  PRO  45           HD1      PRO  45   6.512   7.481   6.876
  369    H    LEU  46           HN       LEU  46   4.884   4.569   4.913
  370    HA   LEU  46           HA       LEU  46   4.777   1.638   4.744
  371    HB2  LEU  46           HB2      LEU  46   2.717   3.749   4.009
  372    HB3  LEU  46           HB1      LEU  46   2.413   2.019   4.171
  373    HG   LEU  46           HG       LEU  46   3.399   3.830   6.398
  374   HD11  LEU  46          HD11      LEU  46   1.173   3.692   7.310
  375   HD12  LEU  46          HD12      LEU  46   0.678   2.535   6.072
  376   HD13  LEU  46          HD13      LEU  46   1.022   4.208   5.630
  377   HD21  LEU  46          HD21      LEU  46   2.830   0.874   6.192
  378   HD22  LEU  46          HD22      LEU  46   2.587   1.702   7.730
  379   HD23  LEU  46          HD23      LEU  46   4.178   1.695   6.978
  380    H    SER  47           HN       SER  47   5.779   4.143   2.733
  381    HA   SER  47           HA       SER  47   4.789   3.112   0.210
  382    HB2  SER  47           HB2      SER  47   6.867   5.151   0.989
  383    HB3  SER  47           HB1      SER  47   6.662   4.661  -0.692
  384    HG   SER  47           HG       SER  47   4.538   5.533   0.977
  385    H    ASN  48           HN       ASN  48   5.773   1.715  -1.203
  386    HA   ASN  48           HA       ASN  48   7.160  -0.044  -1.875
  387    HB2  ASN  48           HB2      ASN  48   9.177   1.906  -0.737
  388    HB3  ASN  48           HB1      ASN  48   9.642   0.412  -1.549
  389   HD21  ASN  48          HD21      ASN  48  10.341   2.962  -2.654
  390   HD22  ASN  48          HD22      ASN  48   9.472   3.175  -4.097
  391    H    LYS  49           HN       LYS  49   5.959  -0.177   0.824
  392    HA   LYS  49           HA       LYS  49   8.034  -1.814   2.251
  393    HB2  LYS  49           HB2      LYS  49   7.073   0.097   3.532
  394    HB3  LYS  49           HB1      LYS  49   5.470  -0.619   3.348
  395    HG2  LYS  49           HG2      LYS  49   6.206  -2.637   4.527
  396    HG3  LYS  49           HG1      LYS  49   7.839  -1.986   4.658
  397    HD2  LYS  49           HD2      LYS  49   6.977  -0.095   5.993
  398    HD3  LYS  49           HD1      LYS  49   5.348  -0.762   5.877
  399    HE2  LYS  49           HE2      LYS  49   6.093  -2.810   7.023
  400    HE3  LYS  49           HE1      LYS  49   7.731  -2.163   7.125
  401    HZ1  LYS  49           HZ1      LYS  49   6.607  -1.764   9.180
  402    HZ2  LYS  49           HZ2      LYS  49   5.293  -1.037   8.389
  403    HZ3  LYS  49           HZ3      LYS  49   6.812  -0.277   8.393
  404    H    ILE  50           HN       ILE  50   7.666  -3.975   2.479
  405    HA   ILE  50           HA       ILE  50   5.342  -5.136   1.105
  406    HB   ILE  50           HB       ILE  50   7.471  -6.577   2.707
  407   HG12  ILE  50          HG12      ILE  50   8.666  -5.144   1.178
  408   HG13  ILE  50          HG11      ILE  50   8.658  -6.762   0.479
  409   HG21  ILE  50          HG21      ILE  50   5.615  -7.973   2.031
  410   HG22  ILE  50          HG22      ILE  50   6.996  -8.356   1.007
  411   HG23  ILE  50          HG23      ILE  50   5.687  -7.351   0.383
  412   HD11  ILE  50          HD11      ILE  50   8.071  -5.352  -1.331
  413   HD12  ILE  50          HD12      ILE  50   7.010  -4.366  -0.328
  414   HD13  ILE  50          HD13      ILE  50   6.527  -6.001  -0.779
  415    H    LEU  51           HN       LEU  51   3.451  -5.439   2.139
  416    HA   LEU  51           HA       LEU  51   3.479  -5.957   5.099
  417    HB2  LEU  51           HB2      LEU  51   1.404  -4.460   3.468
  418    HB3  LEU  51           HB1      LEU  51   1.329  -4.765   5.203
  419    HG   LEU  51           HG       LEU  51   3.500  -3.181   3.793
  420   HD11  LEU  51          HD11      LEU  51   2.469  -1.218   4.663
  421   HD12  LEU  51          HD12      LEU  51   1.403  -2.151   5.714
  422   HD13  LEU  51          HD13      LEU  51   1.150  -2.161   3.968
  423   HD21  LEU  51          HD21      LEU  51   4.564  -4.017   5.703
  424   HD22  LEU  51          HD22      LEU  51   3.073  -4.065   6.644
  425   HD23  LEU  51          HD23      LEU  51   3.872  -2.524   6.332
  426    H    GLN  52           HN       GLN  52   2.035  -7.486   5.876
  427    HA   GLN  52           HA       GLN  52   1.233  -9.525   3.941
  428    HB2  GLN  52           HB2      GLN  52   0.829  -9.307   6.942
  429    HB3  GLN  52           HB1      GLN  52   0.476 -10.742   5.978
  430    HG2  GLN  52           HG2      GLN  52   3.200  -9.422   6.160
  431    HG3  GLN  52           HG1      GLN  52   2.720 -10.849   7.079
  432   HE21  GLN  52          HE21      GLN  52   4.632 -10.241   4.596
  433   HE22  GLN  52          HE22      GLN  52   4.273 -11.529   3.551
  434    H    THR  53           HN       THR  53  -0.596  -9.145   2.779
  435    HA   THR  53           HA       THR  53  -2.845  -7.659   4.051
  436    HB   THR  53           HB       THR  53  -2.299  -8.451   1.176
  437    HG1  THR  53           HG1      THR  53  -2.493  -5.845   2.184
  438   HG21  THR  53          HG21      THR  53  -4.662  -8.395   1.400
  439   HG22  THR  53          HG22      THR  53  -4.221  -6.807   0.775
  440   HG23  THR  53          HG23      THR  53  -4.603  -7.005   2.486
  441    H    ASN  54           HN       ASN  54  -4.474  -8.836   4.895
  442    HA   ASN  54           HA       ASN  54  -4.859 -11.648   3.958
  443    HB2  ASN  54           HB2      ASN  54  -4.447 -11.099   6.425
  444    HB3  ASN  54           HB1      ASN  54  -6.053 -10.373   6.421
  445   HD21  ASN  54          HD21      ASN  54  -7.682 -11.802   7.005
  446   HD22  ASN  54          HD22      ASN  54  -7.628 -13.486   6.799
  447    H    THR  55           HN       THR  55  -6.249 -11.529   2.244
  448    HA   THR  55           HA       THR  55  -8.589  -9.715   2.382
  449    HB   THR  55           HB       THR  55  -7.559 -11.543   0.189
  450    HG1  THR  55           HG1      THR  55  -7.225  -8.885   0.907
  451   HG21  THR  55          HG21      THR  55  -9.207 -10.151  -1.194
  452   HG22  THR  55          HG22      THR  55  -9.928  -9.673   0.343
  453   HG23  THR  55          HG23      THR  55  -9.912 -11.372  -0.135
  454    H    TYR  56           HN       TYR  56 -10.677 -10.454   2.641
  455    HA   TYR  56           HA       TYR  56 -11.001 -13.363   3.267
  456    HB2  TYR  56           HB2      TYR  56 -12.641 -10.921   3.999
  457    HB3  TYR  56           HB1      TYR  56 -13.104 -12.580   4.386
  458    HD1  TYR  56           HD1      TYR  56 -11.667 -13.969   5.878
  459    HD2  TYR  56           HD2      TYR  56 -10.902  -9.794   5.215
  460    HE1  TYR  56           HE1      TYR  56 -10.189 -13.925   7.867
  461    HE2  TYR  56           HE2      TYR  56  -9.424  -9.749   7.206
  462    HH   TYR  56           HH       TYR  56  -8.878 -12.691   9.152
  463    H    TYR  57           HN       TYR  57 -12.294 -14.599   1.981
  464    HA   TYR  57           HA       TYR  57 -13.875 -13.218  -0.169
  465    HB2  TYR  57           HB2      TYR  57 -12.404 -15.866  -0.154
  466    HB3  TYR  57           HB1      TYR  57 -13.532 -15.385  -1.425
  467    HD1  TYR  57           HD2      TYR  57 -13.096 -13.254  -2.715
  468    HD2  TYR  57           HD1      TYR  57 -10.178 -15.013  -0.101
  469    HE1  TYR  57           HE2      TYR  57 -11.317 -11.917  -3.805
  470    HE2  TYR  57           HE1      TYR  57  -8.396 -13.675  -1.191
  471    HH   TYR  57           HH       TYR  57  -9.107 -11.093  -3.360
  472    H    SER  58           HN       SER  58 -16.032 -13.494   0.013
  473    HA   SER  58           HA       SER  58 -17.074 -16.009   1.249
  474    HB2  SER  58           HB2      SER  58 -18.250 -13.288   1.837
  475    HB3  SER  58           HB1      SER  58 -18.625 -14.819   2.615
  476    HG   SER  58           HG       SER  58 -17.100 -13.295   3.704
  477    H    ASP  59           HN       ASP  59 -19.174 -16.592   0.471
  478    HA   ASP  59           HA       ASP  59 -19.653 -15.990  -2.278
  479    HB2  ASP  59           HB2      ASP  59 -21.803 -17.210  -1.901
  480    HB3  ASP  59           HB1      ASP  59 -20.404 -18.076  -1.264
  481    H    THR  60           HN       THR  60 -21.275 -14.829   0.686
  482    HA   THR  60           HA       THR  60 -23.228 -13.232  -0.663
  483    HB   THR  60           HB       THR  60 -22.034 -12.928   2.105
  484    HG1  THR  60           HG1      THR  60 -24.251 -14.334   1.049
  485   HG21  THR  60          HG21      THR  60 -23.154 -10.885   1.505
  486   HG22  THR  60          HG22      THR  60 -24.244 -11.792   2.554
  487   HG23  THR  60          HG23      THR  60 -24.512 -11.771   0.811
  488    H    LEU  61           HN       LEU  61 -20.043 -12.414   0.718
  489    HA   LEU  61           HA       LEU  61 -20.143  -9.632   0.065
  490    HB2  LEU  61           HB2      LEU  61 -17.784 -11.505   0.412
  491    HB3  LEU  61           HB1      LEU  61 -17.649  -9.754   0.298
  492    HG   LEU  61           HG       LEU  61 -19.266 -11.228   2.400
  493   HD11  LEU  61          HD11      LEU  61 -16.997 -11.653   2.919
  494   HD12  LEU  61          HD12      LEU  61 -17.399 -10.243   3.896
  495   HD13  LEU  61          HD13      LEU  61 -16.484 -10.049   2.400
  496   HD21  LEU  61          HD21      LEU  61 -20.279  -9.134   2.319
  497   HD22  LEU  61          HD22      LEU  61 -18.820  -8.323   1.749
  498   HD23  LEU  61          HD23      LEU  61 -18.969  -8.789   3.442
  499    H    HIS  62           HN       HIS  62 -18.967 -12.457  -1.730
  500    HA   HIS  62           HA       HIS  62 -17.759 -11.102  -3.898
  501    HB2  HIS  62           HB2      HIS  62 -17.620 -13.544  -3.538
  502    HB3  HIS  62           HB1      HIS  62 -19.330 -13.697  -3.942
  503    HD1  HIS  62           HD1      HIS  62 -19.968 -13.692  -6.394
  504    HD2  HIS  62           HD2      HIS  62 -15.959 -12.726  -5.787
  505    HE1  HIS  62           HE1      HIS  62 -18.887 -13.655  -8.683
  506    H    LYS  63           HN       LYS  63 -21.152 -12.078  -3.411
  507    HA   LYS  63           HA       LYS  63 -22.111 -11.127  -5.932
  508    HB2  LYS  63           HB2      LYS  63 -23.474 -11.507  -3.259
  509    HB3  LYS  63           HB1      LYS  63 -24.342 -11.064  -4.728
  510    HG2  LYS  63           HG2      LYS  63 -23.438 -13.104  -5.840
  511    HG3  LYS  63           HG1      LYS  63 -22.675 -13.567  -4.321
  512    HD2  LYS  63           HD2      LYS  63 -25.643 -13.027  -4.525
  513    HD3  LYS  63           HD1      LYS  63 -24.965 -14.623  -4.829
  514    HE2  LYS  63           HE2      LYS  63 -23.864 -14.446  -2.533
  515    HE3  LYS  63           HE1      LYS  63 -24.886 -13.033  -2.260
  516    HZ1  LYS  63           HZ1      LYS  63 -25.904 -15.060  -1.413
  517    HZ2  LYS  63           HZ2      LYS  63 -25.861 -15.746  -2.967
  518    HZ3  LYS  63           HZ3      LYS  63 -26.830 -14.384  -2.663
  519    H    SER  64           HN       SER  64 -21.720  -9.579  -2.772
  520    HA   SER  64           HA       SER  64 -22.920  -7.070  -3.618
  521    HB2  SER  64           HB2      SER  64 -21.175  -7.788  -1.244
  522    HB3  SER  64           HB1      SER  64 -21.968  -6.230  -1.459
  523    HG   SER  64           HG       SER  64 -23.580  -7.202  -0.509
  524    H    ASN  65           HN       ASN  65 -20.063  -8.574  -4.398
  525    HA   ASN  65           HA       ASN  65 -18.093  -7.846  -5.414
  526    HB2  ASN  65           HB2      ASN  65 -19.836  -6.496  -6.732
  527    HB3  ASN  65           HB1      ASN  65 -19.405  -5.137  -5.693
  528   HD21  ASN  65          HD21      ASN  65 -16.619  -6.938  -5.908
  529   HD22  ASN  65          HD22      ASN  65 -15.891  -6.173  -7.236
  530    H    ILE  66           HN       ILE  66 -18.274  -7.712  -2.589
  531    HA   ILE  66           HA       ILE  66 -16.536  -5.340  -1.988
  532    HB   ILE  66           HB       ILE  66 -18.490  -6.808  -0.196
  533   HG12  ILE  66          HG12      ILE  66 -18.369  -3.903  -1.065
  534   HG13  ILE  66          HG11      ILE  66 -19.388  -5.118  -1.834
  535   HG21  ILE  66          HG21      ILE  66 -16.265  -4.866   0.395
  536   HG22  ILE  66          HG22      ILE  66 -16.753  -6.300   1.288
  537   HG23  ILE  66          HG23      ILE  66 -17.721  -4.837   1.387
  538   HD11  ILE  66          HD11      ILE  66 -19.565  -4.020   0.967
  539   HD12  ILE  66          HD12      ILE  66 -20.311  -5.561   0.546
  540   HD13  ILE  66          HD13      ILE  66 -20.820  -4.082  -0.268
  541    H    TYR  67           HN       TYR  67 -14.516  -5.832  -1.302
  542    HA   TYR  67           HA       TYR  67 -13.949  -8.664  -0.446
  543    HB2  TYR  67           HB2      TYR  67 -12.138  -6.812  -2.014
  544    HB3  TYR  67           HB1      TYR  67 -11.798  -8.483  -1.558
  545    HD1  TYR  67           HD1      TYR  67 -13.544 -10.278  -2.315
  546    HD2  TYR  67           HD2      TYR  67 -13.189  -6.371  -4.067
  547    HE1  TYR  67           HE1      TYR  67 -14.724 -11.080  -4.343
  548    HE2  TYR  67           HE2      TYR  67 -14.367  -7.174  -6.096
  549    HH   TYR  67           HH       TYR  67 -15.179 -10.580  -6.521
  550    HA   PRO  68           HA       PRO  68 -12.775  -5.841   3.050
  551    HB2  PRO  68           HB2      PRO  68 -13.076  -8.387   4.567
  552    HB3  PRO  68           HB1      PRO  68 -13.784  -6.792   4.894
  553    HG2  PRO  68           HG2      PRO  68 -15.266  -8.810   3.961
  554    HG3  PRO  68           HG1      PRO  68 -15.554  -7.135   3.456
  555    HD2  PRO  68           HD2      PRO  68 -14.173  -9.343   1.953
  556    HD3  PRO  68           HD1      PRO  68 -15.280  -8.089   1.351
  557    H    PHE  69           HN       PHE  69 -10.729  -5.658   4.076
  558    HA   PHE  69           HA       PHE  69  -8.907  -7.976   4.027
  559    HB2  PHE  69           HB2      PHE  69  -7.187  -6.833   2.711
  560    HB3  PHE  69           HB1      PHE  69  -8.667  -6.978   1.765
  561    HD1  PHE  69           HD1      PHE  69 -10.103  -5.027   1.358
  562    HD2  PHE  69           HD2      PHE  69  -6.409  -4.675   3.518
  563    HE1  PHE  69           HE1      PHE  69 -10.173  -2.563   1.077
  564    HE2  PHE  69           HE2      PHE  69  -6.476  -2.212   3.233
  565    HZ   PHE  69           HZ       PHE  69  -8.358  -1.157   2.011
  566    H    ILE  70           HN       ILE  70  -7.020  -7.648   5.309
  567    HA   ILE  70           HA       ILE  70  -6.914  -5.132   6.913
  568    HB   ILE  70           HB       ILE  70  -6.854  -7.953   8.038
  569   HG12  ILE  70          HG12      ILE  70  -8.731  -5.645   8.620
  570   HG13  ILE  70          HG11      ILE  70  -9.108  -6.944   7.490
  571   HG21  ILE  70          HG21      ILE  70  -5.227  -6.621   9.219
  572   HG22  ILE  70          HG22      ILE  70  -6.667  -6.679  10.233
  573   HG23  ILE  70          HG23      ILE  70  -6.318  -5.238   9.279
  574   HD11  ILE  70          HD11      ILE  70 -10.042  -7.350   9.771
  575   HD12  ILE  70          HD12      ILE  70  -8.398  -7.361  10.406
  576   HD13  ILE  70          HD13      ILE  70  -8.912  -8.603   9.264
  577    H    LEU  71           HN       LEU  71  -4.802  -4.504   7.391
  578    HA   LEU  71           HA       LEU  71  -2.653  -6.139   6.100
  579    HB2  LEU  71           HB2      LEU  71  -2.577  -3.257   7.034
  580    HB3  LEU  71           HB1      LEU  71  -1.383  -4.076   6.025
  581    HG   LEU  71           HG       LEU  71  -4.271  -3.521   5.292
  582   HD11  LEU  71          HD11      LEU  71  -2.591  -1.607   5.262
  583   HD12  LEU  71          HD12      LEU  71  -3.406  -1.937   3.734
  584   HD13  LEU  71          HD13      LEU  71  -1.749  -2.487   3.986
  585   HD21  LEU  71          HD21      LEU  71  -3.799  -5.540   4.189
  586   HD22  LEU  71          HD22      LEU  71  -2.096  -5.136   3.963
  587   HD23  LEU  71          HD23      LEU  71  -3.332  -4.341   2.989
  588    H    TYR  72           HN       TYR  72  -0.948  -6.898   7.260
  589    HA   TYR  72           HA       TYR  72  -0.820  -6.235  10.181
  590    HB2  TYR  72           HB2      TYR  72  -0.538  -8.925   8.818
  591    HB3  TYR  72           HB1      TYR  72  -0.067  -8.622  10.490
  592    HD1  TYR  72           HD1      TYR  72  -1.764  -7.962  12.175
  593    HD2  TYR  72           HD2      TYR  72  -2.854  -9.087   8.176
  594    HE1  TYR  72           HE1      TYR  72  -4.113  -8.267  12.903
  595    HE2  TYR  72           HE2      TYR  72  -5.206  -9.390   8.904
  596    HH   TYR  72           HH       TYR  72  -6.551  -9.598  10.729
  597    H    TYR  73           HN       TYR  73   1.289  -6.339  11.098
  598    HA   TYR  73           HA       TYR  73   3.584  -6.749   9.287
  599    HB2  TYR  73           HB2      TYR  73   3.008  -4.373   8.957
  600    HB3  TYR  73           HB1      TYR  73   3.079  -4.104  10.698
  601    HD1  TYR  73           HD1      TYR  73   5.124  -5.393   7.842
  602    HD2  TYR  73           HD2      TYR  73   5.123  -3.505  11.699
  603    HE1  TYR  73           HE1      TYR  73   7.573  -5.044   7.670
  604    HE2  TYR  73           HE2      TYR  73   7.573  -3.157  11.529
  605    HH   TYR  73           HH       TYR  73   9.246  -3.084   8.990
  606    H    GLN  74           HN       GLN  74   3.787  -8.528  10.829
  607    HA   GLN  74           HA       GLN  74   4.668  -9.554  12.736
  608    HB2  GLN  74           HB2      GLN  74   6.165  -6.922  12.901
  609    HB3  GLN  74           HB1      GLN  74   6.592  -8.397  13.768
  610    HG2  GLN  74           HG2      GLN  74   6.431  -8.159  10.750
  611    HG3  GLN  74           HG1      GLN  74   7.925  -8.109  11.685
  612   HE21  GLN  74          HE21      GLN  74   6.215 -10.202   9.827
  613   HE22  GLN  74          HE22      GLN  74   6.582 -11.668  10.600
  614    H    LYS  75           HN       LYS  75   4.750  -6.215  13.981
  615    HA   LYS  75           HA       LYS  75   3.892  -6.727  16.557
  616    HB2  LYS  75           HB2      LYS  75   4.579  -4.497  15.497
  617    HB3  LYS  75           HB1      LYS  75   2.894  -4.339  15.004
  618    HG2  LYS  75           HG2      LYS  75   2.150  -4.446  17.315
  619    HG3  LYS  75           HG1      LYS  75   3.789  -4.793  17.865
  620    HD2  LYS  75           HD2      LYS  75   3.505  -2.472  18.270
  621    HD3  LYS  75           HD1      LYS  75   4.457  -2.554  16.790
  622    HE2  LYS  75           HE2      LYS  75   2.520  -2.100  15.427
  623    HE3  LYS  75           HE1      LYS  75   1.438  -2.284  16.806
  624    HZ1  LYS  75           HZ1      LYS  75   3.533  -0.198  16.538
  625    HZ2  LYS  75           HZ2      LYS  75   2.446  -0.363  17.833
  626    HZ3  LYS  75           HZ3      LYS  75   1.874   0.046  16.286
  627    H    GLN  76           HN       GLN  76   1.527  -5.300  14.279
  628    HA   GLN  76           HA       GLN  76  -0.406  -7.427  14.756
  629    HB2  GLN  76           HB2      GLN  76  -2.028  -6.089  16.003
  630    HB3  GLN  76           HB1      GLN  76  -0.513  -6.152  16.902
  631    HG2  GLN  76           HG2      GLN  76   0.110  -3.948  15.853
  632    HG3  GLN  76           HG1      GLN  76  -1.514  -3.872  15.173
  633   HE21  GLN  76          HE21      GLN  76  -1.619  -1.843  16.615
  634   HE22  GLN  76          HE22      GLN  76  -2.083  -2.059  18.233
  635    H    LEU  77           HN       LEU  77  -2.711  -5.747  14.334
  636    HA   LEU  77           HA       LEU  77  -2.605  -5.517  11.473
  637    HB2  LEU  77           HB2      LEU  77  -4.868  -4.603  11.658
  638    HB3  LEU  77           HB1      LEU  77  -4.683  -6.013  12.693
  639    HG   LEU  77           HG       LEU  77  -3.943  -3.983  14.430
  640   HD11  LEU  77          HD11      LEU  77  -5.378  -2.106  14.189
  641   HD12  LEU  77          HD12      LEU  77  -6.333  -2.891  12.934
  642   HD13  LEU  77          HD13      LEU  77  -4.693  -2.352  12.583
  643   HD21  LEU  77          HD21      LEU  77  -6.152  -4.288  15.452
  644   HD22  LEU  77          HD22      LEU  77  -5.540  -5.839  14.876
  645   HD23  LEU  77          HD23      LEU  77  -6.773  -4.980  13.954
  646    H    ILE  78           HN       ILE  78  -2.327  -3.713  10.183
  647    HA   ILE  78           HA       ILE  78  -1.437  -1.206  11.563
  648    HB   ILE  78           HB       ILE  78  -0.844  -2.241   8.774
  649   HG12  ILE  78          HG12      ILE  78   0.193  -3.411  10.876
  650   HG13  ILE  78          HG11      ILE  78   1.250  -2.957   9.546
  651   HG21  ILE  78          HG21      ILE  78  -0.034   0.255  10.257
  652   HG22  ILE  78          HG22      ILE  78  -0.721   0.108   8.639
  653   HG23  ILE  78          HG23      ILE  78   0.944  -0.391   8.939
  654   HD11  ILE  78          HD11      ILE  78   2.204  -1.185  10.728
  655   HD12  ILE  78          HD12      ILE  78   1.934  -2.359  12.013
  656   HD13  ILE  78          HD13      ILE  78   0.819  -1.014  11.803
  657    H    ALA  79           HN       ALA  79  -3.798  -2.540   9.356
  658    HA   ALA  79           HA       ALA  79  -5.244  -0.009   9.427
  659    HB1  ALA  79           HB1      ALA  79  -4.382  -0.990   6.699
  660    HB2  ALA  79           HB2      ALA  79  -3.502   0.262   7.577
  661    HB3  ALA  79           HB3      ALA  79  -5.179   0.527   7.107
  662    H    ILE  80           HN       ILE  80  -7.399  -0.214   8.643
  663    HA   ILE  80           HA       ILE  80  -8.247  -2.982   7.866
  664    HB   ILE  80           HB       ILE  80  -9.618  -1.151   9.866
  665   HG12  ILE  80          HG12      ILE  80  -8.340  -3.883  10.211
  666   HG13  ILE  80          HG11      ILE  80  -7.585  -2.363  10.683
  667   HG21  ILE  80          HG21      ILE  80 -11.153  -3.142  10.112
  668   HG22  ILE  80          HG22      ILE  80 -10.374  -3.847   8.697
  669   HG23  ILE  80          HG23      ILE  80 -11.272  -2.339   8.550
  670   HD11  ILE  80          HD11      ILE  80  -9.617  -1.918  12.128
  671   HD12  ILE  80          HD12      ILE  80  -8.621  -3.273  12.655
  672   HD13  ILE  80          HD13      ILE  80 -10.130  -3.570  11.791
  673    H    GLY  81           HN       GLY  81  -9.622  -2.983   6.118
  674    HA2  GLY  81           HA2      GLY  81 -11.450  -0.844   5.546
  675    HA3  GLY  81           HA1      GLY  81 -10.001  -0.663   4.561
  676    H    PHE  82           HN       PHE  82 -12.413  -1.135   3.301
  677    HA   PHE  82           HA       PHE  82 -11.950  -3.877   2.204
  678    HB2  PHE  82           HB2      PHE  82 -14.335  -4.342   2.170
  679    HB3  PHE  82           HB1      PHE  82 -13.873  -3.941   3.822
  680    HD1  PHE  82           HD2      PHE  82 -15.543  -2.693   0.763
  681    HD2  PHE  82           HD1      PHE  82 -14.657  -1.931   4.895
  682    HE1  PHE  82           HE2      PHE  82 -17.221  -0.870   0.784
  683    HE2  PHE  82           HE1      PHE  82 -16.329  -0.100   4.911
  684    HZ   PHE  82           HZ       PHE  82 -17.613   0.428   2.859
  685    H    ILE  83           HN       ILE  83 -12.582  -4.094  -0.015
  686    HA   ILE  83           HA       ILE  83 -12.552  -1.494  -1.435
  687    HB   ILE  83           HB       ILE  83 -12.369  -4.357  -2.420
  688   HG12  ILE  83          HG12      ILE  83 -10.290  -2.159  -2.417
  689   HG13  ILE  83          HG11      ILE  83 -10.437  -3.333  -1.111
  690   HG21  ILE  83          HG21      ILE  83 -11.631  -3.159  -4.565
  691   HG22  ILE  83          HG22      ILE  83 -12.347  -1.703  -3.873
  692   HG23  ILE  83          HG23      ILE  83 -13.356  -3.112  -4.201
  693   HD11  ILE  83          HD11      ILE  83 -10.169  -4.192  -3.992
  694   HD12  ILE  83          HD12      ILE  83  -9.894  -5.148  -2.535
  695   HD13  ILE  83          HD13      ILE  83  -8.758  -3.875  -2.984
  696    H    ASP  84           HN       ASP  84 -14.399  -0.558  -2.035
  697    HA   ASP  84           HA       ASP  84 -16.981  -1.810  -1.777
  698    HB2  ASP  84           HB2      ASP  84 -16.419   0.642  -3.461
  699    HB3  ASP  84           HB1      ASP  84 -17.863   0.258  -2.525
  700    H    GLU  85           HN       GLU  85 -18.236  -0.888  -4.174
  701    HA   GLU  85           HA       GLU  85 -18.285  -3.075  -5.836
  702    HB2  GLU  85           HB2      GLU  85 -18.544  -0.151  -6.606
  703    HB3  GLU  85           HB1      GLU  85 -19.025  -1.490  -7.649
  704    HG2  GLU  85           HG2      GLU  85 -20.091  -1.051  -4.843
  705    HG3  GLU  85           HG1      GLU  85 -20.931  -0.543  -6.309
  706    H    ASN  86           HN       ASN  86 -16.160  -3.926  -5.978
  707    HA   ASN  86           HA       ASN  86 -13.966  -4.136  -6.774
  708    HB2  ASN  86           HB2      ASN  86 -15.542  -4.801  -8.632
  709    HB3  ASN  86           HB1      ASN  86 -15.288  -3.200  -9.330
  710   HD21  ASN  86          HD21      ASN  86 -13.784  -6.337  -8.739
  711   HD22  ASN  86          HD22      ASN  86 -12.372  -6.036  -9.632
  712    H    HIS  87           HN       HIS  87 -14.488  -1.451  -5.652
  713    HA   HIS  87           HA       HIS  87 -12.082  -0.165  -6.475
  714    HB2  HIS  87           HB2      HIS  87 -13.332   0.398  -8.533
  715    HB3  HIS  87           HB1      HIS  87 -14.599   1.146  -7.564
  716    HD1  HIS  87           HD1      HIS  87 -10.796   1.489  -7.926
  717    HD2  HIS  87           HD2      HIS  87 -14.167   3.847  -7.244
  718    HE1  HIS  87           HE1      HIS  87  -9.985   3.887  -7.822
  719    H    ASP  88           HN       ASP  88 -12.145   2.260  -5.637
  720    HA   ASP  88           HA       ASP  88 -12.266   3.629  -3.766
  721    HB2  ASP  88           HB2      ASP  88 -15.081   2.533  -3.853
  722    HB3  ASP  88           HB1      ASP  88 -14.569   3.727  -2.662
  723    H    MET  89           HN       MET  89 -11.203   3.263  -1.962
  724    HA   MET  89           HA       MET  89 -11.731   0.762  -0.409
  725    HB2  MET  89           HB2      MET  89  -9.323   2.575  -0.670
  726    HB3  MET  89           HB1      MET  89  -9.467   1.397   0.640
  727    HG2  MET  89           HG2      MET  89  -9.736  -0.411  -0.988
  728    HG3  MET  89           HG1      MET  89  -9.657   0.743  -2.315
  729    HE1  MET  89           HE1      MET  89  -6.138   1.026  -3.171
  730    HE2  MET  89           HE2      MET  89  -7.728   1.783  -3.248
  731    HE3  MET  89           HE3      MET  89  -7.547   0.082  -3.675
  732    H    ASP  90           HN       ASP  90 -13.007   1.077   1.303
  733    HA   ASP  90           HA       ASP  90 -13.130   3.761   2.588
  734    HB2  ASP  90           HB2      ASP  90 -15.255   2.709   1.908
  735    HB3  ASP  90           HB1      ASP  90 -14.884   1.310   2.913
  736    H    PHE  91           HN       PHE  91 -11.847   4.045   4.335
  737    HA   PHE  91           HA       PHE  91 -10.989   1.658   5.915
  738    HB2  PHE  91           HB2      PHE  91  -9.934   4.502   5.978
  739    HB3  PHE  91           HB1      PHE  91  -9.213   3.090   6.754
  740    HD1  PHE  91           HD2      PHE  91  -8.501   1.123   5.270
  741    HD2  PHE  91           HD1      PHE  91  -9.433   5.024   3.728
  742    HE1  PHE  91           HE2      PHE  91  -7.298   0.579   3.173
  743    HE2  PHE  91           HE1      PHE  91  -8.231   4.476   1.627
  744    HZ   PHE  91           HZ       PHE  91  -7.168   2.254   1.356
  745    H    LEU  92           HN       LEU  92 -11.594   1.441   8.026
  746    HA   LEU  92           HA       LEU  92 -13.413   3.528   9.181
  747    HB2  LEU  92           HB2      LEU  92 -13.899   1.437  10.760
  748    HB3  LEU  92           HB1      LEU  92 -14.674   1.565   9.183
  749    HG   LEU  92           HG       LEU  92 -11.984   0.223   9.290
  750   HD11  LEU  92          HD11      LEU  92 -14.543  -0.952  10.377
  751   HD12  LEU  92          HD12      LEU  92 -12.945  -0.918  11.124
  752   HD13  LEU  92          HD13      LEU  92 -13.246  -1.961   9.739
  753   HD21  LEU  92          HD21      LEU  92 -12.818  -0.994   7.427
  754   HD22  LEU  92          HD22      LEU  92 -13.440   0.635   7.184
  755   HD23  LEU  92          HD23      LEU  92 -14.492  -0.625   7.821
  756    H    TYR  93           HN       TYR  93 -10.483   1.672   9.636
  757    HA   TYR  93           HA       TYR  93  -9.772   3.414  11.925
  758    HB2  TYR  93           HB2      TYR  93 -10.797   1.348  12.888
  759    HB3  TYR  93           HB1      TYR  93  -9.582   0.395  12.040
  760    HD1  TYR  93           HD2      TYR  93  -9.960   3.191  14.491
  761    HD2  TYR  93           HD1      TYR  93  -7.454   0.031  13.007
  762    HE1  TYR  93           HE2      TYR  93  -8.366   3.580  16.350
  763    HE2  TYR  93           HE1      TYR  93  -5.861   0.422  14.867
  764    HH   TYR  93           HH       TYR  93  -5.564   1.467  16.841
  765    H    LEU  94           HN       LEU  94  -7.934   4.315  11.113
  766    HA   LEU  94           HA       LEU  94  -5.993   2.520   9.691
  767    HB2  LEU  94           HB2      LEU  94  -6.968   4.385   8.322
  768    HB3  LEU  94           HB1      LEU  94  -6.265   5.533   9.459
  769    HG   LEU  94           HG       LEU  94  -4.010   4.586   8.971
  770   HD11  LEU  94          HD11      LEU  94  -4.020   3.246   6.683
  771   HD12  LEU  94          HD12      LEU  94  -5.648   2.802   7.190
  772   HD13  LEU  94          HD13      LEU  94  -4.263   2.399   8.207
  773   HD21  LEU  94          HD21      LEU  94  -5.701   5.701   6.726
  774   HD22  LEU  94          HD22      LEU  94  -3.968   5.439   6.538
  775   HD23  LEU  94          HD23      LEU  94  -4.561   6.557   7.765
  776    H    HIS  95           HN       HIS  95  -4.148   2.141  10.775
  777    HA   HIS  95           HA       HIS  95  -3.148   4.200  12.698
  778    HB2  HIS  95           HB2      HIS  95  -4.285   2.422  13.965
  779    HB3  HIS  95           HB1      HIS  95  -3.255   1.218  13.188
  780    HD1  HIS  95           HD1      HIS  95  -0.984   3.806  13.475
  781    HD2  HIS  95           HD2      HIS  95  -2.764   1.369  16.350
  782    HE1  HIS  95           HE1      HIS  95   0.521   3.896  15.512
  783    H    ASN  96           HN       ASN  96  -1.335   4.878  11.657
  784    HA   ASN  96           HA       ASN  96   0.394   2.874  10.295
  785    HB2  ASN  96           HB2      ASN  96   1.559   4.844   9.377
  786    HB3  ASN  96           HB1      ASN  96  -0.172   4.946   9.064
  787   HD21  ASN  96          HD21      ASN  96  -0.079   7.320   8.975
  788   HD22  ASN  96          HD22      ASN  96   0.118   8.236  10.391
  789    H    THR  97           HN       THR  97   2.874   3.615  10.597
  790    HA   THR  97           HA       THR  97   3.553   2.991  13.311
  791    HB   THR  97           HB       THR  97   5.883   3.561  12.576
  792    HG1  THR  97           HG1      THR  97   4.507   4.237  10.191
  793   HG21  THR  97          HG21      THR  97   4.871   1.328  12.175
  794   HG22  THR  97          HG22      THR  97   6.026   1.770  10.919
  795   HG23  THR  97          HG23      THR  97   4.295   1.894  10.608
  796    H    VAL  98           HN       VAL  98   2.696   5.940  11.794
  797    HA   VAL  98           HA       VAL  98   3.848   7.518  14.064
  798    HB   VAL  98           HB       VAL  98   4.843   8.233  11.991
  799   HG11  VAL  98          HG11      VAL  98   3.628   8.770  10.008
  800   HG12  VAL  98          HG12      VAL  98   2.081   8.714  10.847
  801   HG13  VAL  98          HG13      VAL  98   2.982   7.229  10.560
  802   HG21  VAL  98          HG21      VAL  98   4.526  10.495  12.310
  803   HG22  VAL  98          HG22      VAL  98   3.579   9.960  13.694
  804   HG23  VAL  98          HG23      VAL  98   2.770  10.384  12.187
  805    H    MET  99           HN       MET  99   1.762   6.554  15.013
  806    HA   MET  99           HA       MET  99  -0.360   6.938  15.868
  807    HB2  MET  99           HB2      MET  99  -0.473   9.090  16.640
  808    HB3  MET  99           HB1      MET  99   0.920   9.452  15.630
  809    HG2  MET  99           HG2      MET  99  -0.675   9.954  13.735
  810    HG3  MET  99           HG1      MET  99  -2.006   9.746  14.868
  811    HE1  MET  99           HE1      MET  99  -1.447  13.507  13.807
  812    HE2  MET  99           HE2      MET  99  -1.819  11.915  13.150
  813    HE3  MET  99           HE3      MET  99  -0.163  12.511  13.108
  814    HA   PRO 100           HA       PRO 100  -3.225   6.452  12.507
  815    HB2  PRO 100           HB2      PRO 100  -5.592   7.140  13.707
  816    HB3  PRO 100           HB1      PRO 100  -4.752   5.614  14.041
  817    HG2  PRO 100           HG2      PRO 100  -4.781   8.148  15.625
  818    HG3  PRO 100           HG1      PRO 100  -4.860   6.466  16.186
  819    HD2  PRO 100           HD2      PRO 100  -2.552   7.929  16.267
  820    HD3  PRO 100           HD1      PRO 100  -2.562   6.166  16.043
  821    H    LEU 101           HN       LEU 101  -4.156   7.656  10.851
  822    HA   LEU 101           HA       LEU 101  -4.010  10.630  11.131
  823    HB2  LEU 101           HB2      LEU 101  -4.325   8.997   8.594
  824    HB3  LEU 101           HB1      LEU 101  -3.821  10.682   8.737
  825    HG   LEU 101           HG       LEU 101  -2.284   8.269   9.735
  826   HD11  LEU 101          HD11      LEU 101  -2.398   8.827   7.206
  827   HD12  LEU 101          HD12      LEU 101  -0.805   8.613   7.931
  828   HD13  LEU 101          HD13      LEU 101  -1.419  10.236   7.616
  829   HD21  LEU 101          HD21      LEU 101  -0.482  10.110  10.042
  830   HD22  LEU 101          HD22      LEU 101  -1.762  10.008  11.249
  831   HD23  LEU 101          HD23      LEU 101  -1.832  11.245   9.993
  832    H    LEU 102           HN       LEU 102  -6.069   8.098   9.646
  833    HA   LEU 102           HA       LEU 102  -8.328   9.973   9.491
  834    HB2  LEU 102           HB2      LEU 102  -7.906   8.281   7.704
  835    HB3  LEU 102           HB1      LEU 102  -8.217   7.003   8.873
  836    HG   LEU 102           HG       LEU 102 -10.508   7.960   9.244
  837   HD11  LEU 102          HD11      LEU 102 -11.217   9.486   7.205
  838   HD12  LEU 102          HD12      LEU 102  -9.505   9.904   7.177
  839   HD13  LEU 102          HD13      LEU 102 -10.465  10.207   8.625
  840   HD21  LEU 102          HD21      LEU 102 -11.418   7.175   7.065
  841   HD22  LEU 102          HD22      LEU 102 -10.182   6.089   7.699
  842   HD23  LEU 102          HD23      LEU 102  -9.786   7.207   6.394
  843    H    ASP 103           HN       ASP 103  -8.451   6.616  10.601
  844    HA   ASP 103           HA       ASP 103  -9.793   5.693  12.285
  845    HB2  ASP 103           HB2      ASP 103  -9.032   6.301  14.515
  846    HB3  ASP 103           HB1      ASP 103  -7.661   6.199  13.416
  847    H    GLN 104           HN       GLN 104 -11.686   6.807  11.159
  848    HA   GLN 104           HA       GLN 104 -12.894   8.943  12.866
  849    HB2  GLN 104           HB2      GLN 104 -13.426   7.975  10.051
  850    HB3  GLN 104           HB1      GLN 104 -14.576   8.995  10.916
  851    HG2  GLN 104           HG2      GLN 104 -11.657   9.730  10.590
  852    HG3  GLN 104           HG1      GLN 104 -12.902  10.239   9.450
  853   HE21  GLN 104          HE21      GLN 104 -14.384  11.900  10.120
  854   HE22  GLN 104          HE22      GLN 104 -14.220  12.733  11.590
  855    H    ARG 105           HN       ARG 105 -14.189   8.186  14.414
  856    HA   ARG 105           HA       ARG 105 -15.148   5.512  14.593
  857    HB2  ARG 105           HB2      ARG 105 -16.180   8.027  15.937
  858    HB3  ARG 105           HB1      ARG 105 -16.531   6.378  16.453
  859    HG2  ARG 105           HG2      ARG 105 -13.677   7.327  16.193
  860    HG3  ARG 105           HG1      ARG 105 -14.607   7.676  17.646
  861    HD2  ARG 105           HD2      ARG 105 -14.048   4.916  16.509
  862    HD3  ARG 105           HD1      ARG 105 -13.324   5.613  17.953
  863    HE   ARG 105           HE       ARG 105 -16.068   4.573  17.724
  864   HH11  ARG 105          HH21      ARG 105 -13.744   6.456  19.454
  865   HH12  ARG 105          HH22      ARG 105 -14.598   6.363  20.957
  866   HH21  ARG 105          HH11      ARG 105 -17.194   4.457  19.675
  867   HH22  ARG 105          HH12      ARG 105 -16.550   5.234  21.083
  868    H    TYR 106           HN       TYR 106 -16.524   8.394  13.123
  869    HA   TYR 106           HA       TYR 106 -19.238   7.607  12.969
  870    HB2  TYR 106           HB2      TYR 106 -17.647   9.051  10.826
  871    HB3  TYR 106           HB1      TYR 106 -19.391   9.127  11.074
  872    HD1  TYR 106           HD1      TYR 106 -20.335  10.285  13.060
  873    HD2  TYR 106           HD2      TYR 106 -16.120  10.281  12.231
  874    HE1  TYR 106           HE1      TYR 106 -20.019  12.162  14.650
  875    HE2  TYR 106           HE2      TYR 106 -15.804  12.157  13.821
  876    HH   TYR 106           HH       TYR 106 -17.202  13.002  15.966
  877    H    LEU 107           HN       LEU 107 -16.562   6.976  10.683
  878    HA   LEU 107           HA       LEU 107 -18.111   5.365   8.884
  879    HB2  LEU 107           HB2      LEU 107 -15.137   5.471   9.455
  880    HB3  LEU 107           HB1      LEU 107 -15.843   4.546   8.131
  881    HG   LEU 107           HG       LEU 107 -16.249   7.528   8.519
  882   HD11  LEU 107          HD11      LEU 107 -14.423   6.168   6.522
  883   HD12  LEU 107          HD12      LEU 107 -13.857   6.823   8.058
  884   HD13  LEU 107          HD13      LEU 107 -14.563   7.895   6.850
  885   HD21  LEU 107          HD21      LEU 107 -16.763   7.173   5.933
  886   HD22  LEU 107          HD22      LEU 107 -18.007   6.864   7.137
  887   HD23  LEU 107          HD23      LEU 107 -17.105   5.519   6.442
  888    H    LEU 108           HN       LEU 108 -16.086   4.594  11.692
  889    HA   LEU 108           HA       LEU 108 -16.233   1.752  11.480
  890    HB2  LEU 108           HB2      LEU 108 -14.806   3.326  13.034
  891    HB3  LEU 108           HB1      LEU 108 -16.169   3.185  14.141
  892    HG   LEU 108           HG       LEU 108 -14.635   0.849  12.956
  893   HD11  LEU 108          HD11      LEU 108 -14.577   2.058  15.740
  894   HD12  LEU 108          HD12      LEU 108 -13.282   2.152  14.546
  895   HD13  LEU 108          HD13      LEU 108 -13.727   0.595  15.244
  896   HD21  LEU 108          HD21      LEU 108 -17.045   1.081  14.745
  897   HD22  LEU 108          HD22      LEU 108 -15.919  -0.248  15.020
  898   HD23  LEU 108          HD23      LEU 108 -16.710  -0.076  13.459
  899    H    THR 109           HN       THR 109 -18.285   4.109  13.187
  900    HA   THR 109           HA       THR 109 -20.200   1.956  13.907
  901    HB   THR 109           HB       THR 109 -21.244   3.661  15.311
  902    HG1  THR 109           HG1      THR 109 -20.695   5.361  13.720
  903   HG21  THR 109          HG21      THR 109 -18.216   3.722  15.482
  904   HG22  THR 109          HG22      THR 109 -19.262   2.491  16.192
  905   HG23  THR 109          HG23      THR 109 -19.319   4.150  16.788
  906    H    GLY 110           HN       GLY 110 -19.634   3.784  11.257
  907    HA2  GLY 110           HA2      GLY 110 -21.015   3.956   9.341
  908    HA3  GLY 110           HA1      GLY 110 -22.392   3.449  10.316
  909    H    GLY 111           HN       GLY 111 -22.714   5.508   8.546
  910    HA2  GLY 111           HA2      GLY 111 -22.265   8.110   9.716
  911    HA3  GLY 111           HA1      GLY 111 -23.309   7.766   8.339
  912    H    GLN 112           HN       GLN 112 -23.732   9.453  10.783
  913    HA   GLN 112           HA       GLN 112 -25.370   9.833  12.424
  914    HB2  GLN 112           HB2      GLN 112 -26.890   8.656  10.094
  915    HB3  GLN 112           HB1      GLN 112 -27.701   9.317  11.516
  916    HG2  GLN 112           HG2      GLN 112 -25.616  10.914  10.024
  917    HG3  GLN 112           HG1      GLN 112 -27.303  10.915   9.511
  918   HE21  GLN 112          HE21      GLN 112 -28.683  10.944  11.937
  919   HE22  GLN 112          HE22      GLN 112 -28.292  12.344  12.814
  920    H    LEU 113           HN       LEU 113 -24.861   8.510  14.141
  921    HA   LEU 113           HA       LEU 113 -25.734   5.686  14.157
  922    HB2  LEU 113           HB2      LEU 113 -24.828   5.945  16.618
  923    HB3  LEU 113           HB1      LEU 113 -23.685   5.906  15.278
  924    HG   LEU 113           HG       LEU 113 -24.769   8.600  16.052
  925   HD11  LEU 113          HD11      LEU 113 -22.730   7.077  17.703
  926   HD12  LEU 113          HD12      LEU 113 -24.286   7.701  18.252
  927   HD13  LEU 113          HD13      LEU 113 -22.995   8.818  17.806
  928   HD21  LEU 113          HD21      LEU 113 -21.903   7.802  15.503
  929   HD22  LEU 113          HD22      LEU 113 -22.672   9.372  15.275
  930   HD23  LEU 113          HD23      LEU 113 -23.051   8.041  14.184
  931    H    GLU 114           HN       GLU 114 -27.101   8.690  14.752
  932    HA   GLU 114           HA       GLU 114 -28.755   7.906  17.040
  933    HB2  GLU 114           HB2      GLU 114 -28.762  10.333  15.232
  934    HB3  GLU 114           HB1      GLU 114 -29.878  10.116  16.583
  935    HG2  GLU 114           HG2      GLU 114 -27.990   9.929  18.142
  936    HG3  GLU 114           HG1      GLU 114 -26.853  10.087  16.802
  937    H    HIS 115           HN       HIS 115 -31.055   7.677  16.957
  938    HA   HIS 115           HA       HIS 115 -31.983   6.199  14.642
  939    HB2  HIS 115           HB2      HIS 115 -33.357   7.135  17.172
  940    HB3  HIS 115           HB1      HIS 115 -34.140   6.130  15.950
  941    HD1  HIS 115           HD1      HIS 115 -31.382   6.067  18.514
  942    HD2  HIS 115           HD2      HIS 115 -33.264   3.439  15.883
  943    HE1  HIS 115           HE1      HIS 115 -30.573   3.744  19.120
  944    H    HIS 116           HN       HIS 116 -34.310   6.764  13.832
  945    HA   HIS 116           HA       HIS 116 -34.209   9.195  12.356
  946    HB2  HIS 116           HB2      HIS 116 -35.566   7.208  11.722
  947    HB3  HIS 116           HB1      HIS 116 -36.634   7.523  13.087
  948    HD1  HIS 116           HD1      HIS 116 -35.367   9.318   9.973
  949    HD2  HIS 116           HD2      HIS 116 -38.695   9.264  12.482
  950    HE1  HIS 116           HE1      HIS 116 -37.064  10.891   8.945
  951    H    HIS 117           HN       HIS 117 -35.952   8.341  15.355
  952    HA   HIS 117           HA       HIS 117 -37.068  11.046  15.569
  953    HB2  HIS 117           HB2      HIS 117 -37.815  10.138  17.857
  954    HB3  HIS 117           HB1      HIS 117 -38.484   9.355  16.427
  955    HD1  HIS 117           HD1      HIS 117 -36.014   8.821  19.214
  956    HD2  HIS 117           HD2      HIS 117 -37.625   6.685  16.017
  957    HE1  HIS 117           HE1      HIS 117 -35.339   6.404  19.555
  958    H    HIS 118           HN       HIS 118 -36.167  12.716  16.682
  959    HA   HIS 118           HA       HIS 118 -33.505  12.305  17.881
  960    HB2  HIS 118           HB2      HIS 118 -33.467  14.769  18.021
  961    HB3  HIS 118           HB1      HIS 118 -33.885  14.228  16.396
  962    HD1  HIS 118           HD1      HIS 118 -36.557  14.199  15.864
  963    HD2  HIS 118           HD2      HIS 118 -35.362  16.449  19.164
  964    HE1  HIS 118           HE1      HIS 118 -38.473  15.769  16.394
  965    H    HIS 119           HN       HIS 119 -33.341  11.798  20.008
  966    HA   HIS 119           HA       HIS 119 -34.943  13.272  21.982
  967    HB2  HIS 119           HB2      HIS 119 -36.439  11.396  21.452
  968    HB3  HIS 119           HB1      HIS 119 -35.131  10.251  21.759
  969    HD1  HIS 119           HD1      HIS 119 -37.008  13.010  23.610
  970    HD2  HIS 119           HD2      HIS 119 -34.968   9.462  24.408
  971    HE1  HIS 119           HE1      HIS 119 -37.266  12.578  26.092
  972    H    HIS 120           HN       HIS 120 -33.891  13.369  23.969
  973    HA   HIS 120           HA       HIS 120 -31.856  11.511  24.789
  974    HB2  HIS 120           HB2      HIS 120 -29.869  12.848  24.493
  975    HB3  HIS 120           HB1      HIS 120 -30.660  12.741  22.922
  976    HD1  HIS 120           HD1      HIS 120 -32.020  14.888  22.135
  977    HD2  HIS 120           HD2      HIS 120 -29.682  15.444  25.543
  978    HE1  HIS 120           HE1      HIS 120 -31.821  17.391  22.468
  Start of MODEL   18
    1    H1   MET   1           HT1      MET   1 -14.867  -9.275  21.289
    2    H2   MET   1           HT2      MET   1 -13.217  -9.262  21.696
    3    H3   MET   1           HT3      MET   1 -13.722  -9.906  20.206
    4    HA   MET   1           HA       MET   1 -14.645  -7.600  19.720
    5    HB2  MET   1           HB2      MET   1 -12.768  -7.080  22.046
    6    HB3  MET   1           HB1      MET   1 -13.308  -5.824  20.929
    7    HG2  MET   1           HG2      MET   1 -15.662  -6.338  21.497
    8    HG3  MET   1           HG1      MET   1 -15.112  -7.567  22.635
    9    HE1  MET   1           HE1      MET   1 -16.989  -5.955  23.604
   10    HE2  MET   1           HE2      MET   1 -16.538  -4.782  24.839
   11    HE3  MET   1           HE3      MET   1 -16.081  -6.472  25.032
   12    H    THR   2           HN       THR   2 -13.196  -9.508  18.468
   13    HA   THR   2           HA       THR   2 -10.431  -8.651  18.043
   14    HB   THR   2           HB       THR   2 -10.570 -10.424  16.191
   15    HG1  THR   2           HG1      THR   2 -12.569 -11.784  16.994
   16   HG21  THR   2          HG21      THR   2 -11.145 -11.046  19.093
   17   HG22  THR   2          HG22      THR   2  -9.580 -11.031  18.278
   18   HG23  THR   2          HG23      THR   2 -10.753 -12.296  17.911
   19    H    LEU   3           HN       LEU   3  -9.661  -8.151  15.787
   20    HA   LEU   3           HA       LEU   3 -11.067  -5.918  14.666
   21    HB2  LEU   3           HB2      LEU   3  -8.750  -7.630  13.777
   22    HB3  LEU   3           HB1      LEU   3  -9.409  -6.407  12.691
   23    HG   LEU   3           HG       LEU   3  -8.966  -4.652  14.300
   24   HD11  LEU   3          HD11      LEU   3  -7.733  -5.305  16.439
   25   HD12  LEU   3          HD12      LEU   3  -8.236  -6.963  16.108
   26   HD13  LEU   3          HD13      LEU   3  -9.446  -5.709  16.382
   27   HD21  LEU   3          HD21      LEU   3  -6.640  -6.579  13.993
   28   HD22  LEU   3          HD22      LEU   3  -6.475  -4.905  14.523
   29   HD23  LEU   3          HD23      LEU   3  -7.069  -5.262  12.901
   30    H    GLU   4           HN       GLU   4 -10.814  -9.325  13.661
   31    HA   GLU   4           HA       GLU   4 -12.281  -9.049  11.217
   32    HB2  GLU   4           HB2      GLU   4 -11.888 -11.415  13.070
   33    HB3  GLU   4           HB1      GLU   4 -12.642 -11.531  11.480
   34    HG2  GLU   4           HG2      GLU   4 -10.610 -10.702  10.412
   35    HG3  GLU   4           HG1      GLU   4  -9.857 -10.444  11.987
   36    H    LEU   5           HN       LEU   5 -13.322  -9.946  14.510
   37    HA   LEU   5           HA       LEU   5 -16.073 -10.345  13.846
   38    HB2  LEU   5           HB2      LEU   5 -15.148 -11.125  15.973
   39    HB3  LEU   5           HB1      LEU   5 -14.794  -9.466  16.453
   40    HG   LEU   5           HG       LEU   5 -17.188  -8.922  16.460
   41   HD11  LEU   5          HD11      LEU   5 -18.753 -11.016  16.250
   42   HD12  LEU   5          HD12      LEU   5 -17.413 -11.709  15.337
   43   HD13  LEU   5          HD13      LEU   5 -18.185 -10.222  14.785
   44   HD21  LEU   5          HD21      LEU   5 -17.845 -10.236  18.385
   45   HD22  LEU   5          HD22      LEU   5 -16.107  -9.949  18.483
   46   HD23  LEU   5          HD23      LEU   5 -16.714 -11.518  17.952
   47    H    GLN   6           HN       GLN   6 -14.313  -7.481  14.997
   48    HA   GLN   6           HA       GLN   6 -16.623  -5.759  15.080
   49    HB2  GLN   6           HB2      GLN   6 -13.657  -5.185  14.863
   50    HB3  GLN   6           HB1      GLN   6 -14.880  -3.938  15.091
   51    HG2  GLN   6           HG2      GLN   6 -14.523  -6.300  16.952
   52    HG3  GLN   6           HG1      GLN   6 -13.799  -4.716  17.228
   53   HE21  GLN   6          HE21      GLN   6 -16.358  -6.486  18.247
   54   HE22  GLN   6          HE22      GLN   6 -17.499  -5.255  18.502
   55    H    LEU   7           HN       LEU   7 -14.131  -6.417  12.646
   56    HA   LEU   7           HA       LEU   7 -14.957  -4.429  10.775
   57    HB2  LEU   7           HB2      LEU   7 -12.798  -5.555  10.575
   58    HB3  LEU   7           HB1      LEU   7 -13.602  -7.106  10.332
   59    HG   LEU   7           HG       LEU   7 -14.570  -6.326   8.231
   60   HD11  LEU   7          HD11      LEU   7 -13.403  -3.693   9.115
   61   HD12  LEU   7          HD12      LEU   7 -15.017  -4.040   8.491
   62   HD13  LEU   7          HD13      LEU   7 -13.639  -4.022   7.398
   63   HD21  LEU   7          HD21      LEU   7 -12.369  -7.299   8.040
   64   HD22  LEU   7          HD22      LEU   7 -11.606  -5.779   8.508
   65   HD23  LEU   7          HD23      LEU   7 -12.437  -5.907   6.958
   66    H    LYS   8           HN       LYS   8 -15.848  -7.855  11.107
   67    HA   LYS   8           HA       LYS   8 -17.589  -7.954   8.838
   68    HB2  LYS   8           HB2      LYS   8 -17.458  -9.572  11.388
   69    HB3  LYS   8           HB1      LYS   8 -18.594  -9.936  10.090
   70    HG2  LYS   8           HG2      LYS   8 -16.725 -10.204   8.514
   71    HG3  LYS   8           HG1      LYS   8 -15.578  -9.804   9.787
   72    HD2  LYS   8           HD2      LYS   8 -16.258 -11.773  11.068
   73    HD3  LYS   8           HD1      LYS   8 -17.498 -12.151   9.872
   74    HE2  LYS   8           HE2      LYS   8 -15.536 -13.541   9.454
   75    HE3  LYS   8           HE1      LYS   8 -15.707 -12.372   8.145
   76    HZ1  LYS   8           HZ1      LYS   8 -13.579 -11.918   8.600
   77    HZ2  LYS   8           HZ2      LYS   8 -13.643 -12.610  10.151
   78    HZ3  LYS   8           HZ3      LYS   8 -14.196 -11.022   9.901
   79    H    HIS   9           HN       HIS   9 -18.135  -7.139  12.237
   80    HA   HIS   9           HA       HIS   9 -20.973  -6.982  12.150
   81    HB2  HIS   9           HB2      HIS   9 -19.602  -6.918  14.229
   82    HB3  HIS   9           HB1      HIS   9 -19.071  -5.292  13.795
   83    HD1  HIS   9           HD1      HIS   9 -20.853  -3.383  13.874
   84    HD2  HIS   9           HD2      HIS   9 -22.263  -7.079  15.192
   85    HE1  HIS   9           HE1      HIS   9 -23.071  -2.939  15.015
   86    H    TYR  10           HN       TYR  10 -18.509  -4.453  11.587
   87    HA   TYR  10           HA       TYR  10 -20.360  -2.334  11.056
   88    HB2  TYR  10           HB2      TYR  10 -17.995  -1.891  11.512
   89    HB3  TYR  10           HB1      TYR  10 -17.533  -2.760  10.048
   90    HD1  TYR  10           HD1      TYR  10 -19.529   0.153  11.259
   91    HD2  TYR  10           HD2      TYR  10 -17.462  -1.654   7.954
   92    HE1  TYR  10           HE1      TYR  10 -19.832   2.227   9.934
   93    HE2  TYR  10           HE2      TYR  10 -17.766   0.420   6.630
   94    HH   TYR  10           HH       TYR  10 -18.193   2.753   6.941
   95    H    ILE  11           HN       ILE  11 -18.623  -4.517   8.829
   96    HA   ILE  11           HA       ILE  11 -19.793  -3.464   6.435
   97    HB   ILE  11           HB       ILE  11 -18.612  -6.181   7.067
   98   HG12  ILE  11          HG12      ILE  11 -17.469  -3.837   5.520
   99   HG13  ILE  11          HG11      ILE  11 -17.140  -4.136   7.228
  100   HG21  ILE  11          HG21      ILE  11 -19.509  -4.958   4.446
  101   HG22  ILE  11          HG22      ILE  11 -20.013  -6.496   5.145
  102   HG23  ILE  11          HG23      ILE  11 -18.376  -6.304   4.531
  103   HD11  ILE  11          HD11      ILE  11 -16.521  -6.014   4.935
  104   HD12  ILE  11          HD12      ILE  11 -16.266  -6.390   6.635
  105   HD13  ILE  11          HD13      ILE  11 -15.344  -5.094   5.871
  106    H    THR  12           HN       THR  12 -20.701  -6.208   8.511
  107    HA   THR  12           HA       THR  12 -22.881  -7.126   6.917
  108    HB   THR  12           HB       THR  12 -23.687  -8.105   9.120
  109    HG1  THR  12           HG1      THR  12 -22.900  -7.208  10.822
  110   HG21  THR  12          HG21      THR  12 -20.933  -8.509   7.976
  111   HG22  THR  12          HG22      THR  12 -22.321  -9.597   7.954
  112   HG23  THR  12          HG23      THR  12 -21.393  -9.377   9.439
  113    H    ASN  13           HN       ASN  13 -22.829  -4.916   9.714
  114    HA   ASN  13           HA       ASN  13 -25.652  -4.347   9.624
  115    HB2  ASN  13           HB2      ASN  13 -24.295  -3.954  11.637
  116    HB3  ASN  13           HB1      ASN  13 -23.361  -2.732  10.775
  117   HD21  ASN  13          HD21      ASN  13 -24.600  -1.790  13.014
  118   HD22  ASN  13          HD22      ASN  13 -25.975  -0.873  12.624
  119    H    LEU  14           HN       LEU  14 -22.794  -2.820   8.203
  120    HA   LEU  14           HA       LEU  14 -24.075  -0.470   7.236
  121    HB2  LEU  14           HB2      LEU  14 -21.631  -0.705   7.276
  122    HB3  LEU  14           HB1      LEU  14 -21.722  -2.004   6.088
  123    HG   LEU  14           HG       LEU  14 -22.627  -0.465   4.413
  124   HD11  LEU  14          HD11      LEU  14 -22.520   2.065   5.124
  125   HD12  LEU  14          HD12      LEU  14 -22.694   1.424   6.758
  126   HD13  LEU  14          HD13      LEU  14 -23.938   1.108   5.544
  127   HD21  LEU  14          HD21      LEU  14 -20.645   0.795   4.002
  128   HD22  LEU  14          HD22      LEU  14 -20.118  -0.642   4.876
  129   HD23  LEU  14          HD23      LEU  14 -20.266   0.898   5.722
  130    H    PHE  15           HN       PHE  15 -23.566  -3.638   5.689
  131    HA   PHE  15           HA       PHE  15 -25.370  -2.800   3.454
  132    HB2  PHE  15           HB2      PHE  15 -23.338  -5.027   3.751
  133    HB3  PHE  15           HB1      PHE  15 -24.453  -4.915   2.386
  134    HD1  PHE  15           HD1      PHE  15 -24.448  -2.814   0.967
  135    HD2  PHE  15           HD2      PHE  15 -21.373  -3.679   3.837
  136    HE1  PHE  15           HE1      PHE  15 -22.957  -1.171  -0.138
  137    HE2  PHE  15           HE2      PHE  15 -19.879  -2.035   2.730
  138    HZ   PHE  15           HZ       PHE  15 -20.672  -0.781   0.742
  139    H    ASN  16           HN       ASN  16 -25.605  -4.192   6.397
  140    HA   ASN  16           HA       ASN  16 -27.173  -5.596   7.422
  141    HB2  ASN  16           HB2      ASN  16 -28.744  -5.233   4.852
  142    HB3  ASN  16           HB1      ASN  16 -29.378  -5.683   6.435
  143   HD21  ASN  16          HD21      ASN  16 -29.316  -3.081   4.463
  144   HD22  ASN  16          HD22      ASN  16 -29.218  -1.828   5.606
  145    H    LEU  17           HN       LEU  17 -25.025  -6.802   5.905
  146    HA   LEU  17           HA       LEU  17 -26.262  -9.090   4.538
  147    HB2  LEU  17           HB2      LEU  17 -23.358  -8.435   5.043
  148    HB3  LEU  17           HB1      LEU  17 -23.938  -9.753   4.029
  149    HG   LEU  17           HG       LEU  17 -24.751  -6.876   3.575
  150   HD11  LEU  17          HD11      LEU  17 -22.492  -8.359   2.206
  151   HD12  LEU  17          HD12      LEU  17 -22.271  -7.120   3.443
  152   HD13  LEU  17          HD13      LEU  17 -23.007  -6.701   1.896
  153   HD21  LEU  17          HD21      LEU  17 -24.937  -9.440   1.980
  154   HD22  LEU  17          HD22      LEU  17 -25.019  -7.870   1.190
  155   HD23  LEU  17          HD23      LEU  17 -26.222  -8.307   2.394
  156    HA   PRO  18           HA       PRO  18 -26.376 -11.864   7.992
  157    HB2  PRO  18           HB2      PRO  18 -24.849 -13.838   6.333
  158    HB3  PRO  18           HB1      PRO  18 -26.390 -14.039   7.190
  159    HG2  PRO  18           HG2      PRO  18 -26.270 -13.744   4.526
  160    HG3  PRO  18           HG1      PRO  18 -27.613 -13.104   5.489
  161    HD2  PRO  18           HD2      PRO  18 -25.376 -11.629   4.175
  162    HD3  PRO  18           HD1      PRO  18 -27.026 -11.095   4.566
  163    H    ARG  19           HN       ARG  19 -25.113 -11.893   9.758
  164    HA   ARG  19           HA       ARG  19 -22.177 -11.554   9.499
  165    HB2  ARG  19           HB2      ARG  19 -22.289 -11.051  11.918
  166    HB3  ARG  19           HB1      ARG  19 -23.415 -10.044  11.006
  167    HG2  ARG  19           HG2      ARG  19 -25.250 -11.626  11.545
  168    HG3  ARG  19           HG1      ARG  19 -24.126 -12.588  12.506
  169    HD2  ARG  19           HD2      ARG  19 -23.692 -10.618  13.943
  170    HD3  ARG  19           HD1      ARG  19 -24.868  -9.694  13.010
  171    HE   ARG  19           HE       ARG  19 -25.481 -11.682  15.044
  172   HH11  ARG  19          HH21      ARG  19 -26.513 -10.190  12.102
  173   HH12  ARG  19          HH22      ARG  19 -28.197 -10.453  12.411
  174   HH21  ARG  19          HH11      ARG  19 -27.669 -12.028  15.451
  175   HH22  ARG  19          HH12      ARG  19 -28.851 -11.488  14.305
  176    H    ASP  20           HN       ASP  20 -24.517 -13.969  10.096
  177    HA   ASP  20           HA       ASP  20 -22.761 -15.684  11.704
  178    HB2  ASP  20           HB2      ASP  20 -24.598 -17.358  11.393
  179    HB3  ASP  20           HB1      ASP  20 -25.166 -15.829  12.062
  180    H    GLU  21           HN       GLU  21 -22.718 -14.787   8.542
  181    HA   GLU  21           HA       GLU  21 -22.096 -17.458   7.423
  182    HB2  GLU  21           HB2      GLU  21 -23.392 -15.824   6.074
  183    HB3  GLU  21           HB1      GLU  21 -22.019 -14.718   6.118
  184    HG2  GLU  21           HG2      GLU  21 -20.618 -16.369   4.966
  185    HG3  GLU  21           HG1      GLU  21 -21.948 -17.527   4.974
  186    H    LYS  22           HN       LYS  22 -20.074 -18.230   7.687
  187    HA   LYS  22           HA       LYS  22 -17.855 -16.461   8.401
  188    HB2  LYS  22           HB2      LYS  22 -17.914 -19.435   7.819
  189    HB3  LYS  22           HB1      LYS  22 -16.566 -18.560   8.544
  190    HG2  LYS  22           HG2      LYS  22 -19.353 -18.698   9.734
  191    HG3  LYS  22           HG1      LYS  22 -18.012 -19.729  10.229
  192    HD2  LYS  22           HD2      LYS  22 -16.729 -17.497  10.627
  193    HD3  LYS  22           HD1      LYS  22 -18.325 -16.747  10.586
  194    HE2  LYS  22           HE2      LYS  22 -17.546 -19.027  12.419
  195    HE3  LYS  22           HE1      LYS  22 -17.634 -17.329  12.893
  196    HZ1  LYS  22           HZ1      LYS  22 -19.750 -19.227  12.500
  197    HZ2  LYS  22           HZ2      LYS  22 -20.014 -17.764  11.677
  198    HZ3  LYS  22           HZ3      LYS  22 -19.754 -17.761  13.356
  199    H    TRP  23           HN       TRP  23 -16.141 -15.886   7.108
  200    HA   TRP  23           HA       TRP  23 -16.432 -16.464   4.191
  201    HB2  TRP  23           HB2      TRP  23 -14.699 -14.370   5.524
  202    HB3  TRP  23           HB1      TRP  23 -15.126 -14.479   3.817
  203    HD1  TRP  23           HD1      TRP  23 -18.288 -15.273   4.797
  204    HE1  TRP  23           HE1      TRP  23 -19.803 -13.270   5.341
  205    HE3  TRP  23           HE3      TRP  23 -14.754 -11.654   5.521
  206    HZ2  TRP  23           HZ2      TRP  23 -19.561 -10.502   5.993
  207    HZ3  TRP  23           HZ3      TRP  23 -15.427  -9.344   6.101
  208    HH2  TRP  23           HH2      TRP  23 -17.826  -8.762   6.338
  209    H    GLU  24           HN       GLU  24 -14.065 -16.231   3.148
  210    HA   GLU  24           HA       GLU  24 -12.403 -18.320   4.504
  211    HB2  GLU  24           HB2      GLU  24 -12.677 -17.502   1.599
  212    HB3  GLU  24           HB1      GLU  24 -11.492 -18.673   2.182
  213    HG2  GLU  24           HG2      GLU  24 -14.493 -18.919   2.567
  214    HG3  GLU  24           HG1      GLU  24 -13.574 -19.756   1.315
  215    H    CYS  25           HN       CYS  25 -10.601 -17.602   5.416
  216    HA   CYS  25           HA       CYS  25  -9.535 -14.939   4.762
  217    HB2  CYS  25           HB2      CYS  25  -8.298 -16.885   6.705
  218    HB3  CYS  25           HB1      CYS  25  -8.328 -15.121   6.769
  219    HG   CYS  25           HG       CYS  25 -10.333 -15.398   8.196
  220    H    GLU  26           HN       GLU  26  -7.658 -14.568   3.644
  221    HA   GLU  26           HA       GLU  26  -5.961 -16.918   2.888
  222    HB2  GLU  26           HB2      GLU  26  -7.441 -16.326   0.992
  223    HB3  GLU  26           HB1      GLU  26  -6.837 -14.670   1.045
  224    HG2  GLU  26           HG2      GLU  26  -4.564 -15.456   0.574
  225    HG3  GLU  26           HG1      GLU  26  -5.120 -17.130   0.596
  226    H    SER  27           HN       SER  27  -3.935 -16.551   3.574
  227    HA   SER  27           HA       SER  27  -3.082 -13.755   4.148
  228    HB2  SER  27           HB2      SER  27  -2.791 -15.325   5.977
  229    HB3  SER  27           HB1      SER  27  -1.928 -16.447   4.929
  230    HG   SER  27           HG       SER  27  -0.456 -14.558   4.601
  231    H    ILE  28           HN       ILE  28  -1.866 -12.757   2.665
  232    HA   ILE  28           HA       ILE  28   0.165 -14.302   1.149
  233    HB   ILE  28           HB       ILE  28  -1.667 -14.345  -0.390
  234   HG12  ILE  28          HG12      ILE  28   0.738 -13.214  -1.050
  235   HG13  ILE  28          HG11      ILE  28  -0.531 -13.527  -2.222
  236   HG21  ILE  28          HG21      ILE  28  -2.050 -11.448   0.382
  237   HG22  ILE  28          HG22      ILE  28  -3.182 -12.782   0.572
  238   HG23  ILE  28          HG23      ILE  28  -2.818 -12.165  -1.037
  239   HD11  ILE  28          HD11      ILE  28   0.494 -11.185  -2.257
  240   HD12  ILE  28          HD12      ILE  28  -0.338 -10.899  -0.736
  241   HD13  ILE  28          HD13      ILE  28  -1.263 -11.258  -2.186
  242    H    GLU  29           HN       GLU  29   1.958 -13.053   0.629
  243    HA   GLU  29           HA       GLU  29   2.140 -10.458   2.021
  244    HB2  GLU  29           HB2      GLU  29   4.190 -12.119   0.520
  245    HB3  GLU  29           HB1      GLU  29   4.550 -10.633   1.399
  246    HG2  GLU  29           HG2      GLU  29   5.037 -12.281   2.998
  247    HG3  GLU  29           HG1      GLU  29   3.391 -11.827   3.427
  248    H    GLU  30           HN       GLU  30   1.913  -8.536   0.977
  249    HA   GLU  30           HA       GLU  30   2.489  -8.392  -1.942
  250    HB2  GLU  30           HB2      GLU  30   0.070  -8.874  -1.734
  251    HB3  GLU  30           HB1      GLU  30  -0.117  -7.465  -0.692
  252    HG2  GLU  30           HG2      GLU  30   0.589  -5.990  -2.494
  253    HG3  GLU  30           HG1      GLU  30   0.937  -7.371  -3.533
  254    H    VAL  31           HN       VAL  31   2.796  -6.212  -2.690
  255    HA   VAL  31           HA       VAL  31   4.177  -4.527  -0.828
  256    HB   VAL  31           HB       VAL  31   3.151  -3.997  -3.625
  257   HG11  VAL  31          HG11      VAL  31   4.912  -2.166  -3.558
  258   HG12  VAL  31          HG12      VAL  31   4.972  -2.397  -1.810
  259   HG13  VAL  31          HG13      VAL  31   3.478  -1.860  -2.580
  260   HG21  VAL  31          HG21      VAL  31   5.884  -4.739  -2.534
  261   HG22  VAL  31          HG22      VAL  31   5.529  -4.380  -4.223
  262   HG23  VAL  31          HG23      VAL  31   4.819  -5.800  -3.455
  263    H    ALA  32           HN       ALA  32   3.468  -2.794   0.343
  264    HA   ALA  32           HA       ALA  32   0.733  -2.444   0.979
  265    HB1  ALA  32           HB1      ALA  32   2.373  -1.612   2.499
  266    HB2  ALA  32           HB2      ALA  32   1.539  -0.186   1.876
  267    HB3  ALA  32           HB3      ALA  32   3.128  -0.621   1.249
  268    H    ASP  33           HN       ASP  33   2.799  -0.622  -1.284
  269    HA   ASP  33           HA       ASP  33   0.870   1.342  -2.042
  270    HB2  ASP  33           HB2      ASP  33   3.301   1.490  -2.517
  271    HB3  ASP  33           HB1      ASP  33   3.137   0.176  -3.679
  272    H    ASP  34           HN       ASP  34   1.455  -1.945  -3.207
  273    HA   ASP  34           HA       ASP  34  -0.201  -1.765  -5.552
  274    HB2  ASP  34           HB2      ASP  34   0.731  -4.081  -3.853
  275    HB3  ASP  34           HB1      ASP  34  -0.300  -4.316  -5.265
  276    H    ILE  35           HN       ILE  35  -0.990  -1.909  -2.204
  277    HA   ILE  35           HA       ILE  35  -3.836  -2.623  -2.870
  278    HB   ILE  35           HB       ILE  35  -2.840  -4.306  -1.420
  279   HG12  ILE  35          HG12      ILE  35  -4.504  -2.532   0.379
  280   HG13  ILE  35          HG11      ILE  35  -5.213  -3.343  -1.017
  281   HG21  ILE  35          HG21      ILE  35  -2.014  -3.611   0.854
  282   HG22  ILE  35          HG22      ILE  35  -2.096  -1.935   0.319
  283   HG23  ILE  35          HG23      ILE  35  -0.997  -3.058  -0.474
  284   HD11  ILE  35          HD11      ILE  35  -3.574  -4.942   0.931
  285   HD12  ILE  35          HD12      ILE  35  -4.883  -5.470  -0.121
  286   HD13  ILE  35          HD13      ILE  35  -5.242  -4.534   1.329
  287    H    LEU  36           HN       LEU  36  -1.676  -0.375  -1.308
  288    HA   LEU  36           HA       LEU  36  -4.006   1.251  -0.386
  289    HB2  LEU  36           HB2      LEU  36  -1.137   1.086   0.482
  290    HB3  LEU  36           HB1      LEU  36  -2.120   2.487   0.877
  291    HG   LEU  36           HG       LEU  36  -3.264  -0.236   1.436
  292   HD11  LEU  36          HD11      LEU  36  -1.024   1.082   2.962
  293   HD12  LEU  36          HD12      LEU  36  -1.188  -0.604   2.472
  294   HD13  LEU  36          HD13      LEU  36  -2.186   0.038   3.776
  295   HD21  LEU  36          HD21      LEU  36  -4.490   0.926   3.110
  296   HD22  LEU  36          HD22      LEU  36  -4.445   2.042   1.747
  297   HD23  LEU  36          HD23      LEU  36  -3.359   2.279   3.114
  298    HA   PRO  37           HA       PRO  37  -2.918   3.546  -4.214
  299    HB2  PRO  37           HB2      PRO  37  -5.022   5.287  -2.946
  300    HB3  PRO  37           HB1      PRO  37  -4.835   4.809  -4.647
  301    HG2  PRO  37           HG2      PRO  37  -6.655   3.638  -3.132
  302    HG3  PRO  37           HG1      PRO  37  -5.689   2.684  -4.276
  303    HD2  PRO  37           HD2      PRO  37  -5.446   2.849  -1.293
  304    HD3  PRO  37           HD1      PRO  37  -5.166   1.465  -2.378
  305    H    ASP  38           HN       ASP  38  -2.013   5.706  -4.577
  306    HA   ASP  38           HA       ASP  38  -0.125   6.546  -2.665
  307    HB2  ASP  38           HB2      ASP  38   0.025   8.628  -4.026
  308    HB3  ASP  38           HB1      ASP  38   0.051   7.170  -5.016
  309    H    GLN  39           HN       GLN  39  -3.444   6.852  -2.524
  310    HA   GLN  39           HA       GLN  39  -3.873   9.416  -1.388
  311    HB2  GLN  39           HB2      GLN  39  -5.256   6.760  -0.931
  312    HB3  GLN  39           HB1      GLN  39  -5.872   8.298  -0.325
  313    HG2  GLN  39           HG2      GLN  39  -5.979   9.179  -2.614
  314    HG3  GLN  39           HG1      GLN  39  -5.308   7.672  -3.238
  315   HE21  GLN  39          HE21      GLN  39  -7.589   7.968  -4.436
  316   HE22  GLN  39          HE22      GLN  39  -8.891   7.168  -3.695
  317    H    TYR  40           HN       TYR  40  -2.842   6.354   0.093
  318    HA   TYR  40           HA       TYR  40  -1.996   7.892   2.509
  319    HB2  TYR  40           HB2      TYR  40  -3.568   5.296   2.524
  320    HB3  TYR  40           HB1      TYR  40  -2.853   6.057   3.947
  321    HD1  TYR  40           HD2      TYR  40  -3.624   8.349   4.656
  322    HD2  TYR  40           HD1      TYR  40  -5.618   6.104   1.583
  323    HE1  TYR  40           HE2      TYR  40  -5.611   9.818   4.872
  324    HE2  TYR  40           HE1      TYR  40  -7.602   7.575   1.797
  325    HH   TYR  40           HH       TYR  40  -7.950   9.830   4.395
  326    H    VAL  41           HN       VAL  41  -0.036   7.538   1.028
  327    HA   VAL  41           HA       VAL  41   1.517   5.297   2.113
  328    HB   VAL  41           HB       VAL  41   0.927   5.544  -0.852
  329   HG11  VAL  41          HG11      VAL  41   3.085   4.032   0.615
  330   HG12  VAL  41          HG12      VAL  41   3.278   5.168  -0.721
  331   HG13  VAL  41          HG13      VAL  41   2.558   3.583  -1.005
  332   HG21  VAL  41          HG21      VAL  41   0.436   3.041  -0.470
  333   HG22  VAL  41          HG22      VAL  41  -0.727   4.193   0.183
  334   HG23  VAL  41          HG23      VAL  41   0.447   3.420   1.250
  335    H    ARG  42           HN       ARG  42   1.240   8.312   0.424
  336    HA   ARG  42           HA       ARG  42   3.959   8.788  -0.257
  337    HB2  ARG  42           HB2      ARG  42   1.896  10.798   0.704
  338    HB3  ARG  42           HB1      ARG  42   3.344  11.164  -0.230
  339    HG2  ARG  42           HG2      ARG  42   1.270   9.229  -1.276
  340    HG3  ARG  42           HG1      ARG  42   1.085  10.964  -1.505
  341    HD2  ARG  42           HD2      ARG  42   3.345  11.021  -2.576
  342    HD3  ARG  42           HD1      ARG  42   3.421   9.268  -2.437
  343    HE   ARG  42           HE       ARG  42   1.891   9.092  -4.226
  344   HH11  ARG  42          HH21      ARG  42   2.066  12.303  -2.970
  345   HH12  ARG  42          HH22      ARG  42   1.149  12.995  -4.266
  346   HH21  ARG  42          HH11      ARG  42   0.708   9.979  -5.915
  347   HH22  ARG  42          HH12      ARG  42   0.381  11.680  -5.935
  348    H    LEU  43           HN       LEU  43   2.686   8.105   2.721
  349    HA   LEU  43           HA       LEU  43   3.983   9.962   4.458
  350    HB2  LEU  43           HB2      LEU  43   3.004   7.124   4.745
  351    HB3  LEU  43           HB1      LEU  43   3.854   7.902   6.073
  352    HG   LEU  43           HG       LEU  43   1.359   8.131   6.198
  353   HD11  LEU  43          HD11      LEU  43   3.215   9.948   6.946
  354   HD12  LEU  43          HD12      LEU  43   1.492  10.221   7.152
  355   HD13  LEU  43          HD13      LEU  43   2.333  10.930   5.776
  356   HD21  LEU  43          HD21      LEU  43   0.174   9.452   4.595
  357   HD22  LEU  43          HD22      LEU  43   1.157   8.327   3.661
  358   HD23  LEU  43          HD23      LEU  43   1.669  10.005   3.842
  359    H    GLY  44           HN       GLY  44   5.077   6.878   3.063
  360    HA2  GLY  44           HA2      GLY  44   7.516   6.891   2.393
  361    HA3  GLY  44           HA1      GLY  44   7.865   7.522   3.989
  362    HA   PRO  45           HA       PRO  45   8.161   3.543   5.895
  363    HB2  PRO  45           HB2      PRO  45   5.602   3.923   7.408
  364    HB3  PRO  45           HB1      PRO  45   7.223   3.530   8.015
  365    HG2  PRO  45           HG2      PRO  45   6.175   5.973   8.291
  366    HG3  PRO  45           HG1      PRO  45   7.907   5.730   7.999
  367    HD2  PRO  45           HD2      PRO  45   5.803   6.698   6.111
  368    HD3  PRO  45           HD1      PRO  45   7.525   7.107   6.184
  369    H    LEU  46           HN       LEU  46   4.849   4.296   4.851
  370    HA   LEU  46           HA       LEU  46   4.207   1.454   4.418
  371    HB2  LEU  46           HB2      LEU  46   2.695   3.975   3.641
  372    HB3  LEU  46           HB1      LEU  46   2.048   2.336   3.607
  373    HG   LEU  46           HG       LEU  46   3.034   3.782   6.089
  374   HD11  LEU  46          HD11      LEU  46   0.971   4.791   5.429
  375   HD12  LEU  46          HD12      LEU  46   0.552   3.629   6.687
  376   HD13  LEU  46          HD13      LEU  46   0.266   3.234   4.992
  377   HD21  LEU  46          HD21      LEU  46   1.696   1.761   7.127
  378   HD22  LEU  46          HD22      LEU  46   3.346   1.509   6.573
  379   HD23  LEU  46          HD23      LEU  46   1.992   1.001   5.563
  380    H    SER  47           HN       SER  47   5.939   3.817   2.830
  381    HA   SER  47           HA       SER  47   5.166   3.228   0.088
  382    HB2  SER  47           HB2      SER  47   6.704   4.867  -0.509
  383    HB3  SER  47           HB1      SER  47   6.287   5.362   1.129
  384    HG   SER  47           HG       SER  47   8.608   4.160   0.134
  385    H    ASN  48           HN       ASN  48   5.889   1.647  -1.182
  386    HA   ASN  48           HA       ASN  48   7.024  -0.284  -1.853
  387    HB2  ASN  48           HB2      ASN  48   8.697   1.551  -2.310
  388    HB3  ASN  48           HB1      ASN  48   9.446   1.169  -0.758
  389   HD21  ASN  48          HD21      ASN  48   8.460  -0.455  -3.829
  390   HD22  ASN  48          HD22      ASN  48   9.734  -1.576  -3.816
  391    H    LYS  49           HN       LYS  49   5.967  -0.291   0.888
  392    HA   LYS  49           HA       LYS  49   7.972  -2.057   2.246
  393    HB2  LYS  49           HB2      LYS  49   7.221  -0.089   3.537
  394    HB3  LYS  49           HB1      LYS  49   5.557  -0.657   3.414
  395    HG2  LYS  49           HG2      LYS  49   6.101  -2.696   4.615
  396    HG3  LYS  49           HG1      LYS  49   7.813  -2.286   4.619
  397    HD2  LYS  49           HD2      LYS  49   5.853  -0.346   5.833
  398    HD3  LYS  49           HD1      LYS  49   6.305  -1.782   6.747
  399    HE2  LYS  49           HE2      LYS  49   8.667  -1.188   6.603
  400    HE3  LYS  49           HE1      LYS  49   8.290   0.194   5.579
  401    HZ1  LYS  49           HZ1      LYS  49   6.682   0.558   7.723
  402    HZ2  LYS  49           HZ2      LYS  49   8.179   1.323   7.477
  403    HZ3  LYS  49           HZ3      LYS  49   8.085  -0.082   8.428
  404    H    ILE  50           HN       ILE  50   7.581  -4.159   2.208
  405    HA   ILE  50           HA       ILE  50   5.036  -5.203   1.203
  406    HB   ILE  50           HB       ILE  50   7.586  -6.540   2.136
  407   HG12  ILE  50          HG12      ILE  50   7.768  -7.040  -0.333
  408   HG13  ILE  50          HG11      ILE  50   6.380  -5.988  -0.594
  409   HG21  ILE  50          HG21      ILE  50   6.542  -8.544   0.927
  410   HG22  ILE  50          HG22      ILE  50   5.012  -7.672   1.025
  411   HG23  ILE  50          HG23      ILE  50   5.858  -8.137   2.502
  412   HD11  ILE  50          HD11      ILE  50   8.710  -4.893   0.955
  413   HD12  ILE  50          HD12      ILE  50   7.574  -4.060  -0.104
  414   HD13  ILE  50          HD13      ILE  50   8.858  -5.047  -0.794
  415    H    LEU  51           HN       LEU  51   3.383  -5.894   2.483
  416    HA   LEU  51           HA       LEU  51   3.986  -6.601   5.320
  417    HB2  LEU  51           HB2      LEU  51   2.274  -5.236   6.183
  418    HB3  LEU  51           HB1      LEU  51   3.089  -4.211   5.015
  419    HG   LEU  51           HG       LEU  51   0.473  -5.668   4.628
  420   HD11  LEU  51          HD11      LEU  51   1.287  -2.746   4.721
  421   HD12  LEU  51          HD12      LEU  51   0.347  -3.606   5.938
  422   HD13  LEU  51          HD13      LEU  51  -0.333  -3.323   4.337
  423   HD21  LEU  51          HD21      LEU  51   0.568  -4.282   2.414
  424   HD22  LEU  51          HD22      LEU  51   1.477  -5.784   2.480
  425   HD23  LEU  51          HD23      LEU  51   2.308  -4.244   2.688
  426    H    GLN  52           HN       GLN  52   2.098  -7.722   6.353
  427    HA   GLN  52           HA       GLN  52   1.259  -9.891   4.601
  428    HB2  GLN  52           HB2      GLN  52   1.926 -10.246   6.975
  429    HB3  GLN  52           HB1      GLN  52   0.527  -9.305   7.486
  430    HG2  GLN  52           HG2      GLN  52  -0.009 -11.681   7.615
  431    HG3  GLN  52           HG1      GLN  52  -0.956 -10.948   6.323
  432   HE21  GLN  52          HE21      GLN  52   1.616 -13.237   7.028
  433   HE22  GLN  52          HE22      GLN  52   1.820 -13.789   5.435
  434    H    THR  53           HN       THR  53  -0.565  -9.822   3.404
  435    HA   THR  53           HA       THR  53  -2.762  -7.968   4.244
  436    HB   THR  53           HB       THR  53  -1.993  -9.010   1.508
  437    HG1  THR  53           HG1      THR  53  -2.002  -6.508   1.399
  438   HG21  THR  53          HG21      THR  53  -3.819  -7.366   0.792
  439   HG22  THR  53          HG22      THR  53  -4.352  -7.386   2.473
  440   HG23  THR  53          HG23      THR  53  -4.372  -8.873   1.524
  441    H    ASN  54           HN       ASN  54  -4.403  -9.026   5.157
  442    HA   ASN  54           HA       ASN  54  -4.935 -11.855   4.367
  443    HB2  ASN  54           HB2      ASN  54  -4.595 -11.320   6.787
  444    HB3  ASN  54           HB1      ASN  54  -6.012 -10.270   6.718
  445   HD21  ASN  54          HD21      ASN  54  -5.730 -12.773   8.302
  446   HD22  ASN  54          HD22      ASN  54  -6.946 -13.819   7.748
  447    H    THR  55           HN       THR  55  -6.243 -11.770   2.602
  448    HA   THR  55           HA       THR  55  -8.483  -9.817   2.520
  449    HB   THR  55           HB       THR  55  -7.465 -11.766   0.433
  450    HG1  THR  55           HG1      THR  55  -6.437  -9.543   1.315
  451   HG21  THR  55          HG21      THR  55  -9.481  -9.507   0.318
  452   HG22  THR  55          HG22      THR  55  -9.801 -11.223   0.057
  453   HG23  THR  55          HG23      THR  55  -8.821 -10.320  -1.100
  454    H    TYR  56           HN       TYR  56 -10.539 -10.443   2.927
  455    HA   TYR  56           HA       TYR  56 -11.087 -13.368   3.263
  456    HB2  TYR  56           HB2      TYR  56 -12.647 -11.017   4.361
  457    HB3  TYR  56           HB1      TYR  56 -12.828 -12.719   4.792
  458    HD1  TYR  56           HD1      TYR  56 -10.617  -9.763   5.034
  459    HD2  TYR  56           HD2      TYR  56 -11.283 -13.817   6.291
  460    HE1  TYR  56           HE1      TYR  56  -8.867  -9.511   6.773
  461    HE2  TYR  56           HE2      TYR  56  -9.534 -13.563   8.031
  462    HH   TYR  56           HH       TYR  56  -8.552 -11.227   9.325
  463    H    TYR  57           HN       TYR  57 -12.741 -14.285   2.040
  464    HA   TYR  57           HA       TYR  57 -14.617 -12.522   0.592
  465    HB2  TYR  57           HB2      TYR  57 -14.060 -13.482  -1.610
  466    HB3  TYR  57           HB1      TYR  57 -12.688 -12.612  -0.929
  467    HD1  TYR  57           HD2      TYR  57 -14.064 -15.929  -1.756
  468    HD2  TYR  57           HD1      TYR  57 -10.712 -13.801  -0.114
  469    HE1  TYR  57           HE2      TYR  57 -12.672 -17.972  -1.948
  470    HE2  TYR  57           HE1      TYR  57  -9.321 -15.843  -0.310
  471    HH   TYR  57           HH       TYR  57  -9.208 -17.911  -1.215
  472    H    SER  58           HN       SER  58 -16.543 -13.516   0.204
  473    HA   SER  58           HA       SER  58 -16.721 -16.484   0.499
  474    HB2  SER  58           HB2      SER  58 -18.350 -16.387   2.164
  475    HB3  SER  58           HB1      SER  58 -17.340 -15.019   2.621
  476    HG   SER  58           HG       SER  58 -18.988 -14.079   0.856
  477    H    ASP  59           HN       ASP  59 -19.228 -17.010   0.014
  478    HA   ASP  59           HA       ASP  59 -19.677 -16.377  -2.731
  479    HB2  ASP  59           HB2      ASP  59 -21.468 -17.481  -0.558
  480    HB3  ASP  59           HB1      ASP  59 -21.989 -17.334  -2.237
  481    H    THR  60           HN       THR  60 -21.271 -15.139   0.227
  482    HA   THR  60           HA       THR  60 -23.056 -13.360  -1.150
  483    HB   THR  60           HB       THR  60 -21.946 -12.985   1.641
  484    HG1  THR  60           HG1      THR  60 -23.096 -15.106   0.754
  485   HG21  THR  60          HG21      THR  60 -23.277 -11.121   0.853
  486   HG22  THR  60          HG22      THR  60 -24.236 -12.042   2.011
  487   HG23  THR  60          HG23      THR  60 -24.540 -12.213   0.282
  488    H    LEU  61           HN       LEU  61 -19.873 -12.780   0.387
  489    HA   LEU  61           HA       LEU  61 -19.740  -9.985  -0.232
  490    HB2  LEU  61           HB2      LEU  61 -17.709 -12.121   0.386
  491    HB3  LEU  61           HB1      LEU  61 -17.156 -10.533  -0.141
  492    HG   LEU  61           HG       LEU  61 -18.363  -9.469   1.698
  493   HD11  LEU  61          HD11      LEU  61 -19.247 -12.302   2.293
  494   HD12  LEU  61          HD12      LEU  61 -20.273 -10.920   1.914
  495   HD13  LEU  61          HD13      LEU  61 -19.401 -10.976   3.444
  496   HD21  LEU  61          HD21      LEU  61 -16.941 -10.190   3.468
  497   HD22  LEU  61          HD22      LEU  61 -16.036 -10.518   1.993
  498   HD23  LEU  61          HD23      LEU  61 -16.857 -11.833   2.836
  499    H    HIS  62           HN       HIS  62 -18.671 -12.865  -1.979
  500    HA   HIS  62           HA       HIS  62 -17.429 -11.510  -4.166
  501    HB2  HIS  62           HB2      HIS  62 -17.133 -13.919  -3.647
  502    HB3  HIS  62           HB1      HIS  62 -18.810 -14.208  -4.106
  503    HD1  HIS  62           HD1      HIS  62 -19.429 -13.692  -6.657
  504    HD2  HIS  62           HD2      HIS  62 -15.354 -13.825  -5.791
  505    HE1  HIS  62           HE1      HIS  62 -18.232 -13.903  -8.878
  506    H    LYS  63           HN       LYS  63 -20.733 -12.738  -3.694
  507    HA   LYS  63           HA       LYS  63 -21.722 -11.958  -6.272
  508    HB2  LYS  63           HB2      LYS  63 -22.856 -13.582  -4.757
  509    HB3  LYS  63           HB1      LYS  63 -23.258 -12.248  -3.675
  510    HG2  LYS  63           HG2      LYS  63 -24.542 -11.156  -5.445
  511    HG3  LYS  63           HG1      LYS  63 -24.097 -12.428  -6.583
  512    HD2  LYS  63           HD2      LYS  63 -25.246 -14.094  -5.157
  513    HD3  LYS  63           HD1      LYS  63 -25.706 -12.810  -4.038
  514    HE2  LYS  63           HE2      LYS  63 -26.965 -11.686  -5.837
  515    HE3  LYS  63           HE1      LYS  63 -26.503 -12.962  -6.961
  516    HZ1  LYS  63           HZ1      LYS  63 -28.417 -13.882  -6.289
  517    HZ2  LYS  63           HZ2      LYS  63 -28.482 -12.985  -4.848
  518    HZ3  LYS  63           HZ3      LYS  63 -27.520 -14.383  -4.940
  519    H    SER  64           HN       SER  64 -21.711 -10.313  -3.116
  520    HA   SER  64           HA       SER  64 -23.116  -7.976  -4.122
  521    HB2  SER  64           HB2      SER  64 -21.487  -8.407  -1.601
  522    HB3  SER  64           HB1      SER  64 -22.445  -6.967  -1.935
  523    HG   SER  64           HG       SER  64 -24.160  -8.046  -1.392
  524    H    ASN  65           HN       ASN  65 -20.132  -9.127  -4.816
  525    HA   ASN  65           HA       ASN  65 -18.211  -8.185  -5.756
  526    HB2  ASN  65           HB2      ASN  65 -19.828  -5.626  -5.958
  527    HB3  ASN  65           HB1      ASN  65 -18.443  -6.100  -6.935
  528   HD21  ASN  65          HD21      ASN  65 -19.135  -8.813  -7.478
  529   HD22  ASN  65          HD22      ASN  65 -20.536  -8.835  -8.435
  530    H    ILE  66           HN       ILE  66 -18.521  -8.162  -2.906
  531    HA   ILE  66           HA       ILE  66 -17.066  -5.646  -2.151
  532    HB   ILE  66           HB       ILE  66 -18.590  -7.565  -0.366
  533   HG12  ILE  66          HG12      ILE  66 -20.163  -6.460  -1.845
  534   HG13  ILE  66          HG11      ILE  66 -20.272  -5.699  -0.261
  535   HG21  ILE  66          HG21      ILE  66 -16.773  -6.284   0.736
  536   HG22  ILE  66          HG22      ILE  66 -18.363  -5.779   1.304
  537   HG23  ILE  66          HG23      ILE  66 -17.485  -4.786   0.140
  538   HD11  ILE  66          HD11      ILE  66 -18.496  -4.022  -1.237
  539   HD12  ILE  66          HD12      ILE  66 -20.186  -3.845  -1.693
  540   HD13  ILE  66          HD13      ILE  66 -19.056  -4.626  -2.797
  541    H    TYR  67           HN       TYR  67 -15.001  -5.863  -1.532
  542    HA   TYR  67           HA       TYR  67 -14.015  -8.585  -0.745
  543    HB2  TYR  67           HB2      TYR  67 -12.644  -6.575  -2.534
  544    HB3  TYR  67           HB1      TYR  67 -11.921  -8.072  -1.949
  545    HD1  TYR  67           HD2      TYR  67 -14.584  -6.634  -4.080
  546    HD2  TYR  67           HD1      TYR  67 -12.573 -10.217  -2.833
  547    HE1  TYR  67           HE2      TYR  67 -15.672  -7.888  -5.923
  548    HE2  TYR  67           HE1      TYR  67 -13.662 -11.472  -4.673
  549    HH   TYR  67           HH       TYR  67 -15.628 -11.305  -6.100
  550    HA   PRO  68           HA       PRO  68 -12.739  -5.539   2.464
  551    HB2  PRO  68           HB2      PRO  68 -13.228  -7.044   4.652
  552    HB3  PRO  68           HB1      PRO  68 -14.518  -6.190   3.786
  553    HG2  PRO  68           HG2      PRO  68 -13.763  -9.073   3.689
  554    HG3  PRO  68           HG1      PRO  68 -15.372  -8.328   3.672
  555    HD2  PRO  68           HD2      PRO  68 -14.046  -9.241   1.407
  556    HD3  PRO  68           HD1      PRO  68 -15.344  -8.031   1.381
  557    H    PHE  69           HN       PHE  69 -10.760  -5.375   3.564
  558    HA   PHE  69           HA       PHE  69  -9.089  -7.826   3.792
  559    HB2  PHE  69           HB2      PHE  69  -7.194  -6.732   2.689
  560    HB3  PHE  69           HB1      PHE  69  -8.558  -6.857   1.583
  561    HD1  PHE  69           HD1      PHE  69  -6.557  -4.552   3.677
  562    HD2  PHE  69           HD2      PHE  69  -9.789  -4.894   0.865
  563    HE1  PHE  69           HE1      PHE  69  -6.518  -2.095   3.328
  564    HE2  PHE  69           HE2      PHE  69  -9.749  -2.439   0.519
  565    HZ   PHE  69           HZ       PHE  69  -8.111  -1.040   1.748
  566    H    ILE  70           HN       ILE  70  -7.469  -7.680   5.314
  567    HA   ILE  70           HA       ILE  70  -7.406  -5.208   7.006
  568    HB   ILE  70           HB       ILE  70  -7.336  -8.105   7.913
  569   HG12  ILE  70          HG12      ILE  70  -9.272  -5.879   8.605
  570   HG13  ILE  70          HG11      ILE  70  -9.577  -7.067   7.339
  571   HG21  ILE  70          HG21      ILE  70  -7.242  -7.039  10.203
  572   HG22  ILE  70          HG22      ILE  70  -6.931  -5.499   9.408
  573   HG23  ILE  70          HG23      ILE  70  -5.779  -6.815   9.250
  574   HD11  ILE  70          HD11      ILE  70 -10.600  -7.643   9.576
  575   HD12  ILE  70          HD12      ILE  70  -8.963  -7.809  10.211
  576   HD13  ILE  70          HD13      ILE  70  -9.526  -8.881   8.928
  577    H    LEU  71           HN       LEU  71  -5.367  -4.457   7.351
  578    HA   LEU  71           HA       LEU  71  -3.128  -6.061   6.215
  579    HB2  LEU  71           HB2      LEU  71  -3.457  -3.131   6.855
  580    HB3  LEU  71           HB1      LEU  71  -1.934  -3.838   6.322
  581    HG   LEU  71           HG       LEU  71  -4.549  -4.069   4.807
  582   HD11  LEU  71          HD11      LEU  71  -2.285  -2.098   4.602
  583   HD12  LEU  71          HD12      LEU  71  -4.017  -1.791   4.654
  584   HD13  LEU  71          HD13      LEU  71  -3.290  -2.473   3.202
  585   HD21  LEU  71          HD21      LEU  71  -1.788  -5.150   4.404
  586   HD22  LEU  71          HD22      LEU  71  -2.588  -4.518   2.972
  587   HD23  LEU  71          HD23      LEU  71  -3.353  -5.796   3.901
  588    H    TYR  72           HN       TYR  72  -1.550  -6.843   7.411
  589    HA   TYR  72           HA       TYR  72  -1.312  -5.987  10.270
  590    HB2  TYR  72           HB2      TYR  72  -1.275  -8.758   9.054
  591    HB3  TYR  72           HB1      TYR  72  -0.583  -8.422  10.642
  592    HD1  TYR  72           HD1      TYR  72  -2.137  -6.968  12.230
  593    HD2  TYR  72           HD2      TYR  72  -3.535  -9.390   8.971
  594    HE1  TYR  72           HE1      TYR  72  -4.384  -7.060  13.266
  595    HE2  TYR  72           HE2      TYR  72  -5.787  -9.484  10.008
  596    HH   TYR  72           HH       TYR  72  -7.134  -8.235  11.579
  597    H    TYR  73           HN       TYR  73   0.765  -5.797  11.030
  598    HA   TYR  73           HA       TYR  73   3.007  -6.463   9.169
  599    HB2  TYR  73           HB2      TYR  73   2.418  -4.045   8.931
  600    HB3  TYR  73           HB1      TYR  73   2.709  -3.839  10.660
  601    HD1  TYR  73           HD1      TYR  73   4.287  -4.745   7.427
  602    HD2  TYR  73           HD2      TYR  73   4.928  -3.733  11.551
  603    HE1  TYR  73           HE1      TYR  73   6.714  -4.497   6.987
  604    HE2  TYR  73           HE2      TYR  73   7.355  -3.483  11.111
  605    HH   TYR  73           HH       TYR  73   8.907  -4.707   8.608
  606    H    GLN  74           HN       GLN  74   4.088  -7.946  10.333
  607    HA   GLN  74           HA       GLN  74   5.147  -9.002  12.133
  608    HB2  GLN  74           HB2      GLN  74   5.404  -6.115  13.032
  609    HB3  GLN  74           HB1      GLN  74   6.224  -7.472  13.801
  610    HG2  GLN  74           HG2      GLN  74   7.365  -8.009  11.706
  611    HG3  GLN  74           HG1      GLN  74   6.507  -6.704  10.885
  612   HE21  GLN  74          HE21      GLN  74   9.492  -7.074  11.505
  613   HE22  GLN  74          HE22      GLN  74   9.934  -5.636  12.290
  614    H    LYS  75           HN       LYS  75   3.782  -6.330  14.010
  615    HA   LYS  75           HA       LYS  75   1.621  -8.025  15.050
  616    HB2  LYS  75           HB2      LYS  75   3.737  -8.618  16.354
  617    HB3  LYS  75           HB1      LYS  75   3.707  -6.965  16.970
  618    HG2  LYS  75           HG2      LYS  75   1.530  -7.308  17.972
  619    HG3  LYS  75           HG1      LYS  75   1.380  -8.890  17.210
  620    HD2  LYS  75           HD2      LYS  75   2.048  -9.284  19.483
  621    HD3  LYS  75           HD1      LYS  75   3.459  -9.592  18.475
  622    HE2  LYS  75           HE2      LYS  75   4.479  -7.533  19.082
  623    HE3  LYS  75           HE1      LYS  75   2.975  -6.889  19.743
  624    HZ1  LYS  75           HZ1      LYS  75   3.101  -8.288  21.581
  625    HZ2  LYS  75           HZ2      LYS  75   4.704  -7.765  21.367
  626    HZ3  LYS  75           HZ3      LYS  75   4.237  -9.317  20.855
  627    H    GLN  76           HN       GLN  76   0.852  -5.985  13.769
  628    HA   GLN  76           HA       GLN  76  -0.233  -4.117  15.661
  629    HB2  GLN  76           HB2      GLN  76   2.068  -3.187  15.585
  630    HB3  GLN  76           HB1      GLN  76   1.929  -3.012  13.833
  631    HG2  GLN  76           HG2      GLN  76   0.101  -1.440  14.072
  632    HG3  GLN  76           HG1      GLN  76   0.033  -1.718  15.814
  633   HE21  GLN  76          HE21      GLN  76   0.456   0.909  14.832
  634   HE22  GLN  76          HE22      GLN  76   2.045   1.385  15.194
  635    H    LEU  77           HN       LEU  77  -1.921  -2.943  14.729
  636    HA   LEU  77           HA       LEU  77  -2.803  -3.853  12.103
  637    HB2  LEU  77           HB2      LEU  77  -4.422  -3.516  13.927
  638    HB3  LEU  77           HB1      LEU  77  -3.997  -1.808  14.005
  639    HG   LEU  77           HG       LEU  77  -4.800  -1.493  11.690
  640   HD11  LEU  77          HD11      LEU  77  -5.126  -4.478  11.853
  641   HD12  LEU  77          HD12      LEU  77  -4.506  -3.491  10.532
  642   HD13  LEU  77          HD13      LEU  77  -6.237  -3.554  10.843
  643   HD21  LEU  77          HD21      LEU  77  -7.150  -1.644  12.166
  644   HD22  LEU  77          HD22      LEU  77  -6.344  -1.335  13.703
  645   HD23  LEU  77          HD23      LEU  77  -6.899  -2.960  13.309
  646    H    ILE  78           HN       ILE  78  -2.638  -2.754  10.190
  647    HA   ILE  78           HA       ILE  78  -1.268  -0.094  10.240
  648    HB   ILE  78           HB       ILE  78  -1.694  -2.049   7.964
  649   HG12  ILE  78          HG12      ILE  78  -0.266  -3.027   9.680
  650   HG13  ILE  78          HG11      ILE  78   0.719  -2.566   8.297
  651   HG21  ILE  78          HG21      ILE  78  -1.353   0.116   7.038
  652   HG22  ILE  78          HG22      ILE  78   0.222  -0.676   6.979
  653   HG23  ILE  78          HG23      ILE  78  -0.119   0.515   8.235
  654   HD11  ILE  78          HD11      ILE  78   1.011  -0.302   9.666
  655   HD12  ILE  78          HD12      ILE  78   1.997  -1.706  10.040
  656   HD13  ILE  78          HD13      ILE  78   0.587  -1.334  11.029
  657    H    ALA  79           HN       ALA  79  -3.924  -1.769   8.468
  658    HA   ALA  79           HA       ALA  79  -5.627   0.558   8.751
  659    HB1  ALA  79           HB1      ALA  79  -4.819  -0.012   5.904
  660    HB2  ALA  79           HB2      ALA  79  -3.928   1.149   6.885
  661    HB3  ALA  79           HB3      ALA  79  -5.641   1.405   6.558
  662    H    ILE  80           HN       ILE  80  -7.750   0.222   7.790
  663    HA   ILE  80           HA       ILE  80  -8.284  -2.569   6.856
  664    HB   ILE  80           HB       ILE  80  -9.845  -1.054   8.966
  665   HG12  ILE  80          HG12      ILE  80  -8.359  -3.687   9.137
  666   HG13  ILE  80          HG11      ILE  80  -7.675  -2.150   9.661
  667   HG21  ILE  80          HG21      ILE  80 -10.326  -3.658   7.501
  668   HG22  ILE  80          HG22      ILE  80 -11.407  -2.269   7.622
  669   HG23  ILE  80          HG23      ILE  80 -11.105  -3.279   9.035
  670   HD11  ILE  80          HD11      ILE  80 -10.263  -3.328  10.718
  671   HD12  ILE  80          HD12      ILE  80  -9.465  -1.864  11.295
  672   HD13  ILE  80          HD13      ILE  80  -8.705  -3.438  11.542
  673    H    GLY  81           HN       GLY  81  -9.754  -2.663   5.177
  674    HA2  GLY  81           HA2      GLY  81 -11.707  -0.572   4.717
  675    HA3  GLY  81           HA1      GLY  81 -10.335  -0.415   3.619
  676    H    PHE  82           HN       PHE  82 -12.481  -0.866   2.221
  677    HA   PHE  82           HA       PHE  82 -12.195  -3.661   1.334
  678    HB2  PHE  82           HB2      PHE  82 -14.579  -4.169   1.451
  679    HB3  PHE  82           HB1      PHE  82 -14.021  -3.711   3.058
  680    HD1  PHE  82           HD1      PHE  82 -14.615  -1.549   4.043
  681    HD2  PHE  82           HD2      PHE  82 -16.044  -2.710   0.162
  682    HE1  PHE  82           HE1      PHE  82 -16.309   0.261   4.125
  683    HE2  PHE  82           HE2      PHE  82 -17.737  -0.898   0.243
  684    HZ   PHE  82           HZ       PHE  82 -17.871   0.585   2.226
  685    H    ILE  83           HN       ILE  83 -13.337  -4.029  -0.755
  686    HA   ILE  83           HA       ILE  83 -13.339  -1.504  -2.364
  687    HB   ILE  83           HB       ILE  83 -13.052  -4.389  -3.241
  688   HG12  ILE  83          HG12      ILE  83 -10.966  -2.196  -3.106
  689   HG13  ILE  83          HG11      ILE  83 -11.162  -3.425  -1.857
  690   HG21  ILE  83          HG21      ILE  83 -12.293  -3.292  -5.374
  691   HG22  ILE  83          HG22      ILE  83 -12.825  -1.747  -4.709
  692   HG23  ILE  83          HG23      ILE  83 -13.999  -3.029  -5.009
  693   HD11  ILE  83          HD11      ILE  83 -10.697  -5.195  -3.457
  694   HD12  ILE  83          HD12      ILE  83  -9.399  -4.004  -3.537
  695   HD13  ILE  83          HD13      ILE  83 -10.648  -4.032  -4.782
  696    H    ASP  84           HN       ASP  84 -15.240  -0.784  -3.109
  697    HA   ASP  84           HA       ASP  84 -17.670  -2.411  -2.768
  698    HB2  ASP  84           HB2      ASP  84 -17.556   0.012  -2.137
  699    HB3  ASP  84           HB1      ASP  84 -17.368   0.404  -3.847
  700    H    GLU  85           HN       GLU  85 -19.353  -2.027  -4.646
  701    HA   GLU  85           HA       GLU  85 -18.455  -3.447  -6.962
  702    HB2  GLU  85           HB2      GLU  85 -20.834  -3.344  -6.181
  703    HB3  GLU  85           HB1      GLU  85 -20.891  -1.655  -6.688
  704    HG2  GLU  85           HG2      GLU  85 -20.383  -2.312  -9.003
  705    HG3  GLU  85           HG1      GLU  85 -20.293  -4.002  -8.511
  706    H    ASN  86           HN       ASN  86 -18.850  -0.004  -6.265
  707    HA   ASN  86           HA       ASN  86 -17.996   0.710  -9.020
  708    HB2  ASN  86           HB2      ASN  86 -19.003   2.345  -6.676
  709    HB3  ASN  86           HB1      ASN  86 -18.455   3.058  -8.193
  710   HD21  ASN  86          HD21      ASN  86 -21.243   3.057  -7.077
  711   HD22  ASN  86          HD22      ASN  86 -22.206   2.296  -8.251
  712    H    HIS  87           HN       HIS  87 -16.090  -0.604  -7.321
  713    HA   HIS  87           HA       HIS  87 -13.878  -0.403  -6.592
  714    HB2  HIS  87           HB2      HIS  87 -14.025   2.022  -8.408
  715    HB3  HIS  87           HB1      HIS  87 -12.536   1.344  -7.756
  716    HD1  HIS  87           HD1      HIS  87 -12.070  -1.237  -8.427
  717    HD2  HIS  87           HD2      HIS  87 -14.905   0.780 -10.721
  718    HE1  HIS  87           HE1      HIS  87 -12.360  -2.583 -10.551
  719    H    ASP  88           HN       ASP  88 -13.002   2.705  -6.714
  720    HA   ASP  88           HA       ASP  88 -12.434   4.182  -4.986
  721    HB2  ASP  88           HB2      ASP  88 -15.429   3.855  -4.712
  722    HB3  ASP  88           HB1      ASP  88 -14.513   5.037  -3.774
  723    H    MET  89           HN       MET  89 -11.099   2.936  -3.686
  724    HA   MET  89           HA       MET  89 -11.954   0.943  -1.855
  725    HB2  MET  89           HB2      MET  89  -9.537   2.764  -1.858
  726    HB3  MET  89           HB1      MET  89  -9.751   1.444  -0.707
  727    HG2  MET  89           HG2      MET  89  -9.978  -0.140  -2.614
  728    HG3  MET  89           HG1      MET  89  -9.684   1.191  -3.730
  729    HE1  MET  89           HE1      MET  89  -6.929  -0.558  -0.574
  730    HE2  MET  89           HE2      MET  89  -7.678  -1.668  -1.718
  731    HE3  MET  89           HE3      MET  89  -8.690  -0.630  -0.720
  732    H    ASP  90           HN       ASP  90 -12.877   1.074   0.132
  733    HA   ASP  90           HA       ASP  90 -13.396   3.792   1.254
  734    HB2  ASP  90           HB2      ASP  90 -14.702   1.098   1.693
  735    HB3  ASP  90           HB1      ASP  90 -15.091   2.530   2.648
  736    H    PHE  91           HN       PHE  91 -12.425   4.402   3.111
  737    HA   PHE  91           HA       PHE  91 -10.723   2.405   4.526
  738    HB2  PHE  91           HB2      PHE  91 -10.757   5.427   4.408
  739    HB3  PHE  91           HB1      PHE  91  -9.819   4.550   5.621
  740    HD1  PHE  91           HD1      PHE  91  -8.039   2.958   4.916
  741    HD2  PHE  91           HD2      PHE  91 -10.073   5.485   2.103
  742    HE1  PHE  91           HE1      PHE  91  -6.263   2.520   3.243
  743    HE2  PHE  91           HE2      PHE  91  -8.295   5.051   0.428
  744    HZ   PHE  91           HZ       PHE  91  -6.390   3.568   0.999
  745    H    LEU  92           HN       LEU  92 -11.400   1.608   6.400
  746    HA   LEU  92           HA       LEU  92 -13.634   2.972   7.843
  747    HB2  LEU  92           HB2      LEU  92 -14.084   0.645   7.182
  748    HB3  LEU  92           HB1      LEU  92 -12.595   0.119   7.966
  749    HG   LEU  92           HG       LEU  92 -13.450   0.806  10.145
  750   HD11  LEU  92          HD11      LEU  92 -15.678   1.947   8.475
  751   HD12  LEU  92          HD12      LEU  92 -14.810   2.675   9.827
  752   HD13  LEU  92          HD13      LEU  92 -16.015   1.428  10.125
  753   HD21  LEU  92          HD21      LEU  92 -14.014  -1.441   9.609
  754   HD22  LEU  92          HD22      LEU  92 -15.266  -0.938   8.473
  755   HD23  LEU  92          HD23      LEU  92 -15.512  -0.727  10.207
  756    H    TYR  93           HN       TYR  93 -10.348   1.774   8.115
  757    HA   TYR  93           HA       TYR  93 -10.000   3.373  10.554
  758    HB2  TYR  93           HB2      TYR  93 -10.826   1.024  11.242
  759    HB3  TYR  93           HB1      TYR  93  -9.266   0.438  10.667
  760    HD1  TYR  93           HD2      TYR  93 -10.871   2.844  13.010
  761    HD2  TYR  93           HD1      TYR  93  -7.301   0.687  11.991
  762    HE1  TYR  93           HE2      TYR  93  -9.830   3.562  15.142
  763    HE2  TYR  93           HE1      TYR  93  -6.261   1.403  14.126
  764    HH   TYR  93           HH       TYR  93  -7.337   2.158  16.531
  765    H    LEU  94           HN       LEU  94  -8.189   4.457  10.093
  766    HA   LEU  94           HA       LEU  94  -6.033   3.080   8.534
  767    HB2  LEU  94           HB2      LEU  94  -7.027   5.101   7.470
  768    HB3  LEU  94           HB1      LEU  94  -6.559   6.047   8.881
  769    HG   LEU  94           HG       LEU  94  -4.184   5.473   8.472
  770   HD11  LEU  94          HD11      LEU  94  -4.073   3.435   7.361
  771   HD12  LEU  94          HD12      LEU  94  -3.818   4.535   6.013
  772   HD13  LEU  94          HD13      LEU  94  -5.409   3.824   6.277
  773   HD21  LEU  94          HD21      LEU  94  -3.921   6.830   6.408
  774   HD22  LEU  94          HD22      LEU  94  -5.107   7.531   7.509
  775   HD23  LEU  94          HD23      LEU  94  -5.644   6.645   6.082
  776    H    HIS  95           HN       HIS  95  -4.223   2.629   9.640
  777    HA   HIS  95           HA       HIS  95  -3.568   4.252  12.068
  778    HB2  HIS  95           HB2      HIS  95  -4.516   2.049  12.709
  779    HB3  HIS  95           HB1      HIS  95  -3.253   1.252  11.771
  780    HD1  HIS  95           HD1      HIS  95  -0.800   2.865  12.508
  781    HD2  HIS  95           HD2      HIS  95  -3.657   1.740  15.328
  782    HE1  HIS  95           HE1      HIS  95   0.358   2.936  14.759
  783    H    ASN  96           HN       ASN  96  -1.716   5.272  11.652
  784    HA   ASN  96           HA       ASN  96   0.195   4.156   9.701
  785    HB2  ASN  96           HB2      ASN  96  -0.523   6.640   9.874
  786    HB3  ASN  96           HB1      ASN  96   0.537   6.712  11.283
  787   HD21  ASN  96          HD21      ASN  96   2.216   7.996  10.325
  788   HD22  ASN  96          HD22      ASN  96   3.159   7.453   9.022
  789    H    THR  97           HN       THR  97   1.932   3.007  10.337
  790    HA   THR  97           HA       THR  97   2.451   1.920  12.789
  791    HB   THR  97           HB       THR  97   4.843   1.766  12.117
  792    HG1  THR  97           HG1      THR  97   3.952   3.697  10.265
  793   HG21  THR  97          HG21      THR  97   3.361   0.156  11.132
  794   HG22  THR  97          HG22      THR  97   4.393   0.749   9.833
  795   HG23  THR  97          HG23      THR  97   2.738   1.341   9.984
  796    H    VAL  98           HN       VAL  98   3.042   5.244  11.903
  797    HA   VAL  98           HA       VAL  98   4.610   5.769  14.363
  798    HB   VAL  98           HB       VAL  98   3.651   7.609  12.154
  799   HG11  VAL  98          HG11      VAL  98   5.383   8.055  14.591
  800   HG12  VAL  98          HG12      VAL  98   3.941   8.946  14.100
  801   HG13  VAL  98          HG13      VAL  98   5.441   9.122  13.189
  802   HG21  VAL  98          HG21      VAL  98   5.317   5.990  11.381
  803   HG22  VAL  98          HG22      VAL  98   6.365   6.385  12.745
  804   HG23  VAL  98          HG23      VAL  98   6.048   7.590  11.497
  805    H    MET  99           HN       MET  99   1.578   6.936  12.871
  806    HA   MET  99           HA       MET  99   0.201   6.872  15.389
  807    HB2  MET  99           HB2      MET  99  -0.116   9.271  15.731
  808    HB3  MET  99           HB1      MET  99   1.595   8.864  15.801
  809    HG2  MET  99           HG2      MET  99   1.573   9.437  13.242
  810    HG3  MET  99           HG1      MET  99   0.077  10.292  13.633
  811    HE1  MET  99           HE1      MET  99   0.628  12.507  13.122
  812    HE2  MET  99           HE2      MET  99   2.218  12.131  12.464
  813    HE3  MET  99           HE3      MET  99   2.041  13.443  13.626
  814    HA   PRO 100           HA       PRO 100  -2.932   6.490  12.110
  815    HB2  PRO 100           HB2      PRO 100  -4.760   7.250  14.367
  816    HB3  PRO 100           HB1      PRO 100  -4.898   5.909  13.209
  817    HG2  PRO 100           HG2      PRO 100  -4.097   5.509  15.731
  818    HG3  PRO 100           HG1      PRO 100  -3.434   4.572  14.379
  819    HD2  PRO 100           HD2      PRO 100  -2.138   6.739  15.969
  820    HD3  PRO 100           HD1      PRO 100  -1.409   5.361  15.104
  821    H    LEU 101           HN       LEU 101  -3.891   7.962  10.732
  822    HA   LEU 101           HA       LEU 101  -3.635  10.833  11.430
  823    HB2  LEU 101           HB2      LEU 101  -4.409   9.481   8.824
  824    HB3  LEU 101           HB1      LEU 101  -4.061  11.198   9.032
  825    HG   LEU 101           HG       LEU 101  -2.106   8.934   9.549
  826   HD11  LEU 101          HD11      LEU 101  -2.041  11.019   7.355
  827   HD12  LEU 101          HD12      LEU 101  -2.726   9.410   7.130
  828   HD13  LEU 101          HD13      LEU 101  -1.015   9.593   7.516
  829   HD21  LEU 101          HD21      LEU 101  -1.394  10.658  10.975
  830   HD22  LEU 101          HD22      LEU 101  -1.971  11.928   9.894
  831   HD23  LEU 101          HD23      LEU 101  -0.507  11.028   9.501
  832    H    LEU 102           HN       LEU 102  -5.975   8.421  11.551
  833    HA   LEU 102           HA       LEU 102  -8.029  10.240  12.345
  834    HB2  LEU 102           HB2      LEU 102  -9.628   9.908  10.498
  835    HB3  LEU 102           HB1      LEU 102  -8.182  10.740   9.951
  836    HG   LEU 102           HG       LEU 102  -7.475   8.093   9.530
  837   HD11  LEU 102          HD11      LEU 102  -9.281   6.847   8.675
  838   HD12  LEU 102          HD12      LEU 102 -10.326   8.263   8.553
  839   HD13  LEU 102          HD13      LEU 102  -9.951   7.580  10.131
  840   HD21  LEU 102          HD21      LEU 102  -7.191   9.967   7.948
  841   HD22  LEU 102          HD22      LEU 102  -8.918   9.930   7.590
  842   HD23  LEU 102          HD23      LEU 102  -7.895   8.563   7.145
  843    H    ASP 103           HN       ASP 103  -9.215   9.091  13.748
  844    HA   ASP 103           HA       ASP 103  -9.862   6.246  13.200
  845    HB2  ASP 103           HB2      ASP 103  -8.324   7.289  15.593
  846    HB3  ASP 103           HB1      ASP 103  -9.241   5.785  15.667
  847    H    GLN 104           HN       GLN 104 -12.053   6.753  13.049
  848    HA   GLN 104           HA       GLN 104 -13.298   8.220  15.339
  849    HB2  GLN 104           HB2      GLN 104 -14.214   7.676  12.505
  850    HB3  GLN 104           HB1      GLN 104 -15.276   8.352  13.744
  851    HG2  GLN 104           HG2      GLN 104 -13.749  10.234  14.076
  852    HG3  GLN 104           HG1      GLN 104 -12.611   9.544  12.918
  853   HE21  GLN 104          HE21      GLN 104 -14.220  12.142  12.831
  854   HE22  GLN 104          HE22      GLN 104 -15.043  12.080  11.345
  855    H    ARG 105           HN       ARG 105 -14.143   6.954  16.854
  856    HA   ARG 105           HA       ARG 105 -14.653   4.143  16.542
  857    HB2  ARG 105           HB2      ARG 105 -15.512   6.168  18.625
  858    HB3  ARG 105           HB1      ARG 105 -15.825   4.443  18.775
  859    HG2  ARG 105           HG2      ARG 105 -13.013   5.408  18.251
  860    HG3  ARG 105           HG1      ARG 105 -13.671   5.485  19.883
  861    HD2  ARG 105           HD2      ARG 105 -13.502   2.980  18.173
  862    HD3  ARG 105           HD1      ARG 105 -12.462   3.369  19.539
  863    HE   ARG 105           HE       ARG 105 -15.075   3.507  20.532
  864   HH11  ARG 105          HH21      ARG 105 -13.037   1.200  18.975
  865   HH12  ARG 105          HH22      ARG 105 -13.754  -0.163  19.770
  866   HH21  ARG 105          HH11      ARG 105 -16.018   1.744  21.571
  867   HH22  ARG 105          HH12      ARG 105 -15.441   0.145  21.239
  868    H    TYR 106           HN       TYR 106 -16.717   7.018  16.352
  869    HA   TYR 106           HA       TYR 106 -19.235   5.717  16.382
  870    HB2  TYR 106           HB2      TYR 106 -18.465   8.162  14.759
  871    HB3  TYR 106           HB1      TYR 106 -20.095   7.703  15.250
  872    HD1  TYR 106           HD1      TYR 106 -20.742   7.768  17.674
  873    HD2  TYR 106           HD2      TYR 106 -16.942   9.226  16.290
  874    HE1  TYR 106           HE1      TYR 106 -20.426   8.982  19.814
  875    HE2  TYR 106           HE2      TYR 106 -16.627  10.437  18.430
  876    HH   TYR 106           HH       TYR 106 -17.840   9.893  21.049
  877    H    LEU 107           HN       LEU 107 -17.069   6.422  13.615
  878    HA   LEU 107           HA       LEU 107 -18.816   5.271  11.643
  879    HB2  LEU 107           HB2      LEU 107 -16.920   6.780  11.066
  880    HB3  LEU 107           HB1      LEU 107 -15.793   5.521  11.560
  881    HG   LEU 107           HG       LEU 107 -16.730   4.009   9.826
  882   HD11  LEU 107          HD11      LEU 107 -18.148   5.335   8.029
  883   HD12  LEU 107          HD12      LEU 107 -18.567   6.353   9.407
  884   HD13  LEU 107          HD13      LEU 107 -18.944   4.630   9.433
  885   HD21  LEU 107          HD21      LEU 107 -14.785   5.367   9.249
  886   HD22  LEU 107          HD22      LEU 107 -15.821   6.734   8.841
  887   HD23  LEU 107          HD23      LEU 107 -15.856   5.276   7.850
  888    H    LEU 108           HN       LEU 108 -16.277   3.920  13.713
  889    HA   LEU 108           HA       LEU 108 -16.065   1.391  12.424
  890    HB2  LEU 108           HB2      LEU 108 -14.750   2.492  14.477
  891    HB3  LEU 108           HB1      LEU 108 -15.904   1.566  15.426
  892    HG   LEU 108           HG       LEU 108 -13.924   0.208  15.097
  893   HD11  LEU 108          HD11      LEU 108 -16.295  -0.781  14.856
  894   HD12  LEU 108          HD12      LEU 108 -14.949  -1.757  14.281
  895   HD13  LEU 108          HD13      LEU 108 -15.938  -0.872  13.129
  896   HD21  LEU 108          HD21      LEU 108 -12.729   0.092  13.151
  897   HD22  LEU 108          HD22      LEU 108 -13.619   1.536  12.686
  898   HD23  LEU 108          HD23      LEU 108 -14.171  -0.048  12.151
  899    H    THR 109           HN       THR 109 -18.173   2.425  15.102
  900    HA   THR 109           HA       THR 109 -19.729  -0.103  14.813
  901    HB   THR 109           HB       THR 109 -19.436   0.145  17.091
  902    HG1  THR 109           HG1      THR 109 -21.686   0.400  16.619
  903   HG21  THR 109          HG21      THR 109 -19.292   3.100  16.510
  904   HG22  THR 109          HG22      THR 109 -18.025   2.045  17.139
  905   HG23  THR 109          HG23      THR 109 -19.397   2.483  18.159
  906    H    GLY 110           HN       GLY 110 -19.678   2.792  13.376
  907    HA2  GLY 110           HA2      GLY 110 -21.290   4.238  12.439
  908    HA3  GLY 110           HA1      GLY 110 -22.055   2.709  12.013
  909    H    GLY 111           HN       GLY 111 -21.894   5.195  14.545
  910    HA2  GLY 111           HA2      GLY 111 -24.077   4.178  16.108
  911    HA3  GLY 111           HA1      GLY 111 -23.470   5.832  16.160
  912    H    GLN 112           HN       GLN 112 -26.230   4.285  15.750
  913    HA   GLN 112           HA       GLN 112 -27.206   5.744  13.358
  914    HB2  GLN 112           HB2      GLN 112 -29.265   4.437  13.687
  915    HB3  GLN 112           HB1      GLN 112 -27.851   3.385  13.642
  916    HG2  GLN 112           HG2      GLN 112 -27.810   3.393  16.140
  917    HG3  GLN 112           HG1      GLN 112 -29.301   4.338  16.130
  918   HE21  GLN 112          HE21      GLN 112 -30.500   2.547  17.161
  919   HE22  GLN 112          HE22      GLN 112 -30.916   1.161  16.273
  920    H    LEU 113           HN       LEU 113 -29.863   6.148  14.137
  921    HA   LEU 113           HA       LEU 113 -29.552   8.602  15.673
  922    HB2  LEU 113           HB2      LEU 113 -31.086   8.497  13.751
  923    HB3  LEU 113           HB1      LEU 113 -32.048   7.276  14.579
  924    HG   LEU 113           HG       LEU 113 -32.554   8.885  16.385
  925   HD11  LEU 113          HD11      LEU 113 -30.625  10.589  14.829
  926   HD12  LEU 113          HD12      LEU 113 -30.770  10.370  16.573
  927   HD13  LEU 113          HD13      LEU 113 -31.934  11.374  15.714
  928   HD21  LEU 113          HD21      LEU 113 -33.925   8.735  14.236
  929   HD22  LEU 113          HD22      LEU 113 -33.093  10.199  13.713
  930   HD23  LEU 113          HD23      LEU 113 -34.104  10.228  15.157
  931    H    GLU 114           HN       GLU 114 -29.971   8.905  17.783
  932    HA   GLU 114           HA       GLU 114 -30.374   6.706  19.561
  933    HB2  GLU 114           HB2      GLU 114 -30.656   9.698  19.948
  934    HB3  GLU 114           HB1      GLU 114 -30.727   8.528  21.270
  935    HG2  GLU 114           HG2      GLU 114 -28.478   7.710  20.676
  936    HG3  GLU 114           HG1      GLU 114 -28.405   8.869  19.348
  937    H    HIS 115           HN       HIS 115 -32.212   5.827  20.385
  938    HA   HIS 115           HA       HIS 115 -34.814   6.772  19.329
  939    HB2  HIS 115           HB2      HIS 115 -35.672   4.643  20.128
  940    HB3  HIS 115           HB1      HIS 115 -34.162   4.343  19.269
  941    HD1  HIS 115           HD1      HIS 115 -32.015   3.870  20.766
  942    HD2  HIS 115           HD2      HIS 115 -35.625   3.957  22.852
  943    HE1  HIS 115           HE1      HIS 115 -31.565   2.811  23.024
  944    H    HIS 116           HN       HIS 116 -33.023   7.893  21.649
  945    HA   HIS 116           HA       HIS 116 -34.428   7.615  24.096
  946    HB2  HIS 116           HB2      HIS 116 -33.277   9.658  24.782
  947    HB3  HIS 116           HB1      HIS 116 -32.172   8.637  23.864
  948    HD1  HIS 116           HD1      HIS 116 -31.587  11.630  23.958
  949    HD2  HIS 116           HD2      HIS 116 -33.950   9.884  21.000
  950    HE1  HIS 116           HE1      HIS 116 -31.535  13.206  21.976
  951    H    HIS 117           HN       HIS 117 -34.981  10.340  24.783
  952    HA   HIS 117           HA       HIS 117 -37.733  10.527  24.085
  953    HB2  HIS 117           HB2      HIS 117 -35.803  12.613  25.139
  954    HB3  HIS 117           HB1      HIS 117 -37.551  12.837  25.053
  955    HD1  HIS 117           HD1      HIS 117 -39.017  11.111  26.484
  956    HD2  HIS 117           HD2      HIS 117 -34.936  11.111  27.331
  957    HE1  HIS 117           HE1      HIS 117 -38.743   9.878  28.678
  958    H    HIS 118           HN       HIS 118 -34.869  12.173  22.766
  959    HA   HIS 118           HA       HIS 118 -34.589  13.401  20.788
  960    HB2  HIS 118           HB2      HIS 118 -35.495  11.219  19.852
  961    HB3  HIS 118           HB1      HIS 118 -37.089  11.972  19.843
  962    HD1  HIS 118           HD1      HIS 118 -33.591  12.792  18.549
  963    HD2  HIS 118           HD2      HIS 118 -37.587  13.340  17.504
  964    HE1  HIS 118           HE1      HIS 118 -33.590  13.956  16.300
  965    H    HIS 119           HN       HIS 119 -38.141  13.149  20.726
  966    HA   HIS 119           HA       HIS 119 -38.435  15.964  20.177
  967    HB2  HIS 119           HB2      HIS 119 -40.434  13.845  20.994
  968    HB3  HIS 119           HB1      HIS 119 -40.872  15.478  20.491
  969    HD1  HIS 119           HD1      HIS 119 -39.825  16.170  18.033
  970    HD2  HIS 119           HD2      HIS 119 -40.183  12.101  18.859
  971    HE1  HIS 119           HE1      HIS 119 -39.686  14.974  15.807
  972    H    HIS 120           HN       HIS 120 -38.981  17.632  21.544
  973    HA   HIS 120           HA       HIS 120 -39.925  17.271  24.238
  974    HB2  HIS 120           HB2      HIS 120 -37.911  18.002  25.440
  975    HB3  HIS 120           HB1      HIS 120 -37.577  16.517  24.553
  976    HD1  HIS 120           HD1      HIS 120 -36.342  16.869  22.160
  977    HD2  HIS 120           HD2      HIS 120 -36.255  20.126  24.761
  978    HE1  HIS 120           HE1      HIS 120 -34.510  18.405  21.324
  Start of MODEL   19
    1    H1   MET   1           HT1      MET   1 -10.934  -8.414  22.282
    2    H2   MET   1           HT2      MET   1 -12.316  -7.777  23.039
    3    H3   MET   1           HT3      MET   1 -10.770  -7.221  23.477
    4    HA   MET   1           HA       MET   1 -12.480  -6.251  21.469
    5    HB2  MET   1           HB2      MET   1  -9.707  -5.539  22.466
    6    HB3  MET   1           HB1      MET   1 -10.612  -4.545  21.321
    7    HG2  MET   1           HG2      MET   1 -12.426  -4.270  22.930
    8    HG3  MET   1           HG1      MET   1 -11.630  -5.365  24.057
    9    HE1  MET   1           HE1      MET   1 -10.590  -1.125  22.845
   10    HE2  MET   1           HE2      MET   1 -11.513  -2.347  21.976
   11    HE3  MET   1           HE3      MET   1  -9.754  -2.353  21.887
   12    H    THR   2           HN       THR   2 -12.481  -8.010  19.871
   13    HA   THR   2           HA       THR   2  -9.943  -8.376  18.357
   14    HB   THR   2           HB       THR   2 -11.248 -10.163  17.179
   15    HG1  THR   2           HG1      THR   2 -13.188  -9.656  19.172
   16   HG21  THR   2          HG21      THR   2 -11.077 -10.219  20.199
   17   HG22  THR   2          HG22      THR   2  -9.887 -10.823  19.046
   18   HG23  THR   2          HG23      THR   2 -11.437 -11.645  19.225
   19    H    LEU   3           HN       LEU   3  -9.600  -7.102  16.640
   20    HA   LEU   3           HA       LEU   3 -11.556  -5.332  15.521
   21    HB2  LEU   3           HB2      LEU   3  -9.849  -4.914  13.782
   22    HB3  LEU   3           HB1      LEU   3  -9.144  -4.894  15.395
   23    HG   LEU   3           HG       LEU   3  -8.866  -7.568  14.749
   24   HD11  LEU   3          HD11      LEU   3  -8.187  -7.837  12.492
   25   HD12  LEU   3          HD12      LEU   3  -8.173  -6.102  12.198
   26   HD13  LEU   3          HD13      LEU   3  -9.703  -6.948  12.396
   27   HD21  LEU   3          HD21      LEU   3  -6.902  -5.352  14.077
   28   HD22  LEU   3          HD22      LEU   3  -6.500  -7.053  14.312
   29   HD23  LEU   3          HD23      LEU   3  -7.104  -6.096  15.664
   30    H    GLU   4           HN       GLU   4 -10.375  -8.533  14.574
   31    HA   GLU   4           HA       GLU   4 -11.476  -8.780  12.012
   32    HB2  GLU   4           HB2      GLU   4 -11.272 -10.824  14.243
   33    HB3  GLU   4           HB1      GLU   4 -11.687 -11.234  12.579
   34    HG2  GLU   4           HG2      GLU   4  -9.555 -10.326  11.790
   35    HG3  GLU   4           HG1      GLU   4  -9.144  -9.813  13.427
   36    H    LEU   5           HN       LEU   5 -13.077  -9.498  15.126
   37    HA   LEU   5           HA       LEU   5 -15.624 -10.141  13.979
   38    HB2  LEU   5           HB2      LEU   5 -14.678  -9.289  16.713
   39    HB3  LEU   5           HB1      LEU   5 -16.406  -9.430  16.386
   40    HG   LEU   5           HG       LEU   5 -16.080 -11.769  15.660
   41   HD11  LEU   5          HD11      LEU   5 -13.863 -11.781  14.796
   42   HD12  LEU   5          HD12      LEU   5 -13.791 -12.780  16.248
   43   HD13  LEU   5          HD13      LEU   5 -13.196 -11.121  16.288
   44   HD21  LEU   5          HD21      LEU   5 -15.296 -12.656  17.934
   45   HD22  LEU   5          HD22      LEU   5 -16.638 -11.512  17.972
   46   HD23  LEU   5          HD23      LEU   5 -15.009 -10.974  18.377
   47    H    GLN   6           HN       GLN   6 -14.221  -7.093  15.160
   48    HA   GLN   6           HA       GLN   6 -16.571  -5.492  14.899
   49    HB2  GLN   6           HB2      GLN   6 -13.643  -4.755  14.627
   50    HB3  GLN   6           HB1      GLN   6 -14.955  -3.586  14.758
   51    HG2  GLN   6           HG2      GLN   6 -14.388  -5.731  16.824
   52    HG3  GLN   6           HG1      GLN   6 -13.817  -4.066  16.944
   53   HE21  GLN   6          HE21      GLN   6 -15.343  -2.429  17.535
   54   HE22  GLN   6          HE22      GLN   6 -16.950  -2.778  17.958
   55    H    LEU   7           HN       LEU   7 -13.936  -6.186  12.585
   56    HA   LEU   7           HA       LEU   7 -14.926  -4.501  10.504
   57    HB2  LEU   7           HB2      LEU   7 -12.652  -5.386  10.435
   58    HB3  LEU   7           HB1      LEU   7 -13.264  -7.036  10.357
   59    HG   LEU   7           HG       LEU   7 -14.270  -6.608   8.168
   60   HD11  LEU   7          HD11      LEU   7 -14.989  -4.373   8.185
   61   HD12  LEU   7          HD12      LEU   7 -13.601  -4.307   7.104
   62   HD13  LEU   7          HD13      LEU   7 -13.441  -3.778   8.778
   63   HD21  LEU   7          HD21      LEU   7 -11.397  -5.699   8.452
   64   HD22  LEU   7          HD22      LEU   7 -12.156  -6.018   6.894
   65   HD23  LEU   7          HD23      LEU   7 -11.976  -7.321   8.069
   66    H    LYS   8           HN       LYS   8 -15.452  -7.958  11.174
   67    HA   LYS   8           HA       LYS   8 -17.103  -8.456   8.890
   68    HB2  LYS   8           HB2      LYS   8 -16.956  -9.807  11.600
   69    HB3  LYS   8           HB1      LYS   8 -17.901 -10.430  10.246
   70    HG2  LYS   8           HG2      LYS   8 -15.860 -10.570   8.870
   71    HG3  LYS   8           HG1      LYS   8 -14.908  -9.922  10.206
   72    HD2  LYS   8           HD2      LYS   8 -15.526 -11.858  11.601
   73    HD3  LYS   8           HD1      LYS   8 -16.497 -12.506  10.279
   74    HE2  LYS   8           HE2      LYS   8 -14.483 -12.656   8.864
   75    HE3  LYS   8           HE1      LYS   8 -13.508 -11.999  10.178
   76    HZ1  LYS   8           HZ1      LYS   8 -13.711 -13.903  11.408
   77    HZ2  LYS   8           HZ2      LYS   8 -13.702 -14.555   9.839
   78    HZ3  LYS   8           HZ3      LYS   8 -15.168 -14.369  10.676
   79    H    HIS   9           HN       HIS   9 -17.842  -7.444  12.205
   80    HA   HIS   9           HA       HIS   9 -20.698  -7.491  11.925
   81    HB2  HIS   9           HB2      HIS   9 -19.498  -7.419  14.105
   82    HB3  HIS   9           HB1      HIS   9 -18.992  -5.768  13.748
   83    HD1  HIS   9           HD1      HIS   9 -22.239  -7.758  14.021
   84    HD2  HIS   9           HD2      HIS   9 -20.825  -3.877  14.584
   85    HE1  HIS   9           HE1      HIS   9 -24.175  -6.418  14.951
   86    H    TYR  10           HN       TYR  10 -18.269  -4.931  11.454
   87    HA   TYR  10           HA       TYR  10 -20.078  -2.794  10.972
   88    HB2  TYR  10           HB2      TYR  10 -17.712  -2.388  11.351
   89    HB3  TYR  10           HB1      TYR  10 -17.291  -3.279   9.888
   90    HD1  TYR  10           HD2      TYR  10 -19.409  -0.391  11.019
   91    HD2  TYR  10           HD1      TYR  10 -17.027  -2.098   7.879
   92    HE1  TYR  10           HE2      TYR  10 -19.688   1.679   9.681
   93    HE2  TYR  10           HE1      TYR  10 -17.311  -0.030   6.538
   94    HH   TYR  10           HH       TYR  10 -19.344   1.945   6.615
   95    H    ILE  11           HN       ILE  11 -18.493  -5.007   8.656
   96    HA   ILE  11           HA       ILE  11 -19.758  -3.891   6.338
   97    HB   ILE  11           HB       ILE  11 -18.567  -6.631   6.840
   98   HG12  ILE  11          HG12      ILE  11 -16.986  -4.748   7.021
   99   HG13  ILE  11          HG11      ILE  11 -16.647  -5.717   5.592
  100   HG21  ILE  11          HG21      ILE  11 -20.018  -6.931   4.985
  101   HG22  ILE  11          HG22      ILE  11 -18.430  -6.640   4.277
  102   HG23  ILE  11          HG23      ILE  11 -19.627  -5.345   4.320
  103   HD11  ILE  11          HD11      ILE  11 -17.658  -2.918   5.792
  104   HD12  ILE  11          HD12      ILE  11 -18.298  -3.883   4.468
  105   HD13  ILE  11          HD13      ILE  11 -16.564  -3.633   4.617
  106    H    THR  12           HN       THR  12 -20.653  -6.637   8.436
  107    HA   THR  12           HA       THR  12 -22.815  -7.627   6.930
  108    HB   THR  12           HB       THR  12 -23.814  -8.202   9.224
  109    HG1  THR  12           HG1      THR  12 -21.589  -6.655   9.888
  110   HG21  THR  12          HG21      THR  12 -21.768  -9.693   9.778
  111   HG22  THR  12          HG22      THR  12 -21.049  -8.998   8.326
  112   HG23  THR  12          HG23      THR  12 -22.555  -9.911   8.217
  113    H    ASN  13           HN       ASN  13 -22.913  -5.066   9.437
  114    HA   ASN  13           HA       ASN  13 -25.703  -4.516   9.037
  115    HB2  ASN  13           HB2      ASN  13 -25.382  -2.683  10.506
  116    HB3  ASN  13           HB1      ASN  13 -24.199  -3.872  11.037
  117   HD21  ASN  13          HD21      ASN  13 -24.388  -1.122   8.685
  118   HD22  ASN  13          HD22      ASN  13 -22.817  -0.562   8.999
  119    H    LEU  14           HN       LEU  14 -22.777  -3.450   7.458
  120    HA   LEU  14           HA       LEU  14 -23.799  -1.101   6.226
  121    HB2  LEU  14           HB2      LEU  14 -21.365  -2.200   6.331
  122    HB3  LEU  14           HB1      LEU  14 -21.833  -2.851   4.766
  123    HG   LEU  14           HG       LEU  14 -20.696  -0.751   4.393
  124   HD11  LEU  14          HD11      LEU  14 -22.876  -1.336   3.131
  125   HD12  LEU  14          HD12      LEU  14 -22.288   0.320   3.022
  126   HD13  LEU  14          HD13      LEU  14 -23.621  -0.071   4.106
  127   HD21  LEU  14          HD21      LEU  14 -22.691   0.954   5.808
  128   HD22  LEU  14          HD22      LEU  14 -20.944   1.132   5.674
  129   HD23  LEU  14          HD23      LEU  14 -21.622   0.030   6.865
  130    H    PHE  15           HN       PHE  15 -23.708  -4.472   5.060
  131    HA   PHE  15           HA       PHE  15 -25.677  -3.714   2.924
  132    HB2  PHE  15           HB2      PHE  15 -23.613  -5.933   3.046
  133    HB3  PHE  15           HB1      PHE  15 -24.833  -5.789   1.778
  134    HD1  PHE  15           HD1      PHE  15 -24.894  -3.712   0.345
  135    HD2  PHE  15           HD2      PHE  15 -21.653  -4.541   3.043
  136    HE1  PHE  15           HE1      PHE  15 -23.487  -2.043  -0.831
  137    HE2  PHE  15           HE2      PHE  15 -20.246  -2.872   1.863
  138    HZ   PHE  15           HZ       PHE  15 -21.167  -1.619  -0.069
  139    H    ASN  16           HN       ASN  16 -25.692  -4.851   5.920
  140    HA   ASN  16           HA       ASN  16 -27.130  -6.208   7.161
  141    HB2  ASN  16           HB2      ASN  16 -28.846  -6.086   4.662
  142    HB3  ASN  16           HB1      ASN  16 -29.390  -6.469   6.295
  143   HD21  ASN  16          HD21      ASN  16 -27.520  -4.413   7.477
  144   HD22  ASN  16          HD22      ASN  16 -28.252  -2.913   7.164
  145    H    LEU  17           HN       LEU  17 -25.040  -7.526   5.703
  146    HA   LEU  17           HA       LEU  17 -26.207  -9.887   4.479
  147    HB2  LEU  17           HB2      LEU  17 -23.384  -9.134   5.222
  148    HB3  LEU  17           HB1      LEU  17 -23.788 -10.680   4.483
  149    HG   LEU  17           HG       LEU  17 -24.724  -8.105   3.209
  150   HD11  LEU  17          HD11      LEU  17 -22.295  -7.864   3.558
  151   HD12  LEU  17          HD12      LEU  17 -22.674  -8.080   1.849
  152   HD13  LEU  17          HD13      LEU  17 -22.027  -9.427   2.786
  153   HD21  LEU  17          HD21      LEU  17 -24.478  -9.528   1.145
  154   HD22  LEU  17          HD22      LEU  17 -25.654 -10.160   2.289
  155   HD23  LEU  17          HD23      LEU  17 -24.054 -10.887   2.181
  156    HA   PRO  18           HA       PRO  18 -26.771 -12.500   8.040
  157    HB2  PRO  18           HB2      PRO  18 -25.021 -14.506   6.642
  158    HB3  PRO  18           HB1      PRO  18 -26.627 -14.725   7.368
  159    HG2  PRO  18           HG2      PRO  18 -26.339 -14.553   4.737
  160    HG3  PRO  18           HG1      PRO  18 -27.716 -13.792   5.556
  161    HD2  PRO  18           HD2      PRO  18 -25.274 -12.504   4.391
  162    HD3  PRO  18           HD1      PRO  18 -26.944 -11.902   4.505
  163    H    ARG  19           HN       ARG  19 -25.753 -12.635   9.980
  164    HA   ARG  19           HA       ARG  19 -22.856 -12.051  10.139
  165    HB2  ARG  19           HB2      ARG  19 -24.999 -12.278  12.279
  166    HB3  ARG  19           HB1      ARG  19 -23.334 -11.775  12.558
  167    HG2  ARG  19           HG2      ARG  19 -24.244  -9.672  12.280
  168    HG3  ARG  19           HG1      ARG  19 -23.963 -10.031  10.583
  169    HD2  ARG  19           HD2      ARG  19 -26.235  -9.207  10.833
  170    HD3  ARG  19           HD1      ARG  19 -26.316 -10.925  10.448
  171    HE   ARG  19           HE       ARG  19 -26.291 -10.443  13.313
  172   HH11  ARG  19          HH21      ARG  19 -28.200 -10.503  10.438
  173   HH12  ARG  19          HH22      ARG  19 -29.677 -10.853  11.272
  174   HH21  ARG  19          HH11      ARG  19 -28.205 -10.901  14.410
  175   HH22  ARG  19          HH12      ARG  19 -29.680 -11.079  13.520
  176    H    ASP  20           HN       ASP  20 -25.007 -14.740  10.397
  177    HA   ASP  20           HA       ASP  20 -23.157 -16.330  12.059
  178    HB2  ASP  20           HB2      ASP  20 -25.666 -16.537  12.205
  179    HB3  ASP  20           HB1      ASP  20 -25.646 -17.234  10.586
  180    H    GLU  21           HN       GLU  21 -23.138 -15.392   8.892
  181    HA   GLU  21           HA       GLU  21 -22.280 -18.021   7.802
  182    HB2  GLU  21           HB2      GLU  21 -23.773 -16.496   6.478
  183    HB3  GLU  21           HB1      GLU  21 -22.449 -15.334   6.406
  184    HG2  GLU  21           HG2      GLU  21 -22.371 -16.624   4.372
  185    HG3  GLU  21           HG1      GLU  21 -21.027 -17.167   5.374
  186    H    LYS  22           HN       LYS  22 -20.194 -18.574   7.993
  187    HA   LYS  22           HA       LYS  22 -18.160 -16.568   8.651
  188    HB2  LYS  22           HB2      LYS  22 -18.077 -19.566   8.255
  189    HB3  LYS  22           HB1      LYS  22 -16.655 -18.605   8.654
  190    HG2  LYS  22           HG2      LYS  22 -19.130 -18.310  10.347
  191    HG3  LYS  22           HG1      LYS  22 -18.106 -19.723  10.583
  192    HD2  LYS  22           HD2      LYS  22 -16.825 -16.994  10.500
  193    HD3  LYS  22           HD1      LYS  22 -17.652 -17.512  11.967
  194    HE2  LYS  22           HE2      LYS  22 -16.250 -19.523  12.074
  195    HE3  LYS  22           HE1      LYS  22 -15.441 -19.058  10.579
  196    HZ1  LYS  22           HZ1      LYS  22 -14.584 -17.110  11.624
  197    HZ2  LYS  22           HZ2      LYS  22 -14.212 -18.442  12.612
  198    HZ3  LYS  22           HZ3      LYS  22 -15.482 -17.396  13.035
  199    H    TRP  23           HN       TRP  23 -16.410 -16.001   7.339
  200    HA   TRP  23           HA       TRP  23 -16.758 -16.588   4.426
  201    HB2  TRP  23           HB2      TRP  23 -15.074 -14.425   5.710
  202    HB3  TRP  23           HB1      TRP  23 -15.555 -14.548   4.020
  203    HD1  TRP  23           HD1      TRP  23 -18.655 -15.451   5.055
  204    HE1  TRP  23           HE1      TRP  23 -20.223 -13.514   5.680
  205    HE3  TRP  23           HE3      TRP  23 -15.225 -11.739   5.793
  206    HZ2  TRP  23           HZ2      TRP  23 -20.055 -10.753   6.396
  207    HZ3  TRP  23           HZ3      TRP  23 -15.958  -9.465   6.444
  208    HH2  TRP  23           HH2      TRP  23 -18.368  -8.967   6.746
  209    H    GLU  24           HN       GLU  24 -14.451 -16.304   3.311
  210    HA   GLU  24           HA       GLU  24 -12.632 -18.260   4.673
  211    HB2  GLU  24           HB2      GLU  24 -13.598 -18.966   2.492
  212    HB3  GLU  24           HB1      GLU  24 -12.859 -17.556   1.730
  213    HG2  GLU  24           HG2      GLU  24 -10.631 -18.336   2.376
  214    HG3  GLU  24           HG1      GLU  24 -11.338 -19.714   3.221
  215    H    CYS  25           HN       CYS  25 -10.670 -17.535   5.280
  216    HA   CYS  25           HA       CYS  25  -9.907 -14.755   4.627
  217    HB2  CYS  25           HB2      CYS  25  -8.294 -16.608   6.375
  218    HB3  CYS  25           HB1      CYS  25  -8.515 -14.861   6.505
  219    HG   CYS  25           HG       CYS  25 -10.833 -15.224   7.535
  220    H    GLU  26           HN       GLU  26  -7.979 -14.197   3.590
  221    HA   GLU  26           HA       GLU  26  -6.334 -16.409   2.424
  222    HB2  GLU  26           HB2      GLU  26  -7.950 -15.590   0.711
  223    HB3  GLU  26           HB1      GLU  26  -7.311 -13.958   0.922
  224    HG2  GLU  26           HG2      GLU  26  -5.092 -14.698   0.219
  225    HG3  GLU  26           HG1      GLU  26  -5.661 -16.362   0.093
  226    H    SER  27           HN       SER  27  -4.532 -16.022   3.672
  227    HA   SER  27           HA       SER  27  -3.601 -13.247   4.094
  228    HB2  SER  27           HB2      SER  27  -3.488 -14.732   6.002
  229    HB3  SER  27           HB1      SER  27  -2.598 -15.935   5.073
  230    HG   SER  27           HG       SER  27  -1.725 -13.288   5.643
  231    H    ILE  28           HN       ILE  28  -2.082 -12.325   2.825
  232    HA   ILE  28           HA       ILE  28   0.014 -13.951   1.577
  233    HB   ILE  28           HB       ILE  28  -1.819 -14.142  -0.063
  234   HG12  ILE  28          HG12      ILE  28  -0.604 -13.248  -2.028
  235   HG13  ILE  28          HG11      ILE  28   0.395 -12.262  -0.966
  236   HG21  ILE  28          HG21      ILE  28  -2.979 -12.035   0.564
  237   HG22  ILE  28          HG22      ILE  28  -2.707 -12.155  -1.174
  238   HG23  ILE  28          HG23      ILE  28  -1.676 -11.116  -0.191
  239   HD11  ILE  28          HD11      ILE  28   1.235 -14.639  -1.801
  240   HD12  ILE  28          HD12      ILE  28   0.263 -15.218  -0.449
  241   HD13  ILE  28          HD13      ILE  28   1.587 -14.085  -0.166
  242    H    GLU  29           HN       GLU  29   1.830 -12.711   1.058
  243    HA   GLU  29           HA       GLU  29   1.889 -10.034   2.265
  244    HB2  GLU  29           HB2      GLU  29   4.007 -11.799   1.018
  245    HB3  GLU  29           HB1      GLU  29   4.343 -10.188   1.658
  246    HG2  GLU  29           HG2      GLU  29   3.527 -10.856   3.857
  247    HG3  GLU  29           HG1      GLU  29   3.082 -12.445   3.240
  248    H    GLU  30           HN       GLU  30   1.627  -8.184   1.130
  249    HA   GLU  30           HA       GLU  30   2.418  -8.110  -1.741
  250    HB2  GLU  30           HB2      GLU  30  -0.327  -7.402  -0.671
  251    HB3  GLU  30           HB1      GLU  30   0.261  -6.888  -2.252
  252    HG2  GLU  30           HG2      GLU  30   0.584  -9.227  -2.917
  253    HG3  GLU  30           HG1      GLU  30   0.056  -9.768  -1.324
  254    H    VAL  31           HN       VAL  31   2.659  -5.905  -2.530
  255    HA   VAL  31           HA       VAL  31   3.809  -4.159  -0.525
  256    HB   VAL  31           HB       VAL  31   3.252  -3.768  -3.478
  257   HG11  VAL  31          HG11      VAL  31   3.360  -1.574  -2.546
  258   HG12  VAL  31          HG12      VAL  31   4.979  -1.897  -3.170
  259   HG13  VAL  31          HG13      VAL  31   4.658  -2.029  -1.440
  260   HG21  VAL  31          HG21      VAL  31   5.559  -4.305  -3.781
  261   HG22  VAL  31          HG22      VAL  31   4.937  -5.527  -2.673
  262   HG23  VAL  31          HG23      VAL  31   5.890  -4.177  -2.054
  263    H    ALA  32           HN       ALA  32   2.907  -2.383   0.433
  264    HA   ALA  32           HA       ALA  32   0.107  -2.051   0.612
  265    HB1  ALA  32           HB1      ALA  32   1.467  -1.122   2.330
  266    HB2  ALA  32           HB2      ALA  32   0.750   0.266   1.513
  267    HB3  ALA  32           HB3      ALA  32   2.418  -0.191   1.177
  268    H    ASP  33           HN       ASP  33   2.452  -0.202  -1.370
  269    HA   ASP  33           HA       ASP  33   0.555   1.615  -2.468
  270    HB2  ASP  33           HB2      ASP  33   3.058   1.814  -2.597
  271    HB3  ASP  33           HB1      ASP  33   3.042   0.564  -3.841
  272    H    ASP  34           HN       ASP  34   0.588  -1.699  -2.807
  273    HA   ASP  34           HA       ASP  34  -0.345  -1.729  -5.624
  274    HB2  ASP  34           HB2      ASP  34   1.135  -3.544  -4.583
  275    HB3  ASP  34           HB1      ASP  34  -0.296  -4.055  -3.688
  276    H    ILE  35           HN       ILE  35  -1.612  -1.664  -2.395
  277    HA   ILE  35           HA       ILE  35  -4.389  -1.927  -3.496
  278    HB   ILE  35           HB       ILE  35  -4.999  -2.918  -1.244
  279   HG12  ILE  35          HG12      ILE  35  -2.017  -3.430  -1.057
  280   HG13  ILE  35          HG11      ILE  35  -2.837  -2.158  -0.150
  281   HG21  ILE  35          HG21      ILE  35  -3.066  -4.438  -3.018
  282   HG22  ILE  35          HG22      ILE  35  -4.806  -4.292  -3.265
  283   HG23  ILE  35          HG23      ILE  35  -4.184  -5.178  -1.872
  284   HD11  ILE  35          HD11      ILE  35  -3.797  -5.021  -0.033
  285   HD12  ILE  35          HD12      ILE  35  -4.108  -3.708   1.101
  286   HD13  ILE  35          HD13      ILE  35  -2.507  -4.443   1.021
  287    H    LEU  36           HN       LEU  36  -2.251   0.182  -2.347
  288    HA   LEU  36           HA       LEU  36  -4.352   1.777  -0.960
  289    HB2  LEU  36           HB2      LEU  36  -1.484   1.402  -0.142
  290    HB3  LEU  36           HB1      LEU  36  -2.460   2.751   0.428
  291    HG   LEU  36           HG       LEU  36  -3.583  -0.039   0.658
  292   HD11  LEU  36          HD11      LEU  36  -1.474  -0.427   1.660
  293   HD12  LEU  36          HD12      LEU  36  -2.546  -0.050   3.008
  294   HD13  LEU  36          HD13      LEU  36  -1.433   1.174   2.396
  295   HD21  LEU  36          HD21      LEU  36  -3.777   2.467   2.365
  296   HD22  LEU  36          HD22      LEU  36  -4.645   0.963   2.664
  297   HD23  LEU  36          HD23      LEU  36  -4.998   1.910   1.224
  298    HA   PRO  37           HA       PRO  37  -3.304   4.438  -4.489
  299    HB2  PRO  37           HB2      PRO  37  -4.584   6.470  -2.685
  300    HB3  PRO  37           HB1      PRO  37  -4.870   6.156  -4.408
  301    HG2  PRO  37           HG2      PRO  37  -6.585   5.331  -2.530
  302    HG3  PRO  37           HG1      PRO  37  -6.266   4.374  -3.987
  303    HD2  PRO  37           HD2      PRO  37  -5.383   3.871  -1.184
  304    HD3  PRO  37           HD1      PRO  37  -5.678   2.720  -2.511
  305    H    ASP  38           HN       ASP  38  -1.558   5.771  -4.887
  306    HA   ASP  38           HA       ASP  38   0.550   6.075  -3.100
  307    HB2  ASP  38           HB2      ASP  38   1.341   7.916  -4.577
  308    HB3  ASP  38           HB1      ASP  38   0.798   6.509  -5.490
  309    H    GLN  39           HN       GLN  39  -2.427   7.778  -3.165
  310    HA   GLN  39           HA       GLN  39  -1.607  10.202  -1.844
  311    HB2  GLN  39           HB2      GLN  39  -4.285   8.784  -1.934
  312    HB3  GLN  39           HB1      GLN  39  -4.037  10.424  -1.335
  313    HG2  GLN  39           HG2      GLN  39  -3.322   9.501  -4.134
  314    HG3  GLN  39           HG1      GLN  39  -4.806  10.357  -3.715
  315   HE21  GLN  39          HE21      GLN  39  -1.895  10.970  -5.075
  316   HE22  GLN  39          HE22      GLN  39  -1.630  12.557  -4.532
  317    H    TYR  40           HN       TYR  40  -2.737   7.047  -0.656
  318    HA   TYR  40           HA       TYR  40  -2.425   7.996   2.157
  319    HB2  TYR  40           HB2      TYR  40  -3.696   5.507   0.985
  320    HB3  TYR  40           HB1      TYR  40  -3.562   5.836   2.714
  321    HD1  TYR  40           HD1      TYR  40  -4.821   7.664   3.759
  322    HD2  TYR  40           HD2      TYR  40  -5.205   6.807  -0.433
  323    HE1  TYR  40           HE1      TYR  40  -6.852   9.082   3.655
  324    HE2  TYR  40           HE2      TYR  40  -7.237   8.225  -0.536
  325    HH   TYR  40           HH       TYR  40  -8.928   9.213   2.153
  326    H    VAL  41           HN       VAL  41  -0.282   7.069   0.071
  327    HA   VAL  41           HA       VAL  41   1.040   4.995   1.797
  328    HB   VAL  41           HB       VAL  41   1.584   5.732  -1.092
  329   HG11  VAL  41          HG11      VAL  41   3.579   4.885  -0.051
  330   HG12  VAL  41          HG12      VAL  41   2.892   3.581  -1.020
  331   HG13  VAL  41          HG13      VAL  41   2.676   3.586   0.730
  332   HG21  VAL  41          HG21      VAL  41   0.364   3.824  -1.742
  333   HG22  VAL  41          HG22      VAL  41  -0.641   4.516  -0.471
  334   HG23  VAL  41          HG23      VAL  41   0.394   3.135  -0.120
  335    H    ARG  42           HN       ARG  42   1.497   8.084   0.099
  336    HA   ARG  42           HA       ARG  42   4.243   8.492   0.752
  337    HB2  ARG  42           HB2      ARG  42   1.970  10.440   0.278
  338    HB3  ARG  42           HB1      ARG  42   3.640  10.954   0.501
  339    HG2  ARG  42           HG2      ARG  42   4.329   9.588  -1.434
  340    HG3  ARG  42           HG1      ARG  42   2.664   9.047  -1.650
  341    HD2  ARG  42           HD2      ARG  42   3.513  11.961  -1.737
  342    HD3  ARG  42           HD1      ARG  42   3.317  10.950  -3.170
  343    HE   ARG  42           HE       ARG  42   0.917  10.758  -1.680
  344   HH11  ARG  42          HH21      ARG  42   2.809  13.113  -3.364
  345   HH12  ARG  42          HH22      ARG  42   1.440  14.072  -3.817
  346   HH21  ARG  42          HH11      ARG  42  -0.867  12.002  -2.267
  347   HH22  ARG  42          HH12      ARG  42  -0.638  13.445  -3.198
  348    H    LEU  43           HN       LEU  43   1.274   9.431   2.510
  349    HA   LEU  43           HA       LEU  43   2.641  10.746   4.675
  350    HB2  LEU  43           HB2      LEU  43  -0.053   9.361   4.760
  351    HB3  LEU  43           HB1      LEU  43   0.513  10.642   5.830
  352    HG   LEU  43           HG       LEU  43   0.104  10.917   2.838
  353   HD11  LEU  43          HD11      LEU  43  -1.972  10.682   4.301
  354   HD12  LEU  43          HD12      LEU  43  -1.871  12.166   3.354
  355   HD13  LEU  43          HD13      LEU  43  -1.488  12.192   5.075
  356   HD21  LEU  43          HD21      LEU  43   1.106  12.775   5.001
  357   HD22  LEU  43          HD22      LEU  43   0.304  13.423   3.570
  358   HD23  LEU  43          HD23      LEU  43   1.780  12.479   3.397
  359    H    GLY  44           HN       GLY  44   1.519   7.430   4.180
  360    HA2  GLY  44           HA2      GLY  44   2.487   6.604   6.830
  361    HA3  GLY  44           HA1      GLY  44   1.670   5.588   5.663
  362    HA   PRO  45           HA       PRO  45   6.632   5.823   4.973
  363    HB2  PRO  45           HB2      PRO  45   6.843   4.192   7.489
  364    HB3  PRO  45           HB1      PRO  45   7.997   5.354   6.801
  365    HG2  PRO  45           HG2      PRO  45   6.470   5.988   8.894
  366    HG3  PRO  45           HG1      PRO  45   6.864   7.179   7.640
  367    HD2  PRO  45           HD2      PRO  45   4.276   5.765   8.143
  368    HD3  PRO  45           HD1      PRO  45   4.571   7.375   7.445
  369    H    LEU  46           HN       LEU  46   4.034   3.784   5.485
  370    HA   LEU  46           HA       LEU  46   5.106   1.173   5.139
  371    HB2  LEU  46           HB2      LEU  46   2.470   2.150   4.005
  372    HB3  LEU  46           HB1      LEU  46   2.871   0.523   4.552
  373    HG   LEU  46           HG       LEU  46   2.734   2.968   6.348
  374   HD11  LEU  46          HD11      LEU  46   0.690   1.904   7.238
  375   HD12  LEU  46          HD12      LEU  46   0.817   0.652   6.000
  376   HD13  LEU  46          HD13      LEU  46   0.518   2.326   5.534
  377   HD21  LEU  46          HD21      LEU  46   3.307   0.039   6.821
  378   HD22  LEU  46          HD22      LEU  46   2.732   1.091   8.114
  379   HD23  LEU  46          HD23      LEU  46   4.267   1.432   7.318
  380    H    SER  47           HN       SER  47   5.473   3.780   3.153
  381    HA   SER  47           HA       SER  47   4.890   2.923   0.545
  382    HB2  SER  47           HB2      SER  47   5.688   5.166   0.959
  383    HB3  SER  47           HB1      SER  47   7.226   4.556   1.562
  384    HG   SER  47           HG       SER  47   7.791   4.794  -0.458
  385    H    ASN  48           HN       ASN  48   5.773   1.505  -0.860
  386    HA   ASN  48           HA       ASN  48   7.015  -0.329  -1.606
  387    HB2  ASN  48           HB2      ASN  48   9.196   1.234  -0.189
  388    HB3  ASN  48           HB1      ASN  48   9.489  -0.161  -1.226
  389   HD21  ASN  48          HD21      ASN  48  10.341   2.651  -1.729
  390   HD22  ASN  48          HD22      ASN  48   9.618   3.103  -3.197
  391    H    LYS  49           HN       LYS  49   6.189   0.067   1.523
  392    HA   LYS  49           HA       LYS  49   7.820  -2.100   2.659
  393    HB2  LYS  49           HB2      LYS  49   6.899  -0.020   3.915
  394    HB3  LYS  49           HB1      LYS  49   5.370  -0.897   3.957
  395    HG2  LYS  49           HG2      LYS  49   6.421  -2.766   5.116
  396    HG3  LYS  49           HG1      LYS  49   8.008  -2.009   4.973
  397    HD2  LYS  49           HD2      LYS  49   7.224  -0.109   6.342
  398    HD3  LYS  49           HD1      LYS  49   5.645  -0.881   6.501
  399    HE2  LYS  49           HE2      LYS  49   6.702  -2.823   7.596
  400    HE3  LYS  49           HE1      LYS  49   8.281  -2.054   7.438
  401    HZ1  LYS  49           HZ1      LYS  49   7.883  -0.732   9.168
  402    HZ2  LYS  49           HZ2      LYS  49   6.600  -1.780   9.543
  403    HZ3  LYS  49           HZ3      LYS  49   6.310  -0.361   8.655
  404    H    ILE  50           HN       ILE  50   7.201  -4.199   2.831
  405    HA   ILE  50           HA       ILE  50   4.703  -5.015   1.473
  406    HB   ILE  50           HB       ILE  50   7.045  -6.576   2.602
  407   HG12  ILE  50          HG12      ILE  50   6.165  -6.137  -0.264
  408   HG13  ILE  50          HG11      ILE  50   7.372  -5.134   0.541
  409   HG21  ILE  50          HG21      ILE  50   5.980  -8.455   1.236
  410   HG22  ILE  50          HG22      ILE  50   4.522  -7.464   1.188
  411   HG23  ILE  50          HG23      ILE  50   5.153  -8.029   2.734
  412   HD11  ILE  50          HD11      ILE  50   8.688  -7.219   1.023
  413   HD12  ILE  50          HD12      ILE  50   8.529  -6.864  -0.697
  414   HD13  ILE  50          HD13      ILE  50   7.532  -8.118   0.040
  415    H    LEU  51           HN       LEU  51   2.893  -5.156   2.675
  416    HA   LEU  51           HA       LEU  51   3.112  -5.829   5.588
  417    HB2  LEU  51           HB2      LEU  51   1.169  -4.200   3.960
  418    HB3  LEU  51           HB1      LEU  51   0.618  -4.941   5.462
  419    HG   LEU  51           HG       LEU  51   2.516  -3.845   6.656
  420   HD11  LEU  51          HD11      LEU  51   3.538  -1.864   5.311
  421   HD12  LEU  51          HD12      LEU  51   3.029  -2.768   3.885
  422   HD13  LEU  51          HD13      LEU  51   4.170  -3.483   5.023
  423   HD21  LEU  51          HD21      LEU  51   1.582  -1.515   6.470
  424   HD22  LEU  51          HD22      LEU  51   0.351  -2.758   6.688
  425   HD23  LEU  51          HD23      LEU  51   0.627  -2.061   5.091
  426    H    GLN  52           HN       GLN  52   1.730  -7.424   6.456
  427    HA   GLN  52           HA       GLN  52   1.104  -9.590   4.607
  428    HB2  GLN  52           HB2      GLN  52   0.706  -9.225   7.590
  429    HB3  GLN  52           HB1      GLN  52   0.309 -10.714   6.728
  430    HG2  GLN  52           HG2      GLN  52   2.617 -10.947   5.984
  431    HG3  GLN  52           HG1      GLN  52   3.042  -9.401   6.714
  432   HE21  GLN  52          HE21      GLN  52   4.026 -12.216   7.333
  433   HE22  GLN  52          HE22      GLN  52   3.755 -12.409   8.997
  434    H    THR  53           HN       THR  53  -0.656  -9.192   3.313
  435    HA   THR  53           HA       THR  53  -3.002  -7.772   4.352
  436    HB   THR  53           HB       THR  53  -3.798  -7.815   2.120
  437    HG1  THR  53           HG1      THR  53  -3.588  -9.543   0.971
  438   HG21  THR  53          HG21      THR  53  -0.826  -7.971   1.642
  439   HG22  THR  53          HG22      THR  53  -1.522  -6.638   2.561
  440   HG23  THR  53          HG23      THR  53  -2.008  -6.902   0.888
  441    H    ASN  54           HN       ASN  54  -5.177  -8.725   4.196
  442    HA   ASN  54           HA       ASN  54  -5.352 -11.678   4.208
  443    HB2  ASN  54           HB2      ASN  54  -5.857  -9.907   6.599
  444    HB3  ASN  54           HB1      ASN  54  -6.756 -11.413   6.407
  445   HD21  ASN  54          HD21      ASN  54  -3.466 -10.084   6.784
  446   HD22  ASN  54          HD22      ASN  54  -2.750 -11.545   7.268
  447    H    THR  55           HN       THR  55  -6.565 -11.282   2.290
  448    HA   THR  55           HA       THR  55  -8.942  -9.578   2.407
  449    HB   THR  55           HB       THR  55  -8.143 -11.521   0.232
  450    HG1  THR  55           HG1      THR  55  -6.968  -9.848  -0.612
  451   HG21  THR  55          HG21      THR  55  -9.691  -8.923   0.078
  452   HG22  THR  55          HG22      THR  55 -10.469 -10.498   0.249
  453   HG23  THR  55          HG23      THR  55  -9.506 -10.141  -1.184
  454    H    TYR  56           HN       TYR  56 -10.972 -10.233   2.871
  455    HA   TYR  56           HA       TYR  56 -11.450 -13.164   3.293
  456    HB2  TYR  56           HB2      TYR  56 -12.978 -10.766   4.353
  457    HB3  TYR  56           HB1      TYR  56 -13.260 -12.455   4.772
  458    HD1  TYR  56           HD1      TYR  56 -10.897  -9.629   5.053
  459    HD2  TYR  56           HD2      TYR  56 -11.812 -13.635   6.305
  460    HE1  TYR  56           HE1      TYR  56  -9.170  -9.468   6.823
  461    HE2  TYR  56           HE2      TYR  56 -10.085 -13.472   8.079
  462    HH   TYR  56           HH       TYR  56  -8.381 -12.256   8.877
  463    H    TYR  57           HN       TYR  57 -13.133 -14.139   2.128
  464    HA   TYR  57           HA       TYR  57 -15.029 -12.419   0.645
  465    HB2  TYR  57           HB2      TYR  57 -14.517 -13.402  -1.520
  466    HB3  TYR  57           HB1      TYR  57 -13.060 -12.660  -0.863
  467    HD1  TYR  57           HD2      TYR  57 -11.204 -14.032  -0.032
  468    HD2  TYR  57           HD1      TYR  57 -14.745 -15.825  -1.676
  469    HE1  TYR  57           HE2      TYR  57 -10.016 -16.201  -0.228
  470    HE2  TYR  57           HE1      TYR  57 -13.556 -17.993  -1.874
  471    HH   TYR  57           HH       TYR  57 -10.208 -18.280  -1.618
  472    H    SER  58           HN       SER  58 -16.968 -13.441   0.281
  473    HA   SER  58           HA       SER  58 -17.147 -16.380   0.806
  474    HB2  SER  58           HB2      SER  58 -17.777 -15.207   2.888
  475    HB3  SER  58           HB1      SER  58 -18.962 -14.260   2.002
  476    HG   SER  58           HG       SER  58 -18.919 -17.041   2.517
  477    H    ASP  59           HN       ASP  59 -19.523 -17.062   0.223
  478    HA   ASP  59           HA       ASP  59 -19.938 -16.610  -2.542
  479    HB2  ASP  59           HB2      ASP  59 -21.833 -17.537  -0.369
  480    HB3  ASP  59           HB1      ASP  59 -22.208 -17.613  -2.090
  481    H    THR  60           HN       THR  60 -21.996 -15.414   0.144
  482    HA   THR  60           HA       THR  60 -23.442 -13.588  -1.571
  483    HB   THR  60           HB       THR  60 -24.380 -14.538   0.527
  484    HG1  THR  60           HG1      THR  60 -24.470 -12.020  -0.305
  485   HG21  THR  60          HG21      THR  60 -22.200 -14.359   1.791
  486   HG22  THR  60          HG22      THR  60 -23.613 -13.790   2.680
  487   HG23  THR  60          HG23      THR  60 -22.508 -12.630   1.944
  488    H    LEU  61           HN       LEU  61 -20.718 -13.224   0.672
  489    HA   LEU  61           HA       LEU  61 -20.621 -10.379   0.624
  490    HB2  LEU  61           HB2      LEU  61 -19.361 -11.817   2.232
  491    HB3  LEU  61           HB1      LEU  61 -18.304 -12.311   0.912
  492    HG   LEU  61           HG       LEU  61 -17.647  -9.942   0.563
  493   HD11  LEU  61          HD11      LEU  61 -19.661  -9.528   2.757
  494   HD12  LEU  61          HD12      LEU  61 -19.370  -8.570   1.307
  495   HD13  LEU  61          HD13      LEU  61 -18.266  -8.451   2.670
  496   HD21  LEU  61          HD21      LEU  61 -17.259 -10.596   3.485
  497   HD22  LEU  61          HD22      LEU  61 -16.112  -9.879   2.355
  498   HD23  LEU  61          HD23      LEU  61 -16.515 -11.588   2.234
  499    H    HIS  62           HN       HIS  62 -19.064 -12.814  -1.437
  500    HA   HIS  62           HA       HIS  62 -17.557 -10.961  -3.020
  501    HB2  HIS  62           HB2      HIS  62 -17.118 -13.401  -2.959
  502    HB3  HIS  62           HB1      HIS  62 -18.651 -13.686  -3.785
  503    HD1  HIS  62           HD1      HIS  62 -15.177 -12.398  -4.346
  504    HD2  HIS  62           HD2      HIS  62 -18.680 -12.951  -6.539
  505    HE1  HIS  62           HE1      HIS  62 -14.558 -12.070  -6.781
  506    H    LYS  63           HN       LYS  63 -20.807 -12.331  -3.360
  507    HA   LYS  63           HA       LYS  63 -21.409 -11.287  -5.939
  508    HB2  LYS  63           HB2      LYS  63 -22.766 -12.994  -4.712
  509    HB3  LYS  63           HB1      LYS  63 -23.317 -11.721  -3.622
  510    HG2  LYS  63           HG2      LYS  63 -24.316 -10.505  -5.496
  511    HG3  LYS  63           HG1      LYS  63 -23.712 -11.715  -6.629
  512    HD2  LYS  63           HD2      LYS  63 -25.065 -13.448  -5.492
  513    HD3  LYS  63           HD1      LYS  63 -25.682 -12.227  -4.378
  514    HE2  LYS  63           HE2      LYS  63 -26.671 -10.989  -6.258
  515    HE3  LYS  63           HE1      LYS  63 -26.028 -12.177  -7.391
  516    HZ1  LYS  63           HZ1      LYS  63 -27.424 -13.540  -5.388
  517    HZ2  LYS  63           HZ2      LYS  63 -27.805 -13.421  -7.039
  518    HZ3  LYS  63           HZ3      LYS  63 -28.419 -12.282  -5.938
  519    H    SER  64           HN       SER  64 -21.781  -9.871  -2.696
  520    HA   SER  64           HA       SER  64 -23.158  -7.505  -3.522
  521    HB2  SER  64           HB2      SER  64 -21.294  -7.952  -1.173
  522    HB3  SER  64           HB1      SER  64 -22.370  -6.570  -1.360
  523    HG   SER  64           HG       SER  64 -24.055  -8.288  -1.614
  524    H    ASN  65           HN       ASN  65 -20.201  -8.533  -4.494
  525    HA   ASN  65           HA       ASN  65 -18.384  -7.498  -5.532
  526    HB2  ASN  65           HB2      ASN  65 -20.112  -5.002  -5.516
  527    HB3  ASN  65           HB1      ASN  65 -18.746  -5.346  -6.574
  528   HD21  ASN  65          HD21      ASN  65 -21.991  -5.201  -6.763
  529   HD22  ASN  65          HD22      ASN  65 -22.299  -6.461  -7.858
  530    H    ILE  66           HN       ILE  66 -18.540  -7.545  -2.631
  531    HA   ILE  66           HA       ILE  66 -16.998  -5.053  -1.949
  532    HB   ILE  66           HB       ILE  66 -18.432  -6.942  -0.062
  533   HG12  ILE  66          HG12      ILE  66 -20.105  -5.840  -1.423
  534   HG13  ILE  66          HG11      ILE  66 -20.080  -5.053   0.153
  535   HG21  ILE  66          HG21      ILE  66 -16.516  -5.645   0.874
  536   HG22  ILE  66          HG22      ILE  66 -18.060  -5.181   1.587
  537   HG23  ILE  66          HG23      ILE  66 -17.311  -4.158   0.361
  538   HD11  ILE  66          HD11      ILE  66 -18.379  -3.406  -0.963
  539   HD12  ILE  66          HD12      ILE  66 -20.091  -3.237  -1.336
  540   HD13  ILE  66          HD13      ILE  66 -19.022  -4.039  -2.476
  541    H    TYR  67           HN       TYR  67 -14.903  -5.340  -1.448
  542    HA   TYR  67           HA       TYR  67 -13.930  -8.119  -0.852
  543    HB2  TYR  67           HB2      TYR  67 -12.452  -5.962  -2.364
  544    HB3  TYR  67           HB1      TYR  67 -11.937  -7.629  -2.119
  545    HD1  TYR  67           HD1      TYR  67 -13.561  -9.490  -2.944
  546    HD2  TYR  67           HD2      TYR  67 -13.726  -5.407  -4.270
  547    HE1  TYR  67           HE1      TYR  67 -14.832 -10.194  -4.952
  548    HE2  TYR  67           HE2      TYR  67 -14.996  -6.113  -6.281
  549    HH   TYR  67           HH       TYR  67 -16.199  -9.380  -6.642
  550    HA   PRO  68           HA       PRO  68 -12.581  -5.339   2.569
  551    HB2  PRO  68           HB2      PRO  68 -13.305  -6.900   4.653
  552    HB3  PRO  68           HB1      PRO  68 -14.477  -5.888   3.784
  553    HG2  PRO  68           HG2      PRO  68 -14.009  -8.822   3.597
  554    HG3  PRO  68           HG1      PRO  68 -15.525  -7.913   3.493
  555    HD2  PRO  68           HD2      PRO  68 -14.070  -8.889   1.298
  556    HD3  PRO  68           HD1      PRO  68 -15.318  -7.627   1.214
  557    H    PHE  69           HN       PHE  69 -10.597  -5.394   3.622
  558    HA   PHE  69           HA       PHE  69  -9.255  -7.985   4.050
  559    HB2  PHE  69           HB2      PHE  69  -7.265  -7.375   2.765
  560    HB3  PHE  69           HB1      PHE  69  -8.674  -7.374   1.707
  561    HD1  PHE  69           HD2      PHE  69  -9.629  -5.286   0.868
  562    HD2  PHE  69           HD1      PHE  69  -6.160  -5.292   3.402
  563    HE1  PHE  69           HE2      PHE  69  -9.171  -2.929   0.248
  564    HE2  PHE  69           HE1      PHE  69  -5.702  -2.935   2.778
  565    HZ   PHE  69           HZ       PHE  69  -7.206  -1.754   1.201
  566    H    ILE  70           HN       ILE  70  -7.323  -7.763   5.355
  567    HA   ILE  70           HA       ILE  70  -7.153  -5.170   6.854
  568    HB   ILE  70           HB       ILE  70  -7.077  -7.977   8.003
  569   HG12  ILE  70          HG12      ILE  70  -9.062  -5.737   8.478
  570   HG13  ILE  70          HG11      ILE  70  -9.334  -7.040   7.325
  571   HG21  ILE  70          HG21      ILE  70  -6.587  -5.228   9.169
  572   HG22  ILE  70          HG22      ILE  70  -5.580  -6.669   9.300
  573   HG23  ILE  70          HG23      ILE  70  -7.103  -6.577  10.181
  574   HD11  ILE  70          HD11      ILE  70 -10.293  -7.316   9.724
  575   HD12  ILE  70          HD12      ILE  70  -8.628  -7.647  10.194
  576   HD13  ILE  70          HD13      ILE  70  -9.432  -8.679   9.014
  577    H    LEU  71           HN       LEU  71  -5.092  -4.603   7.550
  578    HA   LEU  71           HA       LEU  71  -2.838  -6.172   6.347
  579    HB2  LEU  71           HB2      LEU  71  -2.892  -3.276   7.253
  580    HB3  LEU  71           HB1      LEU  71  -1.616  -4.073   6.330
  581    HG   LEU  71           HG       LEU  71  -4.465  -3.583   5.413
  582   HD11  LEU  71          HD11      LEU  71  -2.730  -1.669   5.443
  583   HD12  LEU  71          HD12      LEU  71  -3.571  -1.979   3.925
  584   HD13  LEU  71          HD13      LEU  71  -1.921  -2.558   4.153
  585   HD21  LEU  71          HD21      LEU  71  -2.204  -5.210   4.263
  586   HD22  LEU  71          HD22      LEU  71  -3.371  -4.445   3.188
  587   HD23  LEU  71          HD23      LEU  71  -3.915  -5.615   4.381
  588    H    TYR  72           HN       TYR  72  -1.268  -6.968   7.658
  589    HA   TYR  72           HA       TYR  72  -1.378  -6.267  10.573
  590    HB2  TYR  72           HB2      TYR  72  -0.929  -8.944   9.247
  591    HB3  TYR  72           HB1      TYR  72  -0.622  -8.635  10.956
  592    HD1  TYR  72           HD2      TYR  72  -2.495  -7.955  12.462
  593    HD2  TYR  72           HD1      TYR  72  -3.157  -9.190   8.405
  594    HE1  TYR  72           HE2      TYR  72  -4.898  -8.310  12.963
  595    HE2  TYR  72           HE1      TYR  72  -5.559  -9.549   8.904
  596    HH   TYR  72           HH       TYR  72  -6.782  -9.595  12.093
  597    H    TYR  73           HN       TYR  73   0.529  -5.835  11.553
  598    HA   TYR  73           HA       TYR  73   3.073  -6.580  10.266
  599    HB2  TYR  73           HB2      TYR  73   2.527  -4.394   9.232
  600    HB3  TYR  73           HB1      TYR  73   2.383  -3.685  10.840
  601    HD1  TYR  73           HD2      TYR  73   4.757  -5.573   8.657
  602    HD2  TYR  73           HD1      TYR  73   4.298  -2.841  11.941
  603    HE1  TYR  73           HE2      TYR  73   7.214  -5.244   8.728
  604    HE2  TYR  73           HE1      TYR  73   6.756  -2.514  12.011
  605    HH   TYR  73           HH       TYR  73   8.824  -3.969  11.273
  606    H    GLN  74           HN       GLN  74   4.178  -7.443  11.907
  607    HA   GLN  74           HA       GLN  74   5.017  -7.852  14.040
  608    HB2  GLN  74           HB2      GLN  74   4.628  -4.851  14.230
  609    HB3  GLN  74           HB1      GLN  74   5.480  -5.818  15.436
  610    HG2  GLN  74           HG2      GLN  74   7.055  -6.602  13.723
  611    HG3  GLN  74           HG1      GLN  74   6.195  -5.676  12.493
  612   HE21  GLN  74          HE21      GLN  74   9.039  -5.396  13.612
  613   HE22  GLN  74          HE22      GLN  74   9.145  -3.767  14.077
  614    H    LYS  75           HN       LYS  75   2.739  -8.909  14.114
  615    HA   LYS  75           HA       LYS  75   0.701  -9.294  15.230
  616    HB2  LYS  75           HB2      LYS  75   2.626  -8.563  17.451
  617    HB3  LYS  75           HB1      LYS  75   1.043  -9.295  17.727
  618    HG2  LYS  75           HG2      LYS  75   1.681 -11.198  16.274
  619    HG3  LYS  75           HG1      LYS  75   3.278 -10.483  16.055
  620    HD2  LYS  75           HD2      LYS  75   2.089 -11.285  18.729
  621    HD3  LYS  75           HD1      LYS  75   3.260 -12.238  17.822
  622    HE2  LYS  75           HE2      LYS  75   4.749 -11.088  19.158
  623    HE3  LYS  75           HE1      LYS  75   4.590  -9.868  17.895
  624    HZ1  LYS  75           HZ1      LYS  75   4.085  -8.618  19.700
  625    HZ2  LYS  75           HZ2      LYS  75   3.466  -9.924  20.592
  626    HZ3  LYS  75           HZ3      LYS  75   2.527  -9.205  19.372
  627    H    GLN  76           HN       GLN  76   0.685  -6.725  14.119
  628    HA   GLN  76           HA       GLN  76  -1.264  -5.446  15.875
  629    HB2  GLN  76           HB2      GLN  76   0.822  -4.509  16.782
  630    HB3  GLN  76           HB1      GLN  76   1.295  -3.979  15.165
  631    HG2  GLN  76           HG2      GLN  76  -0.589  -2.473  15.034
  632    HG3  GLN  76           HG1      GLN  76  -1.265  -3.112  16.533
  633   HE21  GLN  76          HE21      GLN  76  -0.653  -0.331  16.250
  634   HE22  GLN  76          HE22      GLN  76   0.635   0.042  17.290
  635    H    LEU  77           HN       LEU  77  -2.832  -4.740  14.569
  636    HA   LEU  77           HA       LEU  77  -2.700  -4.854  11.755
  637    HB2  LEU  77           HB2      LEU  77  -4.858  -3.870  11.723
  638    HB3  LEU  77           HB1      LEU  77  -4.786  -4.887  13.154
  639    HG   LEU  77           HG       LEU  77  -4.088  -1.952  13.421
  640   HD11  LEU  77          HD11      LEU  77  -6.414  -1.399  13.802
  641   HD12  LEU  77          HD12      LEU  77  -6.892  -3.061  13.450
  642   HD13  LEU  77          HD13      LEU  77  -6.215  -2.049  12.170
  643   HD21  LEU  77          HD21      LEU  77  -5.369  -4.010  15.239
  644   HD22  LEU  77          HD22      LEU  77  -5.074  -2.328  15.671
  645   HD23  LEU  77          HD23      LEU  77  -3.717  -3.404  15.351
  646    H    ILE  78           HN       ILE  78  -3.037  -3.005  10.243
  647    HA   ILE  78           HA       ILE  78  -1.576  -0.530  11.106
  648    HB   ILE  78           HB       ILE  78  -1.306  -2.049   8.498
  649   HG12  ILE  78          HG12      ILE  78  -0.042  -3.048  10.351
  650   HG13  ILE  78          HG11      ILE  78   1.051  -2.305   9.191
  651   HG21  ILE  78          HG21      ILE  78  -1.176   0.224   7.888
  652   HG22  ILE  78          HG22      ILE  78   0.506  -0.249   8.125
  653   HG23  ILE  78          HG23      ILE  78  -0.334   0.668   9.374
  654   HD11  ILE  78          HD11      ILE  78   0.430  -1.497  11.996
  655   HD12  ILE  78          HD12      ILE  78   0.745  -0.197  10.855
  656   HD13  ILE  78          HD13      ILE  78   1.957  -1.438  11.130
  657    H    ALA  79           HN       ALA  79  -3.882  -1.987   8.804
  658    HA   ALA  79           HA       ALA  79  -5.517   0.425   8.962
  659    HB1  ALA  79           HB1      ALA  79  -4.428  -0.286   6.234
  660    HB2  ALA  79           HB2      ALA  79  -3.673   0.937   7.256
  661    HB3  ALA  79           HB3      ALA  79  -5.335   1.148   6.704
  662    H    ILE  80           HN       ILE  80  -7.595   0.128   7.963
  663    HA   ILE  80           HA       ILE  80  -8.171  -2.647   6.985
  664    HB   ILE  80           HB       ILE  80  -9.815  -1.057   8.982
  665   HG12  ILE  80          HG12      ILE  80  -8.344  -3.689   9.303
  666   HG13  ILE  80          HG11      ILE  80  -7.707  -2.140   9.847
  667   HG21  ILE  80          HG21      ILE  80 -10.228  -3.708   7.577
  668   HG22  ILE  80          HG22      ILE  80 -11.294  -2.304   7.558
  669   HG23  ILE  80          HG23      ILE  80 -11.115  -3.254   9.032
  670   HD11  ILE  80          HD11      ILE  80  -8.781  -3.205  11.734
  671   HD12  ILE  80          HD12      ILE  80 -10.243  -3.499  10.793
  672   HD13  ILE  80          HD13      ILE  80  -9.792  -1.852  11.229
  673    H    GLY  81           HN       GLY  81  -9.637  -2.710   5.258
  674    HA2  GLY  81           HA2      GLY  81 -11.417  -0.495   4.687
  675    HA3  GLY  81           HA1      GLY  81  -9.992  -0.436   3.651
  676    H    PHE  82           HN       PHE  82 -12.166  -0.738   2.225
  677    HA   PHE  82           HA       PHE  82 -12.021  -3.539   1.290
  678    HB2  PHE  82           HB2      PHE  82 -14.453  -3.832   1.243
  679    HB3  PHE  82           HB1      PHE  82 -13.940  -3.505   2.896
  680    HD1  PHE  82           HD2      PHE  82 -14.351  -1.321   3.940
  681    HD2  PHE  82           HD1      PHE  82 -15.777  -2.221  -0.011
  682    HE1  PHE  82           HE2      PHE  82 -15.889   0.618   4.055
  683    HE2  PHE  82           HE1      PHE  82 -17.319  -0.280   0.105
  684    HZ   PHE  82           HZ       PHE  82 -17.375   1.138   2.139
  685    H    ILE  83           HN       ILE  83 -12.932  -3.769  -0.898
  686    HA   ILE  83           HA       ILE  83 -12.946  -1.149  -2.369
  687    HB   ILE  83           HB       ILE  83 -12.035  -3.883  -3.296
  688   HG12  ILE  83          HG12      ILE  83 -10.470  -1.320  -2.908
  689   HG13  ILE  83          HG11      ILE  83 -10.541  -2.606  -1.702
  690   HG21  ILE  83          HG21      ILE  83 -13.011  -2.752  -5.160
  691   HG22  ILE  83          HG22      ILE  83 -11.270  -2.510  -5.300
  692   HG23  ILE  83          HG23      ILE  83 -12.294  -1.212  -4.686
  693   HD11  ILE  83          HD11      ILE  83  -8.540  -2.682  -3.273
  694   HD12  ILE  83          HD12      ILE  83  -9.675  -3.094  -4.559
  695   HD13  ILE  83          HD13      ILE  83  -9.485  -4.167  -3.173
  696    H    ASP  84           HN       ASP  84 -14.783  -0.668  -3.422
  697    HA   ASP  84           HA       ASP  84 -16.822  -2.834  -3.820
  698    HB2  ASP  84           HB2      ASP  84 -17.357  -0.882  -2.284
  699    HB3  ASP  84           HB1      ASP  84 -17.294   0.153  -3.710
  700    H    GLU  85           HN       GLU  85 -18.463  -1.728  -5.632
  701    HA   GLU  85           HA       GLU  85 -17.421  -2.262  -8.112
  702    HB2  GLU  85           HB2      GLU  85 -19.265  -0.952  -9.052
  703    HB3  GLU  85           HB1      GLU  85 -19.815  -1.885  -7.662
  704    HG2  GLU  85           HG2      GLU  85 -19.518   0.137  -6.230
  705    HG3  GLU  85           HG1      GLU  85 -19.084   1.059  -7.670
  706    H    ASN  86           HN       ASN  86 -16.723  -0.962  -9.855
  707    HA   ASN  86           HA       ASN  86 -15.416   0.683 -10.880
  708    HB2  ASN  86           HB2      ASN  86 -17.218   2.185  -9.744
  709    HB3  ASN  86           HB1      ASN  86 -15.972   2.519  -8.541
  710   HD21  ASN  86          HD21      ASN  86 -17.057   3.276 -11.753
  711   HD22  ASN  86          HD22      ASN  86 -15.763   4.291 -12.174
  712    H    HIS  87           HN       HIS  87 -14.686  -1.075  -8.398
  713    HA   HIS  87           HA       HIS  87 -12.792  -1.496  -7.103
  714    HB2  HIS  87           HB2      HIS  87 -11.852  -1.731  -9.378
  715    HB3  HIS  87           HB1      HIS  87 -11.452  -0.014  -9.382
  716    HD1  HIS  87           HD1      HIS  87 -10.599  -3.222  -7.531
  717    HD2  HIS  87           HD2      HIS  87  -9.067   0.619  -8.069
  718    HE1  HIS  87           HE1      HIS  87  -8.303  -3.209  -6.460
  719    H    ASP  88           HN       ASP  88 -14.208   0.688  -6.183
  720    HA   ASP  88           HA       ASP  88 -12.365   2.937  -5.749
  721    HB2  ASP  88           HB2      ASP  88 -15.171   2.297  -4.817
  722    HB3  ASP  88           HB1      ASP  88 -14.287   3.706  -4.230
  723    H    MET  89           HN       MET  89 -10.889   2.948  -4.155
  724    HA   MET  89           HA       MET  89 -10.898   0.857  -2.106
  725    HB2  MET  89           HB2      MET  89  -8.838   1.791  -3.282
  726    HB3  MET  89           HB1      MET  89  -9.057   3.249  -2.318
  727    HG2  MET  89           HG2      MET  89  -7.505   1.886  -1.111
  728    HG3  MET  89           HG1      MET  89  -9.042   1.752  -0.263
  729    HE1  MET  89           HE1      MET  89  -6.777  -1.215  -2.799
  730    HE2  MET  89           HE2      MET  89  -6.768   0.545  -2.862
  731    HE3  MET  89           HE3      MET  89  -7.991  -0.355  -3.754
  732    H    ASP  90           HN       ASP  90 -12.042   1.089  -0.258
  733    HA   ASP  90           HA       ASP  90 -12.678   3.839   0.744
  734    HB2  ASP  90           HB2      ASP  90 -13.990   1.146   1.182
  735    HB3  ASP  90           HB1      ASP  90 -14.437   2.600   2.076
  736    H    PHE  91           HN       PHE  91 -12.038   4.439   2.793
  737    HA   PHE  91           HA       PHE  91 -10.206   2.563   4.223
  738    HB2  PHE  91           HB2      PHE  91 -10.549   5.567   4.236
  739    HB3  PHE  91           HB1      PHE  91  -9.611   4.733   5.478
  740    HD1  PHE  91           HD2      PHE  91  -9.830   5.536   1.883
  741    HD2  PHE  91           HD1      PHE  91  -7.512   3.652   4.966
  742    HE1  PHE  91           HE2      PHE  91  -7.899   5.377   0.334
  743    HE2  PHE  91           HE1      PHE  91  -5.584   3.491   3.422
  744    HZ   PHE  91           HZ       PHE  91  -5.774   4.352   1.104
  745    H    LEU  92           HN       LEU  92 -10.879   1.630   6.047
  746    HA   LEU  92           HA       LEU  92 -13.386   2.588   7.343
  747    HB2  LEU  92           HB2      LEU  92 -13.192   0.175   6.761
  748    HB3  LEU  92           HB1      LEU  92 -11.756   0.059   7.777
  749    HG   LEU  92           HG       LEU  92 -13.111   0.751   9.747
  750   HD11  LEU  92          HD11      LEU  92 -14.908   2.014   8.994
  751   HD12  LEU  92          HD12      LEU  92 -15.701   0.469   9.273
  752   HD13  LEU  92          HD13      LEU  92 -15.245   0.941   7.637
  753   HD21  LEU  92          HD21      LEU  92 -14.472  -1.357   9.873
  754   HD22  LEU  92          HD22      LEU  92 -12.804  -1.614   9.361
  755   HD23  LEU  92          HD23      LEU  92 -14.106  -1.635   8.170
  756    H    TYR  93           HN       TYR  93 -10.228   1.306   8.353
  757    HA   TYR  93           HA       TYR  93 -10.066   3.383  10.499
  758    HB2  TYR  93           HB2      TYR  93 -10.958   1.208  11.395
  759    HB3  TYR  93           HB1      TYR  93  -9.488   0.423  10.828
  760    HD1  TYR  93           HD1      TYR  93 -10.732   3.146  13.057
  761    HD2  TYR  93           HD2      TYR  93  -7.525   0.436  12.151
  762    HE1  TYR  93           HE1      TYR  93  -9.603   3.774  15.171
  763    HE2  TYR  93           HE2      TYR  93  -6.397   1.063  14.268
  764    HH   TYR  93           HH       TYR  93  -7.961   2.822  16.730
  765    H    LEU  94           HN       LEU  94  -8.059   4.359  10.363
  766    HA   LEU  94           HA       LEU  94  -5.865   2.832   8.987
  767    HB2  LEU  94           HB2      LEU  94  -6.590   4.726   7.639
  768    HB3  LEU  94           HB1      LEU  94  -6.418   5.812   9.016
  769    HG   LEU  94           HG       LEU  94  -4.002   5.440   9.065
  770   HD11  LEU  94          HD11      LEU  94  -3.656   3.202   8.422
  771   HD12  LEU  94          HD12      LEU  94  -3.062   4.096   7.026
  772   HD13  LEU  94          HD13      LEU  94  -4.663   3.360   6.984
  773   HD21  LEU  94          HD21      LEU  94  -3.427   6.589   7.057
  774   HD22  LEU  94          HD22      LEU  94  -5.076   7.089   7.430
  775   HD23  LEU  94          HD23      LEU  94  -4.782   5.883   6.177
  776    H    HIS  95           HN       HIS  95  -4.122   2.405  10.195
  777    HA   HIS  95           HA       HIS  95  -3.391   4.251  12.416
  778    HB2  HIS  95           HB2      HIS  95  -4.695   2.385  13.403
  779    HB3  HIS  95           HB1      HIS  95  -3.556   1.234  12.703
  780    HD1  HIS  95           HD1      HIS  95  -1.085   1.294  13.630
  781    HD2  HIS  95           HD2      HIS  95  -3.776   3.700  15.715
  782    HE1  HIS  95           HE1      HIS  95   0.062   1.943  15.793
  783    H    ASN  96           HN       ASN  96  -1.448   4.944  11.658
  784    HA   ASN  96           HA       ASN  96   0.380   3.024  10.312
  785    HB2  ASN  96           HB2      ASN  96  -0.047   5.228   9.263
  786    HB3  ASN  96           HB1      ASN  96   0.594   6.027  10.698
  787   HD21  ASN  96          HD21      ASN  96   1.495   3.980   7.924
  788   HD22  ASN  96          HD22      ASN  96   3.164   4.273   8.038
  789    H    THR  97           HN       THR  97   2.797   3.493  10.909
  790    HA   THR  97           HA       THR  97   3.318   2.561  13.499
  791    HB   THR  97           HB       THR  97   5.649   3.318  13.105
  792    HG1  THR  97           HG1      THR  97   4.310   4.796  11.137
  793   HG21  THR  97          HG21      THR  97   5.994   2.030  11.044
  794   HG22  THR  97          HG22      THR  97   4.281   2.181  10.652
  795   HG23  THR  97          HG23      THR  97   4.782   1.248  12.062
  796    H    VAL  98           HN       VAL  98   2.571   3.593  15.275
  797    HA   VAL  98           HA       VAL  98   1.979   5.368  16.718
  798    HB   VAL  98           HB       VAL  98   4.266   4.722  17.347
  799   HG11  VAL  98          HG11      VAL  98   6.159   6.230  16.542
  800   HG12  VAL  98          HG12      VAL  98   5.069   6.790  15.278
  801   HG13  VAL  98          HG13      VAL  98   5.529   5.091  15.357
  802   HG21  VAL  98          HG21      VAL  98   4.501   6.466  18.836
  803   HG22  VAL  98          HG22      VAL  98   2.937   6.944  18.185
  804   HG23  VAL  98          HG23      VAL  98   4.411   7.703  17.585
  805    H    MET  99           HN       MET  99   1.468   6.025  13.915
  806    HA   MET  99           HA       MET  99   1.422   8.965  14.222
  807    HB2  MET  99           HB2      MET  99   3.561   8.321  12.993
  808    HB3  MET  99           HB1      MET  99   2.533   7.699  11.703
  809    HG2  MET  99           HG2      MET  99   1.651   9.848  11.215
  810    HG3  MET  99           HG1      MET  99   2.232  10.524  12.735
  811    HE1  MET  99           HE1      MET  99   4.720   9.208   9.135
  812    HE2  MET  99           HE2      MET  99   3.127   8.655   9.645
  813    HE3  MET  99           HE3      MET  99   4.563   8.084  10.494
  814    HA   PRO 100           HA       PRO 100  -2.205   6.745  12.137
  815    HB2  PRO 100           HB2      PRO 100  -4.086   7.260  14.068
  816    HB3  PRO 100           HB1      PRO 100  -3.044   5.824  14.092
  817    HG2  PRO 100           HG2      PRO 100  -2.732   8.400  15.577
  818    HG3  PRO 100           HG1      PRO 100  -2.530   6.734  16.159
  819    HD2  PRO 100           HD2      PRO 100  -0.402   8.278  15.485
  820    HD3  PRO 100           HD1      PRO 100  -0.405   6.520  15.220
  821    H    LEU 101           HN       LEU 101  -3.689   7.845  10.881
  822    HA   LEU 101           HA       LEU 101  -3.779  10.822  11.164
  823    HB2  LEU 101           HB2      LEU 101  -4.650   9.086   8.831
  824    HB3  LEU 101           HB1      LEU 101  -4.448  10.837   8.832
  825    HG   LEU 101           HG       LEU 101  -2.220   8.831   9.290
  826   HD11  LEU 101          HD11      LEU 101  -3.210   8.917   6.956
  827   HD12  LEU 101          HD12      LEU 101  -1.498   9.332   7.049
  828   HD13  LEU 101          HD13      LEU 101  -2.706  10.606   6.883
  829   HD21  LEU 101          HD21      LEU 101  -0.855  10.992   8.801
  830   HD22  LEU 101          HD22      LEU 101  -1.583  10.822  10.396
  831   HD23  LEU 101          HD23      LEU 101  -2.349  11.848   9.182
  832    H    LEU 102           HN       LEU 102  -5.877   8.055  10.320
  833    HA   LEU 102           HA       LEU 102  -8.213   9.557  11.470
  834    HB2  LEU 102           HB2      LEU 102  -8.197   7.464   9.279
  835    HB3  LEU 102           HB1      LEU 102  -9.592   8.386   9.842
  836    HG   LEU 102           HG       LEU 102  -7.098   9.570   8.587
  837   HD11  LEU 102          HD11      LEU 102  -8.720  10.150   6.735
  838   HD12  LEU 102          HD12      LEU 102  -9.888   9.081   7.514
  839   HD13  LEU 102          HD13      LEU 102  -8.370   8.429   6.894
  840   HD21  LEU 102          HD21      LEU 102  -7.908  11.276   9.970
  841   HD22  LEU 102          HD22      LEU 102  -9.587  10.758   9.806
  842   HD23  LEU 102          HD23      LEU 102  -8.787  11.597   8.478
  843    H    ASP 103           HN       ASP 103  -9.292   8.617  13.079
  844    HA   ASP 103           HA       ASP 103  -9.336   5.704  13.404
  845    HB2  ASP 103           HB2      ASP 103  -8.425   5.753  15.704
  846    HB3  ASP 103           HB1      ASP 103  -7.220   6.298  14.539
  847    H    GLN 104           HN       GLN 104 -11.584   6.595  12.887
  848    HA   GLN 104           HA       GLN 104 -12.925   7.797  15.269
  849    HB2  GLN 104           HB2      GLN 104 -13.750   7.517  12.370
  850    HB3  GLN 104           HB1      GLN 104 -14.856   8.060  13.636
  851    HG2  GLN 104           HG2      GLN 104 -13.354   9.911  14.193
  852    HG3  GLN 104           HG1      GLN 104 -12.193   9.357  12.986
  853   HE21  GLN 104          HE21      GLN 104 -14.701  11.542  13.445
  854   HE22  GLN 104          HE22      GLN 104 -15.141  11.786  11.824
  855    H    ARG 105           HN       ARG 105 -13.858   6.417  16.622
  856    HA   ARG 105           HA       ARG 105 -14.282   3.630  16.076
  857    HB2  ARG 105           HB2      ARG 105 -15.445   5.422  18.233
  858    HB3  ARG 105           HB1      ARG 105 -15.485   3.662  18.255
  859    HG2  ARG 105           HG2      ARG 105 -12.873   5.158  18.007
  860    HG3  ARG 105           HG1      ARG 105 -13.602   4.855  19.582
  861    HD2  ARG 105           HD2      ARG 105 -13.654   2.413  19.035
  862    HD3  ARG 105           HD1      ARG 105 -12.782   2.758  17.546
  863    HE   ARG 105           HE       ARG 105 -11.671   2.893  20.277
  864   HH11  ARG 105          HH21      ARG 105 -11.362   3.583  16.902
  865   HH12  ARG 105          HH22      ARG 105  -9.639   3.730  16.966
  866   HH21  ARG 105          HH11      ARG 105  -9.433   3.081  20.360
  867   HH22  ARG 105          HH12      ARG 105  -8.548   3.447  18.916
  868    H    TYR 106           HN       TYR 106 -16.410   6.457  15.981
  869    HA   TYR 106           HA       TYR 106 -18.886   5.080  15.736
  870    HB2  TYR 106           HB2      TYR 106 -18.098   7.700  14.422
  871    HB3  TYR 106           HB1      TYR 106 -19.737   7.158  14.788
  872    HD1  TYR 106           HD2      TYR 106 -20.458   6.883  17.179
  873    HD2  TYR 106           HD1      TYR 106 -16.698   8.660  16.105
  874    HE1  TYR 106           HE2      TYR 106 -20.258   7.839  19.458
  875    HE2  TYR 106           HE1      TYR 106 -16.495   9.616  18.381
  876    HH   TYR 106           HH       TYR 106 -19.049   9.093  20.825
  877    H    LEU 107           HN       LEU 107 -16.566   6.160  13.263
  878    HA   LEU 107           HA       LEU 107 -18.074   5.237  11.012
  879    HB2  LEU 107           HB2      LEU 107 -16.191   6.818  10.796
  880    HB3  LEU 107           HB1      LEU 107 -15.073   5.570  11.339
  881    HG   LEU 107           HG       LEU 107 -15.634   4.194   9.375
  882   HD11  LEU 107          HD11      LEU 107 -17.631   6.395   8.912
  883   HD12  LEU 107          HD12      LEU 107 -17.840   4.650   8.774
  884   HD13  LEU 107          HD13      LEU 107 -16.961   5.530   7.529
  885   HD21  LEU 107          HD21      LEU 107 -13.767   5.675   9.091
  886   HD22  LEU 107          HD22      LEU 107 -14.826   7.060   8.826
  887   HD23  LEU 107          HD23      LEU 107 -14.724   5.783   7.613
  888    H    LEU 108           HN       LEU 108 -15.612   3.694  13.053
  889    HA   LEU 108           HA       LEU 108 -15.288   1.326  11.516
  890    HB2  LEU 108           HB2      LEU 108 -14.034   2.265  13.663
  891    HB3  LEU 108           HB1      LEU 108 -15.174   1.239  14.529
  892    HG   LEU 108           HG       LEU 108 -13.281   0.340  12.339
  893   HD11  LEU 108          HD11      LEU 108 -13.277  -0.389  15.277
  894   HD12  LEU 108          HD12      LEU 108 -12.284   0.902  14.598
  895   HD13  LEU 108          HD13      LEU 108 -12.042  -0.764  14.073
  896   HD21  LEU 108          HD21      LEU 108 -15.485  -1.049  13.855
  897   HD22  LEU 108          HD22      LEU 108 -14.087  -1.970  13.300
  898   HD23  LEU 108          HD23      LEU 108 -15.099  -1.122  12.137
  899    H    THR 109           HN       THR 109 -17.523   2.029  14.213
  900    HA   THR 109           HA       THR 109 -18.960  -0.535  13.667
  901    HB   THR 109           HB       THR 109 -20.154   0.122  15.840
  902    HG1  THR 109           HG1      THR 109 -19.610   2.289  15.872
  903   HG21  THR 109          HG21      THR 109 -17.168  -0.386  15.773
  904   HG22  THR 109          HG22      THR 109 -18.454  -1.588  15.886
  905   HG23  THR 109          HG23      THR 109 -18.141  -0.501  17.239
  906    H    GLY 110           HN       GLY 110 -19.016   2.423  12.432
  907    HA2  GLY 110           HA2      GLY 110 -21.583   3.504  12.772
  908    HA3  GLY 110           HA1      GLY 110 -20.642   3.659  11.292
  909    H    GLY 111           HN       GLY 111 -23.506   3.341  11.485
  910    HA2  GLY 111           HA2      GLY 111 -23.941   1.385   9.447
  911    HA3  GLY 111           HA1      GLY 111 -24.466   0.727  11.001
  912    H    GLN 112           HN       GLN 112 -25.235   3.297  12.105
  913    HA   GLN 112           HA       GLN 112 -27.248   4.474  12.340
  914    HB2  GLN 112           HB2      GLN 112 -26.096   5.804  10.580
  915    HB3  GLN 112           HB1      GLN 112 -26.879   4.813   9.348
  916    HG2  GLN 112           HG2      GLN 112 -29.074   5.544  10.064
  917    HG3  GLN 112           HG1      GLN 112 -28.387   6.388  11.451
  918   HE21  GLN 112          HE21      GLN 112 -29.965   7.731   9.431
  919   HE22  GLN 112          HE22      GLN 112 -28.950   8.831   8.629
  920    H    LEU 113           HN       LEU 113 -28.387   2.452  12.831
  921    HA   LEU 113           HA       LEU 113 -30.023   1.314  10.623
  922    HB2  LEU 113           HB2      LEU 113 -29.769   0.469  13.527
  923    HB3  LEU 113           HB1      LEU 113 -30.614  -0.419  12.258
  924    HG   LEU 113           HG       LEU 113 -27.648   0.228  12.278
  925   HD11  LEU 113          HD11      LEU 113 -27.504  -2.316  12.475
  926   HD12  LEU 113          HD12      LEU 113 -29.219  -2.286  12.885
  927   HD13  LEU 113          HD13      LEU 113 -28.052  -1.461  13.918
  928   HD21  LEU 113          HD21      LEU 113 -28.189   0.072  10.000
  929   HD22  LEU 113          HD22      LEU 113 -29.484  -1.092  10.280
  930   HD23  LEU 113          HD23      LEU 113 -27.801  -1.603  10.381
  931    H    GLU 114           HN       GLU 114 -32.162   1.728  10.425
  932    HA   GLU 114           HA       GLU 114 -33.608   3.082  12.671
  933    HB2  GLU 114           HB2      GLU 114 -33.554   3.893   9.746
  934    HB3  GLU 114           HB1      GLU 114 -34.732   4.500  10.909
  935    HG2  GLU 114           HG2      GLU 114 -32.934   5.435  12.286
  936    HG3  GLU 114           HG1      GLU 114 -31.724   4.766  11.191
  937    H    HIS 115           HN       HIS 115 -33.601   0.981   9.882
  938    HA   HIS 115           HA       HIS 115 -36.437   0.530   9.730
  939    HB2  HIS 115           HB2      HIS 115 -34.041  -1.098   8.851
  940    HB3  HIS 115           HB1      HIS 115 -35.700  -1.620   8.564
  941    HD1  HIS 115           HD1      HIS 115 -33.291   1.162   7.684
  942    HD2  HIS 115           HD2      HIS 115 -37.016  -0.269   6.480
  943    HE1  HIS 115           HE1      HIS 115 -33.899   2.431   5.579
  944    H    HIS 116           HN       HIS 116 -33.818  -1.065  11.542
  945    HA   HIS 116           HA       HIS 116 -35.843  -2.171  13.390
  946    HB2  HIS 116           HB2      HIS 116 -35.609  -3.908  11.627
  947    HB3  HIS 116           HB1      HIS 116 -33.873  -3.968  11.939
  948    HD1  HIS 116           HD1      HIS 116 -33.103  -5.435  13.838
  949    HD2  HIS 116           HD2      HIS 116 -37.207  -4.716  13.986
  950    HE1  HIS 116           HE1      HIS 116 -34.020  -6.896  15.693
  951    H    HIS 117           HN       HIS 117 -34.748  -3.212  15.304
  952    HA   HIS 117           HA       HIS 117 -31.902  -2.545  15.679
  953    HB2  HIS 117           HB2      HIS 117 -32.395  -1.242  17.770
  954    HB3  HIS 117           HB1      HIS 117 -32.913  -0.428  16.295
  955    HD1  HIS 117           HD1      HIS 117 -34.217  -2.065  19.389
  956    HD2  HIS 117           HD2      HIS 117 -35.759  -0.346  15.918
  957    HE1  HIS 117           HE1      HIS 117 -36.694  -1.729  19.796
  958    H    HIS 118           HN       HIS 118 -31.021  -3.574  17.587
  959    HA   HIS 118           HA       HIS 118 -32.405  -6.061  18.248
  960    HB2  HIS 118           HB2      HIS 118 -29.765  -4.880  19.140
  961    HB3  HIS 118           HB1      HIS 118 -30.341  -6.475  19.627
  962    HD1  HIS 118           HD1      HIS 118 -27.850  -6.663  18.080
  963    HD2  HIS 118           HD2      HIS 118 -31.522  -6.342  16.130
  964    HE1  HIS 118           HE1      HIS 118 -27.504  -7.564  15.739
  965    H    HIS 119           HN       HIS 119 -33.236  -6.656  20.244
  966    HA   HIS 119           HA       HIS 119 -34.282  -4.541  21.903
  967    HB2  HIS 119           HB2      HIS 119 -35.252  -6.336  23.224
  968    HB3  HIS 119           HB1      HIS 119 -35.420  -6.730  21.514
  969    HD1  HIS 119           HD1      HIS 119 -33.984  -7.981  24.660
  970    HD2  HIS 119           HD2      HIS 119 -33.421  -8.695  20.591
  971    HE1  HIS 119           HE1      HIS 119 -32.720 -10.168  24.485
  972    H    HIS 120           HN       HIS 120 -33.598  -3.826  23.903
  973    HA   HIS 120           HA       HIS 120 -31.603  -5.212  25.477
  974    HB2  HIS 120           HB2      HIS 120 -29.766  -3.648  25.226
  975    HB3  HIS 120           HB1      HIS 120 -30.200  -4.241  23.624
  976    HD1  HIS 120           HD1      HIS 120 -31.663  -2.595  22.115
  977    HD2  HIS 120           HD2      HIS 120 -30.075  -0.887  25.570
  978    HE1  HIS 120           HE1      HIS 120 -31.848  -0.086  21.825
  Start of MODEL   20
    1    H1   MET   1           HT1      MET   1  -7.295  -7.339  19.013
    2    H2   MET   1           HT2      MET   1  -6.377  -8.438  19.927
    3    H3   MET   1           HT3      MET   1  -7.908  -7.946  20.472
    4    HA   MET   1           HA       MET   1  -7.629  -9.301  17.874
    5    HB2  MET   1           HB2      MET   1  -8.294 -11.397  19.283
    6    HB3  MET   1           HB1      MET   1  -6.596 -10.924  19.241
    7    HG2  MET   1           HG2      MET   1  -6.845  -9.742  21.375
    8    HG3  MET   1           HG1      MET   1  -8.563 -10.139  21.412
    9    HE1  MET   1           HE1      MET   1  -7.564 -12.391  24.204
   10    HE2  MET   1           HE2      MET   1  -8.194 -10.837  23.664
   11    HE3  MET   1           HE3      MET   1  -6.460 -11.044  23.897
   12    H    THR   2           HN       THR   2  -9.281  -7.181  19.285
   13    HA   THR   2           HA       THR   2 -11.963  -8.517  19.093
   14    HB   THR   2           HB       THR   2 -11.937  -7.713  21.282
   15    HG1  THR   2           HG1      THR   2 -12.649  -5.263  20.792
   16   HG21  THR   2          HG21      THR   2  -9.698  -6.768  21.257
   17   HG22  THR   2          HG22      THR   2 -10.808  -5.569  21.920
   18   HG23  THR   2          HG23      THR   2 -10.241  -5.420  20.256
   19    H    LEU   3           HN       LEU   3  -9.827  -6.106  17.900
   20    HA   LEU   3           HA       LEU   3 -11.722  -4.302  16.736
   21    HB2  LEU   3           HB2      LEU   3  -9.283  -3.805  16.943
   22    HB3  LEU   3           HB1      LEU   3  -8.957  -5.028  15.718
   23    HG   LEU   3           HG       LEU   3 -10.323  -3.767  14.086
   24   HD11  LEU   3          HD11      LEU   3 -10.762  -1.278  14.906
   25   HD12  LEU   3          HD12      LEU   3 -10.818  -2.041  16.495
   26   HD13  LEU   3          HD13      LEU   3 -11.937  -2.550  15.230
   27   HD21  LEU   3          HD21      LEU   3  -8.010  -3.251  13.976
   28   HD22  LEU   3          HD22      LEU   3  -8.051  -2.342  15.486
   29   HD23  LEU   3          HD23      LEU   3  -8.800  -1.678  14.034
   30    H    GLU   4           HN       GLU   4 -10.185  -7.253  15.540
   31    HA   GLU   4           HA       GLU   4 -11.208  -7.192  12.880
   32    HB2  GLU   4           HB2      GLU   4  -9.433  -8.749  13.677
   33    HB3  GLU   4           HB1      GLU   4 -10.644  -9.601  14.635
   34    HG2  GLU   4           HG2      GLU   4 -11.887 -10.182  12.612
   35    HG3  GLU   4           HG1      GLU   4 -10.749  -9.267  11.624
   36    H    LEU   5           HN       LEU   5 -12.582  -8.425  15.903
   37    HA   LEU   5           HA       LEU   5 -14.897  -9.680  14.770
   38    HB2  LEU   5           HB2      LEU   5 -14.227  -8.551  17.484
   39    HB3  LEU   5           HB1      LEU   5 -15.853  -9.146  17.149
   40    HG   LEU   5           HG       LEU   5 -14.888 -11.329  16.464
   41   HD11  LEU   5          HD11      LEU   5 -12.703 -10.728  15.711
   42   HD12  LEU   5          HD12      LEU   5 -12.456 -11.692  17.166
   43   HD13  LEU   5          HD13      LEU   5 -12.318  -9.935  17.239
   44   HD21  LEU   5          HD21      LEU   5 -14.167 -10.266  19.211
   45   HD22  LEU   5          HD22      LEU   5 -14.066 -11.974  18.781
   46   HD23  LEU   5          HD23      LEU   5 -15.623 -11.148  18.750
   47    H    GLN   6           HN       GLN   6 -14.321  -6.370  15.933
   48    HA   GLN   6           HA       GLN   6 -17.006  -5.430  15.595
   49    HB2  GLN   6           HB2      GLN   6 -14.351  -3.975  15.501
   50    HB3  GLN   6           HB1      GLN   6 -15.912  -3.155  15.486
   51    HG2  GLN   6           HG2      GLN   6 -16.485  -4.192  17.647
   52    HG3  GLN   6           HG1      GLN   6 -14.933  -5.030  17.659
   53   HE21  GLN   6          HE21      GLN   6 -15.042  -3.553  19.826
   54   HE22  GLN   6          HE22      GLN   6 -14.272  -2.047  19.675
   55    H    LEU   7           HN       LEU   7 -14.260  -5.642  13.395
   56    HA   LEU   7           HA       LEU   7 -15.375  -4.121  11.258
   57    HB2  LEU   7           HB2      LEU   7 -12.996  -4.830  11.351
   58    HB3  LEU   7           HB1      LEU   7 -13.503  -6.499  11.105
   59    HG   LEU   7           HG       LEU   7 -14.514  -5.862   8.931
   60   HD11  LEU   7          HD11      LEU   7 -15.106  -3.619   9.011
   61   HD12  LEU   7          HD12      LEU   7 -13.608  -3.513   8.092
   62   HD13  LEU   7          HD13      LEU   7 -13.612  -3.138   9.816
   63   HD21  LEU   7          HD21      LEU   7 -11.590  -5.320   9.441
   64   HD22  LEU   7          HD22      LEU   7 -12.259  -5.216   7.812
   65   HD23  LEU   7          HD23      LEU   7 -12.341  -6.734   8.702
   66    H    LYS   8           HN       LYS   8 -15.590  -7.570  12.053
   67    HA   LYS   8           HA       LYS   8 -17.046  -8.386   9.735
   68    HB2  LYS   8           HB2      LYS   8 -17.006  -9.447  12.572
   69    HB3  LYS   8           HB1      LYS   8 -17.808 -10.273  11.236
   70    HG2  LYS   8           HG2      LYS   8 -15.716 -10.517  10.045
   71    HG3  LYS   8           HG1      LYS   8 -14.880  -9.494  11.209
   72    HD2  LYS   8           HD2      LYS   8 -14.327 -11.741  11.808
   73    HD3  LYS   8           HD1      LYS   8 -15.518 -11.205  12.991
   74    HE2  LYS   8           HE2      LYS   8 -17.271 -12.432  11.924
   75    HE3  LYS   8           HE1      LYS   8 -16.288 -12.726  10.490
   76    HZ1  LYS   8           HZ1      LYS   8 -16.431 -14.216  12.891
   77    HZ2  LYS   8           HZ2      LYS   8 -14.837 -13.690  12.631
   78    HZ3  LYS   8           HZ3      LYS   8 -15.639 -14.601  11.441
   79    H    HIS   9           HN       HIS   9 -18.126  -7.213  12.907
   80    HA   HIS   9           HA       HIS   9 -20.950  -7.456  12.370
   81    HB2  HIS   9           HB2      HIS   9 -19.411  -5.716  14.311
   82    HB3  HIS   9           HB1      HIS   9 -21.165  -5.884  14.314
   83    HD1  HIS   9           HD1      HIS   9 -21.845  -8.662  14.251
   84    HD2  HIS   9           HD2      HIS   9 -18.298  -7.484  16.098
   85    HE1  HIS   9           HE1      HIS   9 -21.187 -10.549  15.806
   86    H    TYR  10           HN       TYR  10 -18.645  -4.773  12.081
   87    HA   TYR  10           HA       TYR  10 -20.524  -2.751  11.358
   88    HB2  TYR  10           HB2      TYR  10 -18.225  -2.212  12.000
   89    HB3  TYR  10           HB1      TYR  10 -17.614  -3.066  10.582
   90    HD1  TYR  10           HD1      TYR  10 -19.687  -0.176  11.673
   91    HD2  TYR  10           HD2      TYR  10 -17.545  -2.021   8.440
   92    HE1  TYR  10           HE1      TYR  10 -19.976   1.875  10.311
   93    HE2  TYR  10           HE2      TYR  10 -17.832   0.032   7.079
   94    HH   TYR  10           HH       TYR  10 -18.366   2.266   7.213
   95    H    ILE  11           HN       ILE  11 -18.582  -4.926   9.320
   96    HA   ILE  11           HA       ILE  11 -19.503  -3.911   6.813
   97    HB   ILE  11           HB       ILE  11 -18.426  -6.621   7.616
   98   HG12  ILE  11          HG12      ILE  11 -17.122  -4.351   6.087
   99   HG13  ILE  11          HG11      ILE  11 -16.962  -4.565   7.831
  100   HG21  ILE  11          HG21      ILE  11 -19.626  -7.027   5.598
  101   HG22  ILE  11          HG22      ILE  11 -17.952  -6.791   5.100
  102   HG23  ILE  11          HG23      ILE  11 -19.123  -5.487   4.900
  103   HD11  ILE  11          HD11      ILE  11 -15.051  -5.586   6.679
  104   HD12  ILE  11          HD12      ILE  11 -16.145  -6.574   5.712
  105   HD13  ILE  11          HD13      ILE  11 -16.030  -6.835   7.450
  106    H    THR  12           HN       THR  12 -20.715  -6.595   8.827
  107    HA   THR  12           HA       THR  12 -22.734  -7.452   6.994
  108    HB   THR  12           HB       THR  12 -23.826  -8.404   9.083
  109    HG1  THR  12           HG1      THR  12 -22.197  -6.602  10.170
  110   HG21  THR  12          HG21      THR  12 -21.761  -9.858   9.615
  111   HG22  THR  12          HG22      THR  12 -20.934  -8.905   8.382
  112   HG23  THR  12          HG23      THR  12 -22.352  -9.863   7.954
  113    H    ASN  13           HN       ASN  13 -22.892  -5.167   9.716
  114    HA   ASN  13           HA       ASN  13 -25.686  -4.557   9.391
  115    HB2  ASN  13           HB2      ASN  13 -24.451  -4.077  11.468
  116    HB3  ASN  13           HB1      ASN  13 -23.452  -2.909  10.604
  117   HD21  ASN  13          HD21      ASN  13 -24.823  -1.872  12.738
  118   HD22  ASN  13          HD22      ASN  13 -26.151  -0.950  12.222
  119    H    LEU  14           HN       LEU  14 -22.719  -3.049   8.146
  120    HA   LEU  14           HA       LEU  14 -24.014  -0.819   6.918
  121    HB2  LEU  14           HB2      LEU  14 -21.595  -0.831   7.260
  122    HB3  LEU  14           HB1      LEU  14 -21.426  -2.208   6.175
  123    HG   LEU  14           HG       LEU  14 -22.206  -0.873   4.280
  124   HD11  LEU  14          HD11      LEU  14 -22.442   1.692   4.793
  125   HD12  LEU  14          HD12      LEU  14 -22.768   1.151   6.441
  126   HD13  LEU  14          HD13      LEU  14 -23.804   0.623   5.116
  127   HD21  LEU  14          HD21      LEU  14 -19.788  -0.765   4.986
  128   HD22  LEU  14          HD22      LEU  14 -20.160   0.730   5.843
  129   HD23  LEU  14          HD23      LEU  14 -20.337   0.653   4.091
  130    H    PHE  15           HN       PHE  15 -23.170  -4.027   5.615
  131    HA   PHE  15           HA       PHE  15 -24.642  -3.357   3.105
  132    HB2  PHE  15           HB2      PHE  15 -22.742  -5.586   3.872
  133    HB3  PHE  15           HB1      PHE  15 -23.664  -5.601   2.365
  134    HD1  PHE  15           HD1      PHE  15 -23.335  -3.802   0.677
  135    HD2  PHE  15           HD2      PHE  15 -20.874  -4.098   4.184
  136    HE1  PHE  15           HE1      PHE  15 -21.689  -2.262  -0.352
  137    HE2  PHE  15           HE2      PHE  15 -19.223  -2.559   3.153
  138    HZ   PHE  15           HZ       PHE  15 -19.632  -1.639   0.887
  139    H    ASN  16           HN       ASN  16 -25.304  -4.539   6.088
  140    HA   ASN  16           HA       ASN  16 -27.064  -5.801   6.976
  141    HB2  ASN  16           HB2      ASN  16 -28.280  -4.208   5.387
  142    HB3  ASN  16           HB1      ASN  16 -28.337  -5.548   4.241
  143   HD21  ASN  16          HD21      ASN  16 -30.712  -5.641   4.458
  144   HD22  ASN  16          HD22      ASN  16 -31.426  -6.303   5.849
  145    H    LEU  17           HN       LEU  17 -24.887  -7.256   5.947
  146    HA   LEU  17           HA       LEU  17 -26.051  -9.529   4.452
  147    HB2  LEU  17           HB2      LEU  17 -23.216  -9.069   5.413
  148    HB3  LEU  17           HB1      LEU  17 -23.731 -10.337   4.310
  149    HG   LEU  17           HG       LEU  17 -24.193  -7.405   3.735
  150   HD11  LEU  17          HD11      LEU  17 -21.852  -9.133   2.886
  151   HD12  LEU  17          HD12      LEU  17 -21.779  -7.770   4.004
  152   HD13  LEU  17          HD13      LEU  17 -22.182  -7.499   2.309
  153   HD21  LEU  17          HD21      LEU  17 -24.171  -8.366   1.351
  154   HD22  LEU  17          HD22      LEU  17 -25.562  -8.779   2.346
  155   HD23  LEU  17          HD23      LEU  17 -24.273  -9.957   2.103
  156    HA   PRO  18           HA       PRO  18 -26.741 -11.902   8.122
  157    HB2  PRO  18           HB2      PRO  18 -26.398 -14.464   7.146
  158    HB3  PRO  18           HB1      PRO  18 -27.840 -13.474   6.839
  159    HG2  PRO  18           HG2      PRO  18 -25.467 -13.948   5.088
  160    HG3  PRO  18           HG1      PRO  18 -27.188 -13.886   4.661
  161    HD2  PRO  18           HD2      PRO  18 -25.524 -11.788   4.219
  162    HD3  PRO  18           HD1      PRO  18 -27.235 -11.558   4.630
  163    H    ARG  19           HN       ARG  19 -25.602 -12.775   9.820
  164    HA   ARG  19           HA       ARG  19 -22.678 -12.785   9.643
  165    HB2  ARG  19           HB2      ARG  19 -24.642 -13.321  11.881
  166    HB3  ARG  19           HB1      ARG  19 -22.895 -13.426  12.097
  167    HG2  ARG  19           HG2      ARG  19 -22.651 -11.079  11.412
  168    HG3  ARG  19           HG1      ARG  19 -24.389 -10.969  11.128
  169    HD2  ARG  19           HD2      ARG  19 -24.835 -11.412  13.494
  170    HD3  ARG  19           HD1      ARG  19 -23.113 -11.624  13.799
  171    HE   ARG  19           HE       ARG  19 -22.826  -9.264  13.669
  172   HH11  ARG  19          HH21      ARG  19 -25.993 -10.275  12.738
  173   HH12  ARG  19          HH22      ARG  19 -26.651  -8.676  12.777
  174   HH21  ARG  19          HH11      ARG  19 -23.672  -7.186  13.728
  175   HH22  ARG  19          HH12      ARG  19 -25.339  -6.926  13.338
  176    H    ASP  20           HN       ASP  20 -25.128 -15.032   9.067
  177    HA   ASP  20           HA       ASP  20 -23.705 -17.398  10.043
  178    HB2  ASP  20           HB2      ASP  20 -26.136 -17.025   8.273
  179    HB3  ASP  20           HB1      ASP  20 -25.506 -18.610   8.722
  180    H    GLU  21           HN       GLU  21 -23.039 -15.333   7.587
  181    HA   GLU  21           HA       GLU  21 -22.477 -17.308   5.490
  182    HB2  GLU  21           HB2      GLU  21 -23.137 -14.948   4.970
  183    HB3  GLU  21           HB1      GLU  21 -21.610 -14.409   5.663
  184    HG2  GLU  21           HG2      GLU  21 -21.316 -14.562   3.270
  185    HG3  GLU  21           HG1      GLU  21 -20.422 -15.894   3.998
  186    H    LYS  22           HN       LYS  22 -20.708 -18.552   5.513
  187    HA   LYS  22           HA       LYS  22 -18.543 -18.129   7.390
  188    HB2  LYS  22           HB2      LYS  22 -19.265 -20.383   6.636
  189    HB3  LYS  22           HB1      LYS  22 -18.700 -19.998   5.010
  190    HG2  LYS  22           HG2      LYS  22 -16.416 -19.721   5.824
  191    HG3  LYS  22           HG1      LYS  22 -16.948 -19.978   7.485
  192    HD2  LYS  22           HD2      LYS  22 -17.703 -22.257   6.881
  193    HD3  LYS  22           HD1      LYS  22 -17.131 -22.002   5.233
  194    HE2  LYS  22           HE2      LYS  22 -15.363 -21.805   7.687
  195    HE3  LYS  22           HE1      LYS  22 -15.498 -23.248   6.682
  196    HZ1  LYS  22           HZ1      LYS  22 -14.711 -20.574   5.661
  197    HZ2  LYS  22           HZ2      LYS  22 -14.692 -22.043   4.806
  198    HZ3  LYS  22           HZ3      LYS  22 -13.610 -21.790   6.091
  199    H    TRP  23           HN       TRP  23 -16.629 -17.113   7.057
  200    HA   TRP  23           HA       TRP  23 -16.147 -15.874   4.386
  201    HB2  TRP  23           HB2      TRP  23 -15.289 -15.215   7.198
  202    HB3  TRP  23           HB1      TRP  23 -14.393 -14.571   5.822
  203    HD1  TRP  23           HD1      TRP  23 -16.161 -13.434   3.872
  204    HE1  TRP  23           HE1      TRP  23 -18.046 -11.742   4.344
  205    HE3  TRP  23           HE3      TRP  23 -16.899 -14.307   8.843
  206    HZ2  TRP  23           HZ2      TRP  23 -19.656 -10.873   6.542
  207    HZ3  TRP  23           HZ3      TRP  23 -18.613 -13.036  10.103
  208    HH2  TRP  23           HH2      TRP  23 -19.992 -11.320   8.959
  209    H    GLU  24           HN       GLU  24 -14.128 -16.087   3.383
  210    HA   GLU  24           HA       GLU  24 -12.514 -18.431   4.314
  211    HB2  GLU  24           HB2      GLU  24 -13.637 -18.597   2.072
  212    HB3  GLU  24           HB1      GLU  24 -12.678 -17.215   1.545
  213    HG2  GLU  24           HG2      GLU  24 -11.533 -19.214   0.831
  214    HG3  GLU  24           HG1      GLU  24 -10.608 -18.523   2.162
  215    H    CYS  25           HN       CYS  25 -10.563 -17.971   5.079
  216    HA   CYS  25           HA       CYS  25  -9.496 -15.260   4.935
  217    HB2  CYS  25           HB2      CYS  25  -9.284 -16.678   6.968
  218    HB3  CYS  25           HB1      CYS  25  -8.242 -17.776   6.064
  219    HG   CYS  25           HG       CYS  25  -6.409 -15.992   5.979
  220    H    GLU  26           HN       GLU  26  -7.896 -14.535   3.621
  221    HA   GLU  26           HA       GLU  26  -6.360 -16.510   1.978
  222    HB2  GLU  26           HB2      GLU  26  -8.195 -15.553   0.609
  223    HB3  GLU  26           HB1      GLU  26  -7.605 -13.931   0.970
  224    HG2  GLU  26           HG2      GLU  26  -5.470 -14.438  -0.106
  225    HG3  GLU  26           HG1      GLU  26  -5.988 -16.097  -0.400
  226    H    SER  27           HN       SER  27  -4.401 -16.229   2.976
  227    HA   SER  27           HA       SER  27  -3.460 -13.467   3.551
  228    HB2  SER  27           HB2      SER  27  -1.573 -14.733   4.708
  229    HB3  SER  27           HB1      SER  27  -3.176 -14.906   5.420
  230    HG   SER  27           HG       SER  27  -1.682 -16.843   4.780
  231    H    ILE  28           HN       ILE  28  -2.135 -12.486   2.176
  232    HA   ILE  28           HA       ILE  28  -0.176 -14.077   0.615
  233    HB   ILE  28           HB       ILE  28  -2.180 -13.803  -0.840
  234   HG12  ILE  28          HG12      ILE  28   0.090 -12.023  -1.760
  235   HG13  ILE  28          HG11      ILE  28   0.225 -13.780  -1.683
  236   HG21  ILE  28          HG21      ILE  28  -2.989 -11.663  -1.473
  237   HG22  ILE  28          HG22      ILE  28  -1.589 -10.840  -0.784
  238   HG23  ILE  28          HG23      ILE  28  -2.796 -11.567   0.277
  239   HD11  ILE  28          HD11      ILE  28  -1.993 -12.375  -3.184
  240   HD12  ILE  28          HD12      ILE  28  -1.538 -14.076  -3.277
  241   HD13  ILE  28          HD13      ILE  28  -0.471 -12.840  -3.943
  242    H    GLU  29           HN       GLU  29   1.761 -13.023   0.536
  243    HA   GLU  29           HA       GLU  29   1.930 -10.384   1.844
  244    HB2  GLU  29           HB2      GLU  29   3.514 -12.187   2.465
  245    HB3  GLU  29           HB1      GLU  29   4.127 -12.191   0.810
  246    HG2  GLU  29           HG2      GLU  29   4.840  -9.868   1.028
  247    HG3  GLU  29           HG1      GLU  29   4.146  -9.780   2.646
  248    H    GLU  30           HN       GLU  30   2.154  -8.506   0.749
  249    HA   GLU  30           HA       GLU  30   3.444  -8.457  -1.887
  250    HB2  GLU  30           HB2      GLU  30   1.436  -7.336  -2.953
  251    HB3  GLU  30           HB1      GLU  30   1.234  -9.059  -2.631
  252    HG2  GLU  30           HG2      GLU  30   0.043  -8.539  -0.543
  253    HG3  GLU  30           HG1      GLU  30   0.260  -6.814  -0.842
  254    H    VAL  31           HN       VAL  31   3.448  -6.154  -2.739
  255    HA   VAL  31           HA       VAL  31   4.355  -4.382  -0.670
  256    HB   VAL  31           HB       VAL  31   3.712  -3.892  -3.584
  257   HG11  VAL  31          HG11      VAL  31   4.992  -2.133  -1.475
  258   HG12  VAL  31          HG12      VAL  31   3.602  -1.757  -2.494
  259   HG13  VAL  31          HG13      VAL  31   5.213  -1.863  -3.204
  260   HG21  VAL  31          HG21      VAL  31   5.554  -5.487  -3.117
  261   HG22  VAL  31          HG22      VAL  31   6.329  -4.279  -2.092
  262   HG23  VAL  31          HG23      VAL  31   6.164  -3.992  -3.825
  263    H    ALA  32           HN       ALA  32   3.308  -2.788   0.404
  264    HA   ALA  32           HA       ALA  32   0.495  -2.725   0.657
  265    HB1  ALA  32           HB1      ALA  32   0.891  -0.497   1.745
  266    HB2  ALA  32           HB2      ALA  32   2.558  -0.572   1.182
  267    HB3  ALA  32           HB3      ALA  32   1.968  -1.760   2.343
  268    H    ASP  33           HN       ASP  33   2.620  -0.557  -1.224
  269    HA   ASP  33           HA       ASP  33   0.625   1.171  -2.247
  270    HB2  ASP  33           HB2      ASP  33   3.158   1.376  -2.457
  271    HB3  ASP  33           HB1      ASP  33   3.052   0.223  -3.783
  272    H    ASP  34           HN       ASP  34   1.104  -2.152  -2.885
  273    HA   ASP  34           HA       ASP  34   0.170  -2.283  -5.602
  274    HB2  ASP  34           HB2      ASP  34   1.347  -4.122  -4.329
  275    HB3  ASP  34           HB1      ASP  34  -0.169  -4.399  -3.473
  276    H    ILE  35           HN       ILE  35  -1.529  -2.389  -2.482
  277    HA   ILE  35           HA       ILE  35  -4.137  -2.264  -3.969
  278    HB   ILE  35           HB       ILE  35  -5.152  -3.227  -1.914
  279   HG12  ILE  35          HG12      ILE  35  -2.284  -3.672  -1.024
  280   HG13  ILE  35          HG11      ILE  35  -3.316  -2.402  -0.372
  281   HG21  ILE  35          HG21      ILE  35  -4.261  -4.601  -3.880
  282   HG22  ILE  35          HG22      ILE  35  -4.468  -5.468  -2.358
  283   HG23  ILE  35          HG23      ILE  35  -2.860  -4.953  -2.868
  284   HD11  ILE  35          HD11      ILE  35  -4.856  -3.982   0.537
  285   HD12  ILE  35          HD12      ILE  35  -3.250  -4.570   0.966
  286   HD13  ILE  35          HD13      ILE  35  -4.133  -5.313  -0.363
  287    H    LEU  36           HN       LEU  36  -1.969  -0.536  -2.051
  288    HA   LEU  36           HA       LEU  36  -4.126   1.205  -0.966
  289    HB2  LEU  36           HB2      LEU  36  -1.258   0.787  -0.228
  290    HB3  LEU  36           HB1      LEU  36  -2.079   2.273   0.236
  291    HG   LEU  36           HG       LEU  36  -3.445  -0.360   0.770
  292   HD11  LEU  36          HD11      LEU  36  -1.401  -0.889   1.775
  293   HD12  LEU  36          HD12      LEU  36  -2.331  -0.189   3.098
  294   HD13  LEU  36          HD13      LEU  36  -1.102   0.774   2.280
  295   HD21  LEU  36          HD21      LEU  36  -4.668   1.752   1.169
  296   HD22  LEU  36          HD22      LEU  36  -3.372   2.314   2.215
  297   HD23  LEU  36          HD23      LEU  36  -4.351   0.931   2.694
  298    HA   PRO  37           HA       PRO  37  -3.303   3.826  -4.572
  299    HB2  PRO  37           HB2      PRO  37  -4.699   5.789  -2.775
  300    HB3  PRO  37           HB1      PRO  37  -4.987   5.437  -4.492
  301    HG2  PRO  37           HG2      PRO  37  -6.624   4.508  -2.614
  302    HG3  PRO  37           HG1      PRO  37  -6.203   3.527  -4.031
  303    HD2  PRO  37           HD2      PRO  37  -5.257   3.254  -1.206
  304    HD3  PRO  37           HD1      PRO  37  -5.522   2.007  -2.451
  305    H    ASP  38           HN       ASP  38  -1.659   5.244  -5.021
  306    HA   ASP  38           HA       ASP  38   0.436   5.740  -3.209
  307    HB2  ASP  38           HB2      ASP  38   0.408   5.944  -5.770
  308    HB3  ASP  38           HB1      ASP  38  -0.241   7.563  -5.519
  309    H    GLN  39           HN       GLN  39  -2.630   7.132  -3.231
  310    HA   GLN  39           HA       GLN  39  -2.086   9.828  -2.446
  311    HB2  GLN  39           HB2      GLN  39  -4.333   8.956  -3.119
  312    HB3  GLN  39           HB1      GLN  39  -4.403   8.073  -1.595
  313    HG2  GLN  39           HG2      GLN  39  -4.221  10.190  -0.344
  314    HG3  GLN  39           HG1      GLN  39  -4.139  11.082  -1.863
  315   HE21  GLN  39          HE21      GLN  39  -6.139  12.157  -1.925
  316   HE22  GLN  39          HE22      GLN  39  -7.643  11.384  -1.787
  317    H    TYR  40           HN       TYR  40  -2.540   6.877  -0.507
  318    HA   TYR  40           HA       TYR  40  -1.678   8.390   1.923
  319    HB2  TYR  40           HB2      TYR  40  -3.729   7.150   2.243
  320    HB3  TYR  40           HB1      TYR  40  -3.008   5.692   1.562
  321    HD1  TYR  40           HD2      TYR  40  -2.350   8.212   4.263
  322    HD2  TYR  40           HD1      TYR  40  -2.153   4.099   3.050
  323    HE1  TYR  40           HE2      TYR  40  -1.499   7.592   6.508
  324    HE2  TYR  40           HE1      TYR  40  -1.299   3.477   5.294
  325    HH   TYR  40           HH       TYR  40   0.085   5.242   7.288
  326    H    VAL  41           HN       VAL  41  -0.384   6.458  -0.501
  327    HA   VAL  41           HA       VAL  41   1.844   5.573   1.291
  328    HB   VAL  41           HB       VAL  41   0.609   4.172  -1.091
  329   HG11  VAL  41          HG11      VAL  41   2.931   3.855  -1.433
  330   HG12  VAL  41          HG12      VAL  41   2.449   2.435  -0.504
  331   HG13  VAL  41          HG13      VAL  41   3.265   3.777   0.297
  332   HG21  VAL  41          HG21      VAL  41   0.349   2.343   0.572
  333   HG22  VAL  41          HG22      VAL  41  -0.491   3.806   1.084
  334   HG23  VAL  41          HG23      VAL  41   1.060   3.381   1.807
  335    H    ARG  42           HN       ARG  42   3.721   6.412   0.787
  336    HA   ARG  42           HA       ARG  42   4.493   7.032  -1.976
  337    HB2  ARG  42           HB2      ARG  42   5.129   9.443  -1.211
  338    HB3  ARG  42           HB1      ARG  42   3.447   9.121  -1.622
  339    HG2  ARG  42           HG2      ARG  42   2.878   8.831   0.731
  340    HG3  ARG  42           HG1      ARG  42   4.569   9.030   1.195
  341    HD2  ARG  42           HD2      ARG  42   3.425  11.145   1.543
  342    HD3  ARG  42           HD1      ARG  42   4.513  11.322   0.166
  343    HE   ARG  42           HE       ARG  42   1.928  10.509  -0.763
  344   HH11  ARG  42          HH21      ARG  42   3.641  13.171   0.608
  345   HH12  ARG  42          HH22      ARG  42   2.634  14.366  -0.135
  346   HH21  ARG  42          HH11      ARG  42   0.611  12.054  -1.733
  347   HH22  ARG  42          HH12      ARG  42   0.920  13.736  -1.460
  348    H    LEU  43           HN       LEU  43   6.115   8.989   0.240
  349    HA   LEU  43           HA       LEU  43   8.396   7.071   0.369
  350    HB2  LEU  43           HB2      LEU  43   8.125  10.064   0.674
  351    HB3  LEU  43           HB1      LEU  43   9.571   9.226   1.239
  352    HG   LEU  43           HG       LEU  43   9.844   8.249  -1.046
  353   HD11  LEU  43          HD11      LEU  43   7.658   8.260  -1.958
  354   HD12  LEU  43          HD12      LEU  43   8.499   9.519  -2.859
  355   HD13  LEU  43          HD13      LEU  43   7.401   9.956  -1.550
  356   HD21  LEU  43          HD21      LEU  43   9.624  11.264  -1.181
  357   HD22  LEU  43          HD22      LEU  43  10.781  10.224  -2.012
  358   HD23  LEU  43          HD23      LEU  43  10.891  10.449  -0.266
  359    H    GLY  44           HN       GLY  44   5.765   7.665   2.136
  360    HA2  GLY  44           HA2      GLY  44   6.754   8.228   4.754
  361    HA3  GLY  44           HA1      GLY  44   5.219   7.437   4.407
  362    HA   PRO  45           HA       PRO  45   8.219   4.443   6.538
  363    HB2  PRO  45           HB2      PRO  45   5.655   3.917   7.998
  364    HB3  PRO  45           HB1      PRO  45   7.304   4.067   8.640
  365    HG2  PRO  45           HG2      PRO  45   5.556   6.019   8.984
  366    HG3  PRO  45           HG1      PRO  45   7.245   6.389   8.583
  367    HD2  PRO  45           HD2      PRO  45   4.835   6.416   6.780
  368    HD3  PRO  45           HD1      PRO  45   6.188   7.568   6.867
  369    H    LEU  46           HN       LEU  46   4.945   4.202   5.280
  370    HA   LEU  46           HA       LEU  46   5.082   1.295   4.899
  371    HB2  LEU  46           HB2      LEU  46   3.084   3.326   3.854
  372    HB3  LEU  46           HB1      LEU  46   2.863   1.578   3.876
  373    HG   LEU  46           HG       LEU  46   3.236   3.330   6.328
  374   HD11  LEU  46          HD11      LEU  46   0.772   1.954   5.208
  375   HD12  LEU  46          HD12      LEU  46   1.053   3.694   5.269
  376   HD13  LEU  46          HD13      LEU  46   0.851   2.780   6.763
  377   HD21  LEU  46          HD21      LEU  46   4.049   1.217   6.966
  378   HD22  LEU  46          HD22      LEU  46   2.935   0.357   5.905
  379   HD23  LEU  46          HD23      LEU  46   2.344   1.094   7.394
  380    H    SER  47           HN       SER  47   6.516   3.829   3.362
  381    HA   SER  47           HA       SER  47   6.016   3.444   0.610
  382    HB2  SER  47           HB2      SER  47   8.174   4.495   0.225
  383    HB3  SER  47           HB1      SER  47   7.363   5.289   1.570
  384    HG   SER  47           HG       SER  47   9.056   4.793   2.690
  385    H    ASN  48           HN       ASN  48   6.612   1.945  -0.848
  386    HA   ASN  48           HA       ASN  48   7.221  -0.222  -1.540
  387    HB2  ASN  48           HB2      ASN  48   9.656  -0.486  -1.663
  388    HB3  ASN  48           HB1      ASN  48   9.200   1.169  -2.058
  389   HD21  ASN  48          HD21      ASN  48  10.807   2.496  -1.209
  390   HD22  ASN  48          HD22      ASN  48  11.438   2.372   0.362
  391    H    LYS  49           HN       LYS  49   6.420   0.083   1.381
  392    HA   LYS  49           HA       LYS  49   8.047  -1.957   2.721
  393    HB2  LYS  49           HB2      LYS  49   6.935   0.030   3.880
  394    HB3  LYS  49           HB1      LYS  49   5.412  -0.828   3.669
  395    HG2  LYS  49           HG2      LYS  49   6.042  -1.588   5.786
  396    HG3  LYS  49           HG1      LYS  49   6.740  -2.846   4.769
  397    HD2  LYS  49           HD2      LYS  49   8.920  -1.708   4.832
  398    HD3  LYS  49           HD1      LYS  49   8.223  -0.410   5.798
  399    HE2  LYS  49           HE2      LYS  49   7.682  -2.024   7.579
  400    HE3  LYS  49           HE1      LYS  49   8.380  -3.324   6.611
  401    HZ1  LYS  49           HZ1      LYS  49   9.871  -2.284   8.339
  402    HZ2  LYS  49           HZ2      LYS  49   9.912  -0.904   7.350
  403    HZ3  LYS  49           HZ3      LYS  49  10.505  -2.386   6.769
  404    H    ILE  50           HN       ILE  50   7.555  -4.095   2.887
  405    HA   ILE  50           HA       ILE  50   5.291  -5.111   1.293
  406    HB   ILE  50           HB       ILE  50   7.545  -6.499   2.756
  407   HG12  ILE  50          HG12      ILE  50   7.020  -6.212  -0.213
  408   HG13  ILE  50          HG11      ILE  50   8.065  -5.117   0.693
  409   HG21  ILE  50          HG21      ILE  50   6.753  -8.477   1.350
  410   HG22  ILE  50          HG22      ILE  50   5.272  -7.562   1.067
  411   HG23  ILE  50          HG23      ILE  50   5.716  -8.037   2.706
  412   HD11  ILE  50          HD11      ILE  50   9.573  -6.891   1.265
  413   HD12  ILE  50          HD12      ILE  50   9.255  -7.047  -0.462
  414   HD13  ILE  50          HD13      ILE  50   8.450  -8.119   0.683
  415    H    LEU  51           HN       LEU  51   3.357  -5.207   2.302
  416    HA   LEU  51           HA       LEU  51   3.275  -5.983   5.197
  417    HB2  LEU  51           HB2      LEU  51   1.546  -4.192   3.503
  418    HB3  LEU  51           HB1      LEU  51   0.867  -4.958   4.940
  419    HG   LEU  51           HG       LEU  51   2.723  -4.008   6.293
  420   HD11  LEU  51          HD11      LEU  51   3.584  -3.022   3.596
  421   HD12  LEU  51          HD12      LEU  51   4.552  -3.619   4.943
  422   HD13  LEU  51          HD13      LEU  51   3.886  -1.992   4.995
  423   HD21  LEU  51          HD21      LEU  51   0.480  -2.835   5.847
  424   HD22  LEU  51          HD22      LEU  51   1.375  -1.794   4.740
  425   HD23  LEU  51          HD23      LEU  51   1.795  -1.831   6.453
  426    H    GLN  52           HN       GLN  52   1.836  -7.548   5.856
  427    HA   GLN  52           HA       GLN  52   1.183  -9.559   3.850
  428    HB2  GLN  52           HB2      GLN  52   0.777  -9.398   6.842
  429    HB3  GLN  52           HB1      GLN  52   0.300 -10.797   5.875
  430    HG2  GLN  52           HG2      GLN  52   2.618 -11.053   5.083
  431    HG3  GLN  52           HG1      GLN  52   3.101  -9.637   6.015
  432   HE21  GLN  52          HE21      GLN  52   4.569 -11.626   6.854
  433   HE22  GLN  52          HE22      GLN  52   3.970 -12.399   8.241
  434    H    THR  53           HN       THR  53  -0.602  -9.288   2.630
  435    HA   THR  53           HA       THR  53  -2.911  -7.772   3.712
  436    HB   THR  53           HB       THR  53  -3.720  -7.812   1.395
  437    HG1  THR  53           HG1      THR  53  -3.077  -9.771   0.667
  438   HG21  THR  53          HG21      THR  53  -1.989  -6.464   0.421
  439   HG22  THR  53          HG22      THR  53  -0.746  -7.254   1.391
  440   HG23  THR  53          HG23      THR  53  -1.921  -6.188   2.160
  441    H    ASN  54           HN       ASN  54  -4.375  -8.942   4.811
  442    HA   ASN  54           HA       ASN  54  -4.919 -11.767   3.997
  443    HB2  ASN  54           HB2      ASN  54  -5.362 -10.268   6.590
  444    HB3  ASN  54           HB1      ASN  54  -6.022 -11.876   6.281
  445   HD21  ASN  54          HD21      ASN  54  -4.070 -11.424   8.352
  446   HD22  ASN  54          HD22      ASN  54  -2.639 -12.222   7.908
  447    H    THR  55           HN       THR  55  -6.440 -11.553   2.419
  448    HA   THR  55           HA       THR  55  -8.703  -9.683   2.818
  449    HB   THR  55           HB       THR  55  -7.910 -11.428   0.475
  450    HG1  THR  55           HG1      THR  55  -7.860  -8.829  -0.011
  451   HG21  THR  55          HG21      THR  55 -10.249 -11.114   0.290
  452   HG22  THR  55          HG22      THR  55  -9.548  -9.850  -0.719
  453   HG23  THR  55          HG23      THR  55 -10.158  -9.458   0.888
  454    H    TYR  56           HN       TYR  56 -10.632 -10.373   3.544
  455    HA   TYR  56           HA       TYR  56 -11.166 -13.324   3.612
  456    HB2  TYR  56           HB2      TYR  56 -12.283 -11.103   5.354
  457    HB3  TYR  56           HB1      TYR  56 -12.630 -12.826   5.523
  458    HD1  TYR  56           HD2      TYR  56  -9.909 -10.292   5.649
  459    HD2  TYR  56           HD1      TYR  56 -11.115 -14.291   6.652
  460    HE1  TYR  56           HE2      TYR  56  -7.857 -10.568   7.013
  461    HE2  TYR  56           HE1      TYR  56  -9.064 -14.566   8.017
  462    HH   TYR  56           HH       TYR  56  -6.505 -12.171   7.994
  463    H    TYR  57           HN       TYR  57 -12.794 -13.986   2.291
  464    HA   TYR  57           HA       TYR  57 -15.070 -12.170   1.759
  465    HB2  TYR  57           HB2      TYR  57 -14.865 -12.317  -0.664
  466    HB3  TYR  57           HB1      TYR  57 -13.395 -11.613   0.004
  467    HD1  TYR  57           HD2      TYR  57 -11.383 -13.156   0.408
  468    HD2  TYR  57           HD1      TYR  57 -14.780 -14.301  -1.960
  469    HE1  TYR  57           HE2      TYR  57 -10.038 -14.936  -0.672
  470    HE2  TYR  57           HE1      TYR  57 -13.428 -16.081  -3.036
  471    HH   TYR  57           HH       TYR  57  -9.973 -16.333  -2.513
  472    H    SER  58           HN       SER  58 -16.840 -13.308   0.673
  473    HA   SER  58           HA       SER  58 -16.653 -16.285   0.745
  474    HB2  SER  58           HB2      SER  58 -18.507 -16.530   2.149
  475    HB3  SER  58           HB1      SER  58 -17.710 -15.131   2.860
  476    HG   SER  58           HG       SER  58 -19.176 -14.066   1.084
  477    H    ASP  59           HN       ASP  59 -19.108 -16.993   0.004
  478    HA   ASP  59           HA       ASP  59 -19.266 -16.313  -2.777
  479    HB2  ASP  59           HB2      ASP  59 -21.085 -17.735  -0.838
  480    HB3  ASP  59           HB1      ASP  59 -21.601 -17.440  -2.497
  481    H    THR  60           HN       THR  60 -21.176 -15.267   0.038
  482    HA   THR  60           HA       THR  60 -23.033 -13.638  -1.427
  483    HB   THR  60           HB       THR  60 -22.064 -13.163   1.403
  484    HG1  THR  60           HG1      THR  60 -22.965 -15.385   0.533
  485   HG21  THR  60          HG21      THR  60 -23.559 -11.457   0.375
  486   HG22  THR  60          HG22      THR  60 -24.304 -12.280   1.745
  487   HG23  THR  60          HG23      THR  60 -24.762 -12.718   0.100
  488    H    LEU  61           HN       LEU  61 -20.000 -12.806   0.265
  489    HA   LEU  61           HA       LEU  61 -20.056 -10.016  -0.376
  490    HB2  LEU  61           HB2      LEU  61 -17.903 -11.968   0.384
  491    HB3  LEU  61           HB1      LEU  61 -17.465 -10.327  -0.073
  492    HG   LEU  61           HG       LEU  61 -18.969  -9.445   1.677
  493   HD11  LEU  61          HD11      LEU  61 -20.664 -11.110   1.832
  494   HD12  LEU  61          HD12      LEU  61 -19.805 -11.180   3.370
  495   HD13  LEU  61          HD13      LEU  61 -19.487 -12.390   2.126
  496   HD21  LEU  61          HD21      LEU  61 -16.563 -10.036   2.157
  497   HD22  LEU  61          HD22      LEU  61 -17.123 -11.576   2.800
  498   HD23  LEU  61          HD23      LEU  61 -17.603 -10.066   3.578
  499    H    HIS  62           HN       HIS  62 -18.598 -12.794  -2.061
  500    HA   HIS  62           HA       HIS  62 -17.354 -11.267  -4.145
  501    HB2  HIS  62           HB2      HIS  62 -16.838 -13.660  -3.654
  502    HB3  HIS  62           HB1      HIS  62 -18.425 -14.099  -4.285
  503    HD1  HIS  62           HD1      HIS  62 -18.866 -13.441  -6.862
  504    HD2  HIS  62           HD2      HIS  62 -14.888 -13.323  -5.620
  505    HE1  HIS  62           HE1      HIS  62 -17.458 -13.403  -8.968
  506    H    LYS  63           HN       LYS  63 -20.576 -12.731  -3.853
  507    HA   LYS  63           HA       LYS  63 -21.443 -12.118  -6.523
  508    HB2  LYS  63           HB2      LYS  63 -22.606 -13.725  -4.993
  509    HB3  LYS  63           HB1      LYS  63 -23.151 -12.349  -4.031
  510    HG2  LYS  63           HG2      LYS  63 -24.334 -11.422  -5.948
  511    HG3  LYS  63           HG1      LYS  63 -23.735 -12.718  -6.981
  512    HD2  LYS  63           HD2      LYS  63 -24.939 -14.374  -5.586
  513    HD3  LYS  63           HD1      LYS  63 -25.555 -13.062  -4.578
  514    HE2  LYS  63           HE2      LYS  63 -26.682 -12.072  -6.533
  515    HE3  LYS  63           HE1      LYS  63 -26.053 -13.362  -7.557
  516    HZ1  LYS  63           HZ1      LYS  63 -28.194 -14.040  -6.990
  517    HZ2  LYS  63           HZ2      LYS  63 -28.033 -13.553  -5.371
  518    HZ3  LYS  63           HZ3      LYS  63 -27.199 -14.920  -5.936
  519    H    SER  64           HN       SER  64 -21.602 -10.311  -3.485
  520    HA   SER  64           HA       SER  64 -23.105  -8.107  -4.672
  521    HB2  SER  64           HB2      SER  64 -21.542  -8.054  -2.085
  522    HB3  SER  64           HB1      SER  64 -22.930  -7.064  -2.527
  523    HG   SER  64           HG       SER  64 -23.130  -9.146  -1.162
  524    H    ASN  65           HN       ASN  65 -19.997  -9.116  -5.054
  525    HA   ASN  65           HA       ASN  65 -18.113  -8.099  -5.996
  526    HB2  ASN  65           HB2      ASN  65 -19.983  -6.853  -7.303
  527    HB3  ASN  65           HB1      ASN  65 -19.665  -5.513  -6.204
  528   HD21  ASN  65          HD21      ASN  65 -19.004  -4.531  -8.446
  529   HD22  ASN  65          HD22      ASN  65 -17.379  -4.726  -8.894
  530    H    ILE  66           HN       ILE  66 -18.456  -8.144  -3.174
  531    HA   ILE  66           HA       ILE  66 -17.039  -5.619  -2.381
  532    HB   ILE  66           HB       ILE  66 -18.866  -7.365  -0.710
  533   HG12  ILE  66          HG12      ILE  66 -19.147  -4.478  -1.597
  534   HG13  ILE  66          HG11      ILE  66 -19.910  -5.831  -2.430
  535   HG21  ILE  66          HG21      ILE  66 -18.495  -5.333   0.894
  536   HG22  ILE  66          HG22      ILE  66 -17.049  -5.034  -0.069
  537   HG23  ILE  66          HG23      ILE  66 -17.233  -6.557   0.798
  538   HD11  ILE  66          HD11      ILE  66 -21.040  -6.452  -0.289
  539   HD12  ILE  66          HD12      ILE  66 -21.512  -4.859  -0.883
  540   HD13  ILE  66          HD13      ILE  66 -20.361  -5.000   0.446
  541    H    TYR  67           HN       TYR  67 -15.043  -5.884  -1.598
  542    HA   TYR  67           HA       TYR  67 -14.184  -8.620  -0.712
  543    HB2  TYR  67           HB2      TYR  67 -12.698  -6.645  -2.454
  544    HB3  TYR  67           HB1      TYR  67 -11.980  -8.105  -1.763
  545    HD1  TYR  67           HD1      TYR  67 -12.760 -10.345  -2.445
  546    HD2  TYR  67           HD2      TYR  67 -14.317  -6.777  -4.260
  547    HE1  TYR  67           HE1      TYR  67 -13.725 -11.702  -4.282
  548    HE2  TYR  67           HE2      TYR  67 -15.279  -8.134  -6.098
  549    HH   TYR  67           HH       TYR  67 -15.813 -11.289  -5.966
  550    HA   PRO  68           HA       PRO  68 -13.019  -5.623   2.563
  551    HB2  PRO  68           HB2      PRO  68 -13.765  -7.098   4.712
  552    HB3  PRO  68           HB1      PRO  68 -14.932  -6.166   3.752
  553    HG2  PRO  68           HG2      PRO  68 -14.410  -9.092   3.767
  554    HG3  PRO  68           HG1      PRO  68 -15.924  -8.214   3.494
  555    HD2  PRO  68           HD2      PRO  68 -14.270  -9.306   1.481
  556    HD3  PRO  68           HD1      PRO  68 -15.577  -8.133   1.221
  557    H    PHE  69           HN       PHE  69 -11.047  -5.563   3.698
  558    HA   PHE  69           HA       PHE  69  -9.665  -8.109   4.266
  559    HB2  PHE  69           HB2      PHE  69  -7.693  -7.560   2.941
  560    HB3  PHE  69           HB1      PHE  69  -9.112  -7.616   1.893
  561    HD1  PHE  69           HD2      PHE  69  -6.645  -5.416   3.521
  562    HD2  PHE  69           HD1      PHE  69 -10.044  -5.601   0.905
  563    HE1  PHE  69           HE2      PHE  69  -6.199  -3.091   2.782
  564    HE2  PHE  69           HE1      PHE  69  -9.599  -3.276   0.164
  565    HZ   PHE  69           HZ       PHE  69  -7.675  -2.021   1.101
  566    H    ILE  70           HN       ILE  70  -7.613  -7.750   5.420
  567    HA   ILE  70           HA       ILE  70  -7.461  -5.105   6.811
  568    HB   ILE  70           HB       ILE  70  -7.242  -7.846   8.089
  569   HG12  ILE  70          HG12      ILE  70  -9.254  -5.633   8.575
  570   HG13  ILE  70          HG11      ILE  70  -9.563  -7.011   7.524
  571   HG21  ILE  70          HG21      ILE  70  -6.764  -5.032   9.095
  572   HG22  ILE  70          HG22      ILE  70  -5.696  -6.430   9.209
  573   HG23  ILE  70          HG23      ILE  70  -7.153  -6.352  10.197
  574   HD11  ILE  70          HD11      ILE  70  -9.322  -8.559   9.352
  575   HD12  ILE  70          HD12      ILE  70 -10.412  -7.285   9.894
  576   HD13  ILE  70          HD13      ILE  70  -8.731  -7.288  10.422
  577    H    LEU  71           HN       LEU  71  -5.345  -4.492   7.393
  578    HA   LEU  71           HA       LEU  71  -3.182  -6.021   6.003
  579    HB2  LEU  71           HB2      LEU  71  -3.110  -3.210   7.128
  580    HB3  LEU  71           HB1      LEU  71  -1.939  -3.946   6.033
  581    HG   LEU  71           HG       LEU  71  -4.837  -3.291   5.426
  582   HD11  LEU  71          HD11      LEU  71  -2.344  -2.318   4.026
  583   HD12  LEU  71          HD12      LEU  71  -3.026  -1.465   5.410
  584   HD13  LEU  71          HD13      LEU  71  -3.975  -1.653   3.935
  585   HD21  LEU  71          HD21      LEU  71  -4.439  -5.307   4.247
  586   HD22  LEU  71          HD22      LEU  71  -2.762  -4.879   3.908
  587   HD23  LEU  71          HD23      LEU  71  -4.074  -4.053   3.069
  588    H    TYR  72           HN       TYR  72  -1.487  -6.843   7.118
  589    HA   TYR  72           HA       TYR  72  -1.339  -6.314  10.056
  590    HB2  TYR  72           HB2      TYR  72  -1.197  -8.970   8.627
  591    HB3  TYR  72           HB1      TYR  72  -0.727  -8.738  10.313
  592    HD1  TYR  72           HD1      TYR  72  -2.463  -7.607  11.871
  593    HD2  TYR  72           HD2      TYR  72  -3.460  -9.392   8.094
  594    HE1  TYR  72           HE1      TYR  72  -4.832  -7.779  12.580
  595    HE2  TYR  72           HE2      TYR  72  -5.830  -9.567   8.804
  596    HH   TYR  72           HH       TYR  72  -6.887  -9.546  11.705
  597    H    TYR  73           HN       TYR  73   0.664  -6.048  10.858
  598    HA   TYR  73           HA       TYR  73   3.008  -6.705   9.149
  599    HB2  TYR  73           HB2      TYR  73   2.492  -4.363   8.666
  600    HB3  TYR  73           HB1      TYR  73   2.461  -3.997  10.392
  601    HD1  TYR  73           HD2      TYR  73   4.654  -5.337   7.684
  602    HD2  TYR  73           HD1      TYR  73   4.454  -3.455  11.539
  603    HE1  TYR  73           HE2      TYR  73   7.113  -5.012   7.653
  604    HE2  TYR  73           HE1      TYR  73   6.911  -3.130  11.509
  605    HH   TYR  73           HH       TYR  73   8.717  -2.999   9.194
  606    H    GLN  74           HN       GLN  74   4.242  -7.948  10.383
  607    HA   GLN  74           HA       GLN  74   5.252  -8.900  12.255
  608    HB2  GLN  74           HB2      GLN  74   6.381  -6.629  12.074
  609    HB3  GLN  74           HB1      GLN  74   5.297  -6.084  13.355
  610    HG2  GLN  74           HG2      GLN  74   6.120  -7.890  14.825
  611    HG3  GLN  74           HG1      GLN  74   7.195  -8.444  13.541
  612   HE21  GLN  74          HE21      GLN  74   9.254  -7.897  14.345
  613   HE22  GLN  74          HE22      GLN  74   9.699  -6.333  14.834
  614    H    LYS  75           HN       LYS  75   2.800  -9.560  12.475
  615    HA   LYS  75           HA       LYS  75   0.996 -10.016  13.885
  616    HB2  LYS  75           HB2      LYS  75   3.109 -10.905  15.120
  617    HB3  LYS  75           HB1      LYS  75   2.888  -9.519  16.187
  618    HG2  LYS  75           HG2      LYS  75   0.633 -10.261  16.753
  619    HG3  LYS  75           HG1      LYS  75   0.743 -11.579  15.589
  620    HD2  LYS  75           HD2      LYS  75   2.565 -12.599  16.870
  621    HD3  LYS  75           HD1      LYS  75   2.540 -11.254  18.012
  622    HE2  LYS  75           HE2      LYS  75   1.280 -13.146  18.933
  623    HE3  LYS  75           HE1      LYS  75   0.186 -11.810  18.580
  624    HZ1  LYS  75           HZ1      LYS  75  -0.963 -13.364  17.480
  625    HZ2  LYS  75           HZ2      LYS  75   0.359 -14.424  17.363
  626    HZ3  LYS  75           HZ3      LYS  75   0.189 -13.147  16.256
  627    H    GLN  76           HN       GLN  76   1.104  -7.311  13.060
  628    HA   GLN  76           HA       GLN  76  -0.433  -6.102  15.265
  629    HB2  GLN  76           HB2      GLN  76   1.958  -5.390  15.624
  630    HB3  GLN  76           HB1      GLN  76   1.903  -4.601  14.048
  631    HG2  GLN  76           HG2      GLN  76   1.404  -2.931  15.727
  632    HG3  GLN  76           HG1      GLN  76  -0.091  -3.288  14.863
  633   HE21  GLN  76          HE21      GLN  76   1.656  -4.822  17.639
  634   HE22  GLN  76          HE22      GLN  76   0.280  -4.923  18.629
  635    H    LEU  77           HN       LEU  77  -2.228  -5.276  14.354
  636    HA   LEU  77           HA       LEU  77  -2.535  -5.067  11.505
  637    HB2  LEU  77           HB2      LEU  77  -4.772  -4.437  11.932
  638    HB3  LEU  77           HB1      LEU  77  -4.337  -5.567  13.209
  639    HG   LEU  77           HG       LEU  77  -3.612  -3.180  14.384
  640   HD11  LEU  77          HD11      LEU  77  -6.076  -2.629  12.692
  641   HD12  LEU  77          HD12      LEU  77  -4.518  -1.820  12.542
  642   HD13  LEU  77          HD13      LEU  77  -5.488  -1.592  13.995
  643   HD21  LEU  77          HD21      LEU  77  -5.919  -3.329  15.506
  644   HD22  LEU  77          HD22      LEU  77  -4.920  -4.780  15.572
  645   HD23  LEU  77          HD23      LEU  77  -6.241  -4.676  14.412
  646    H    ILE  78           HN       ILE  78  -2.461  -3.331  10.156
  647    HA   ILE  78           HA       ILE  78  -1.440  -0.762  11.307
  648    HB   ILE  78           HB       ILE  78  -1.286  -1.827   8.480
  649   HG12  ILE  78          HG12      ILE  78   0.097  -3.180   9.952
  650   HG13  ILE  78          HG11      ILE  78   1.141  -2.123   9.008
  651   HG21  ILE  78          HG21      ILE  78   0.495   0.029   8.360
  652   HG22  ILE  78          HG22      ILE  78  -0.232   0.656   9.839
  653   HG23  ILE  78          HG23      ILE  78  -1.193   0.537   8.364
  654   HD11  ILE  78          HD11      ILE  78   2.030  -1.846  11.147
  655   HD12  ILE  78          HD12      ILE  78   0.457  -1.991  11.929
  656   HD13  ILE  78          HD13      ILE  78   0.891  -0.506  11.086
  657    H    ALA  79           HN       ALA  79  -3.779  -2.085   8.943
  658    HA   ALA  79           HA       ALA  79  -5.524   0.213   9.481
  659    HB1  ALA  79           HB1      ALA  79  -5.567   1.102   7.257
  660    HB2  ALA  79           HB2      ALA  79  -4.543  -0.198   6.653
  661    HB3  ALA  79           HB3      ALA  79  -3.873   1.018   7.740
  662    H    ILE  80           HN       ILE  80  -7.580   0.049   8.301
  663    HA   ILE  80           HA       ILE  80  -8.222  -2.725   7.370
  664    HB   ILE  80           HB       ILE  80  -9.835  -0.996   9.269
  665   HG12  ILE  80          HG12      ILE  80  -8.595  -3.721   9.715
  666   HG13  ILE  80          HG11      ILE  80  -7.815  -2.215  10.190
  667   HG21  ILE  80          HG21      ILE  80 -10.408  -3.690   8.007
  668   HG22  ILE  80          HG22      ILE  80 -11.330  -2.203   7.789
  669   HG23  ILE  80          HG23      ILE  80 -11.324  -3.014   9.352
  670   HD11  ILE  80          HD11      ILE  80  -9.221  -3.450  11.975
  671   HD12  ILE  80          HD12      ILE  80 -10.624  -2.864  11.083
  672   HD13  ILE  80          HD13      ILE  80  -9.483  -1.718  11.786
  673    H    GLY  81           HN       GLY  81  -9.815  -2.791   5.720
  674    HA2  GLY  81           HA2      GLY  81 -11.414  -0.515   4.992
  675    HA3  GLY  81           HA1      GLY  81  -9.980  -0.584   3.966
  676    H    PHE  82           HN       PHE  82 -12.428  -0.878   2.786
  677    HA   PHE  82           HA       PHE  82 -12.259  -3.648   1.784
  678    HB2  PHE  82           HB2      PHE  82 -14.682  -4.034   2.053
  679    HB3  PHE  82           HB1      PHE  82 -13.924  -3.765   3.623
  680    HD1  PHE  82           HD2      PHE  82 -14.277  -1.694   4.866
  681    HD2  PHE  82           HD1      PHE  82 -16.155  -2.347   1.058
  682    HE1  PHE  82           HE2      PHE  82 -15.810   0.207   5.296
  683    HE2  PHE  82           HE1      PHE  82 -17.691  -0.447   1.492
  684    HZ   PHE  82           HZ       PHE  82 -17.517   0.830   3.610
  685    H    ILE  83           HN       ILE  83 -13.368  -3.895  -0.279
  686    HA   ILE  83           HA       ILE  83 -13.599  -1.283  -1.719
  687    HB   ILE  83           HB       ILE  83 -13.240  -4.088  -2.806
  688   HG12  ILE  83          HG12      ILE  83 -11.245  -1.808  -2.609
  689   HG13  ILE  83          HG11      ILE  83 -11.306  -3.156  -1.473
  690   HG21  ILE  83          HG21      ILE  83 -14.356  -2.617  -4.398
  691   HG22  ILE  83          HG22      ILE  83 -12.679  -2.831  -4.899
  692   HG23  ILE  83          HG23      ILE  83 -13.174  -1.344  -4.092
  693   HD11  ILE  83          HD11      ILE  83 -10.931  -3.448  -4.468
  694   HD12  ILE  83          HD12      ILE  83 -10.880  -4.745  -3.276
  695   HD13  ILE  83          HD13      ILE  83  -9.627  -3.505  -3.283
  696    H    ASP  84           HN       ASP  84 -15.589  -0.609  -2.248
  697    HA   ASP  84           HA       ASP  84 -17.869  -2.497  -2.028
  698    HB2  ASP  84           HB2      ASP  84 -19.262  -0.478  -2.036
  699    HB3  ASP  84           HB1      ASP  84 -17.989  -0.343  -0.827
  700    H    GLU  85           HN       GLU  85 -19.719  -1.650  -3.673
  701    HA   GLU  85           HA       GLU  85 -19.053  -2.660  -6.233
  702    HB2  GLU  85           HB2      GLU  85 -21.287  -0.816  -5.351
  703    HB3  GLU  85           HB1      GLU  85 -21.218  -1.578  -6.940
  704    HG2  GLU  85           HG2      GLU  85 -21.233  -3.795  -5.910
  705    HG3  GLU  85           HG1      GLU  85 -21.201  -3.072  -4.302
  706    H    ASN  86           HN       ASN  86 -18.432   0.454  -4.900
  707    HA   ASN  86           HA       ASN  86 -18.232   1.757  -7.553
  708    HB2  ASN  86           HB2      ASN  86 -17.689   2.760  -4.741
  709    HB3  ASN  86           HB1      ASN  86 -17.555   3.753  -6.194
  710   HD21  ASN  86          HD21      ASN  86 -19.614   3.430  -3.735
  711   HD22  ASN  86          HD22      ASN  86 -21.109   3.588  -4.527
  712    H    HIS  87           HN       HIS  87 -16.408  -0.448  -6.135
  713    HA   HIS  87           HA       HIS  87 -14.138  -1.025  -6.194
  714    HB2  HIS  87           HB2      HIS  87 -14.302   0.944  -8.487
  715    HB3  HIS  87           HB1      HIS  87 -12.841   0.033  -8.115
  716    HD1  HIS  87           HD1      HIS  87 -16.442  -0.469  -9.169
  717    HD2  HIS  87           HD2      HIS  87 -12.912  -2.668  -8.884
  718    HE1  HIS  87           HE1      HIS  87 -16.885  -2.687 -10.311
  719    H    ASP  88           HN       ASP  88 -15.162   1.762  -4.966
  720    HA   ASP  88           HA       ASP  88 -12.613   3.189  -4.727
  721    HB2  ASP  88           HB2      ASP  88 -14.754   4.409  -4.777
  722    HB3  ASP  88           HB1      ASP  88 -15.251   3.600  -3.292
  723    H    MET  89           HN       MET  89 -11.073   2.583  -3.312
  724    HA   MET  89           HA       MET  89 -11.409   0.525  -1.364
  725    HB2  MET  89           HB2      MET  89  -9.311   2.703  -1.596
  726    HB3  MET  89           HB1      MET  89  -9.185   1.316  -0.513
  727    HG2  MET  89           HG2      MET  89  -7.997   0.599  -2.413
  728    HG3  MET  89           HG1      MET  89  -9.592  -0.103  -2.676
  729    HE1  MET  89           HE1      MET  89  -6.974   1.063  -4.792
  730    HE2  MET  89           HE2      MET  89  -8.092   0.986  -6.152
  731    HE3  MET  89           HE3      MET  89  -8.128  -0.272  -4.919
  732    H    ASP  90           HN       ASP  90 -13.174   1.021  -0.019
  733    HA   ASP  90           HA       ASP  90 -13.400   3.558   1.367
  734    HB2  ASP  90           HB2      ASP  90 -14.746   0.869   1.604
  735    HB3  ASP  90           HB1      ASP  90 -15.053   2.127   2.800
  736    H    PHE  91           HN       PHE  91 -12.688   4.097   3.399
  737    HA   PHE  91           HA       PHE  91 -10.976   2.080   4.818
  738    HB2  PHE  91           HB2      PHE  91 -10.754   5.082   4.548
  739    HB3  PHE  91           HB1      PHE  91  -9.828   4.156   5.733
  740    HD1  PHE  91           HD1      PHE  91  -8.184   2.467   5.008
  741    HD2  PHE  91           HD2      PHE  91 -10.272   4.929   2.176
  742    HE1  PHE  91           HE1      PHE  91  -6.561   1.818   3.250
  743    HE2  PHE  91           HE2      PHE  91  -8.647   4.284   0.417
  744    HZ   PHE  91           HZ       PHE  91  -6.792   2.728   0.954
  745    H    LEU  92           HN       LEU  92 -11.652   1.506   6.778
  746    HA   LEU  92           HA       LEU  92 -13.775   3.132   8.113
  747    HB2  LEU  92           HB2      LEU  92 -14.299   0.755   7.555
  748    HB3  LEU  92           HB1      LEU  92 -12.944   0.252   8.564
  749    HG   LEU  92           HG       LEU  92 -14.017   1.367  10.517
  750   HD11  LEU  92          HD11      LEU  92 -16.601   1.788  10.062
  751   HD12  LEU  92          HD12      LEU  92 -16.051   2.062   8.411
  752   HD13  LEU  92          HD13      LEU  92 -15.423   3.053   9.727
  753   HD21  LEU  92          HD21      LEU  92 -14.405  -0.969  10.352
  754   HD22  LEU  92          HD22      LEU  92 -15.512  -0.774   8.994
  755   HD23  LEU  92          HD23      LEU  92 -16.002  -0.272  10.612
  756    H    TYR  93           HN       TYR  93 -10.563   1.729   8.527
  757    HA   TYR  93           HA       TYR  93 -10.159   3.479  10.869
  758    HB2  TYR  93           HB2      TYR  93 -11.065   1.412  11.874
  759    HB3  TYR  93           HB1      TYR  93  -9.820   0.469  11.061
  760    HD1  TYR  93           HD1      TYR  93 -10.444   3.056  13.639
  761    HD2  TYR  93           HD2      TYR  93  -7.559   0.406  11.879
  762    HE1  TYR  93           HE1      TYR  93  -8.891   3.498  15.520
  763    HE2  TYR  93           HE2      TYR  93  -6.004   0.850  13.759
  764    HH   TYR  93           HH       TYR  93  -6.446   1.657  16.354
  765    H    LEU  94           HN       LEU  94  -8.406   4.518  10.085
  766    HA   LEU  94           HA       LEU  94  -6.226   2.912   8.809
  767    HB2  LEU  94           HB2      LEU  94  -7.122   4.647   7.362
  768    HB3  LEU  94           HB1      LEU  94  -6.920   5.856   8.627
  769    HG   LEU  94           HG       LEU  94  -4.489   5.608   8.535
  770   HD11  LEU  94          HD11      LEU  94  -4.069   3.345   8.050
  771   HD12  LEU  94          HD12      LEU  94  -3.626   4.144   6.546
  772   HD13  LEU  94          HD13      LEU  94  -5.182   3.331   6.682
  773   HD21  LEU  94          HD21      LEU  94  -5.319   7.225   6.991
  774   HD22  LEU  94          HD22      LEU  94  -5.894   5.980   5.881
  775   HD23  LEU  94          HD23      LEU  94  -4.164   6.255   6.076
  776    H    HIS  95           HN       HIS  95  -4.396   2.652   9.957
  777    HA   HIS  95           HA       HIS  95  -3.650   4.706  11.985
  778    HB2  HIS  95           HB2      HIS  95  -4.741   2.763  13.117
  779    HB3  HIS  95           HB1      HIS  95  -3.486   1.720  12.445
  780    HD1  HIS  95           HD1      HIS  95  -0.986   3.363  12.837
  781    HD2  HIS  95           HD2      HIS  95  -3.959   3.119  15.750
  782    HE1  HIS  95           HE1      HIS  95   0.120   3.965  15.036
  783    H    ASN  96           HN       ASN  96  -1.796   5.506  11.224
  784    HA   ASN  96           HA       ASN  96  -0.003   3.924   9.547
  785    HB2  ASN  96           HB2      ASN  96  -0.475   6.426   9.330
  786    HB3  ASN  96           HB1      ASN  96   0.543   6.641  10.753
  787   HD21  ASN  96          HD21      ASN  96   2.168   7.794   9.440
  788   HD22  ASN  96          HD22      ASN  96   3.180   6.944   8.376
  789    H    THR  97           HN       THR  97   2.384   3.883  10.109
  790    HA   THR  97           HA       THR  97   2.823   2.500  12.568
  791    HB   THR  97           HB       THR  97   5.241   2.765  11.985
  792    HG1  THR  97           HG1      THR  97   4.437   4.101   9.660
  793   HG21  THR  97          HG21      THR  97   3.693   1.059  10.894
  794   HG22  THR  97          HG22      THR  97   5.146   1.462   9.980
  795   HG23  THR  97          HG23      THR  97   3.593   2.161   9.521
  796    H    VAL  98           HN       VAL  98   3.090   5.885  11.684
  797    HA   VAL  98           HA       VAL  98   4.410   6.608  14.217
  798    HB   VAL  98           HB       VAL  98   3.245   8.329  12.014
  799   HG11  VAL  98          HG11      VAL  98   4.810  10.047  13.031
  800   HG12  VAL  98          HG12      VAL  98   4.991   8.958  14.406
  801   HG13  VAL  98          HG13      VAL  98   3.409   9.636  14.019
  802   HG21  VAL  98          HG21      VAL  98   6.124   7.552  12.562
  803   HG22  VAL  98          HG22      VAL  98   5.541   8.549  11.230
  804   HG23  VAL  98          HG23      VAL  98   5.116   6.839  11.300
  805    H    MET  99           HN       MET  99   1.488   7.977  12.688
  806    HA   MET  99           HA       MET  99  -0.034   7.498  15.183
  807    HB2  MET  99           HB2      MET  99  -0.698   9.893  15.330
  808    HB3  MET  99           HB1      MET  99   1.029   9.668  15.596
  809    HG2  MET  99           HG2      MET  99   1.292  10.114  13.068
  810    HG3  MET  99           HG1      MET  99  -0.363  10.721  13.133
  811    HE1  MET  99           HE1      MET  99  -1.064  12.352  15.273
  812    HE2  MET  99           HE2      MET  99  -0.981  12.962  13.621
  813    HE3  MET  99           HE3      MET  99  -0.330  13.928  14.942
  814    HA   PRO 100           HA       PRO 100  -3.241   6.969  12.140
  815    HB2  PRO 100           HB2      PRO 100  -5.487   7.340  13.680
  816    HB3  PRO 100           HB1      PRO 100  -4.475   5.887  13.774
  817    HG2  PRO 100           HG2      PRO 100  -4.503   8.278  15.559
  818    HG3  PRO 100           HG1      PRO 100  -4.382   6.559  15.980
  819    HD2  PRO 100           HD2      PRO 100  -2.199   8.198  15.904
  820    HD3  PRO 100           HD1      PRO 100  -2.104   6.466  15.519
  821    H    LEU 101           HN       LEU 101  -4.585   8.167  10.771
  822    HA   LEU 101           HA       LEU 101  -4.553  11.121  11.200
  823    HB2  LEU 101           HB2      LEU 101  -5.196   9.507   8.715
  824    HB3  LEU 101           HB1      LEU 101  -4.978  11.255   8.794
  825    HG   LEU 101           HG       LEU 101  -2.856   9.191   9.464
  826   HD11  LEU 101          HD11      LEU 101  -1.773  10.180   7.381
  827   HD12  LEU 101          HD12      LEU 101  -3.328  10.936   7.035
  828   HD13  LEU 101          HD13      LEU 101  -3.195   9.178   7.093
  829   HD21  LEU 101          HD21      LEU 101  -1.423  11.387   9.247
  830   HD22  LEU 101          HD22      LEU 101  -2.292  11.079  10.747
  831   HD23  LEU 101          HD23      LEU 101  -2.953  12.206   9.563
  832    H    LEU 102           HN       LEU 102  -6.614   8.384  11.276
  833    HA   LEU 102           HA       LEU 102  -9.013  10.170  11.479
  834    HB2  LEU 102           HB2      LEU 102  -8.835   7.507  10.042
  835    HB3  LEU 102           HB1      LEU 102 -10.329   8.396  10.325
  836    HG   LEU 102           HG       LEU 102  -7.944   9.475   8.795
  837   HD11  LEU 102          HD11      LEU 102  -8.956   7.604   7.589
  838   HD12  LEU 102          HD12      LEU 102  -9.376   9.119   6.789
  839   HD13  LEU 102          HD13      LEU 102 -10.562   8.302   7.805
  840   HD21  LEU 102          HD21      LEU 102  -9.926  11.041   7.982
  841   HD22  LEU 102          HD22      LEU 102  -9.111  11.378   9.504
  842   HD23  LEU 102          HD23      LEU 102 -10.669  10.555   9.506
  843    H    ASP 103           HN       ASP 103  -8.930   6.664  11.613
  844    HA   ASP 103           HA       ASP 103  -9.520   5.193  13.323
  845    HB2  ASP 103           HB2      ASP 103  -7.922   7.287  14.815
  846    HB3  ASP 103           HB1      ASP 103  -8.651   5.923  15.661
  847    H    GLN 104           HN       GLN 104 -11.488   7.066  12.483
  848    HA   GLN 104           HA       GLN 104 -12.774   8.289  14.758
  849    HB2  GLN 104           HB2      GLN 104 -13.808   7.541  12.012
  850    HB3  GLN 104           HB1      GLN 104 -14.741   8.462  13.193
  851    HG2  GLN 104           HG2      GLN 104 -12.005   9.285  12.180
  852    HG3  GLN 104           HG1      GLN 104 -13.524   9.905  11.532
  853   HE21  GLN 104          HE21      GLN 104 -14.732  11.420  12.835
  854   HE22  GLN 104          HE22      GLN 104 -14.105  12.085  14.265
  855    H    ARG 105           HN       ARG 105 -13.677   7.207  16.366
  856    HA   ARG 105           HA       ARG 105 -14.376   4.410  16.224
  857    HB2  ARG 105           HB2      ARG 105 -13.702   5.706  18.313
  858    HB3  ARG 105           HB1      ARG 105 -15.304   6.436  18.268
  859    HG2  ARG 105           HG2      ARG 105 -15.695   4.637  19.696
  860    HG3  ARG 105           HG1      ARG 105 -16.133   3.927  18.143
  861    HD2  ARG 105           HD2      ARG 105 -13.823   2.993  17.961
  862    HD3  ARG 105           HD1      ARG 105 -13.460   3.646  19.556
  863    HE   ARG 105           HE       ARG 105 -15.796   2.049  19.775
  864   HH11  ARG 105          HH21      ARG 105 -12.422   1.812  19.087
  865   HH12  ARG 105          HH22      ARG 105 -12.286   0.190  19.681
  866   HH21  ARG 105          HH11      ARG 105 -15.634  -0.053  20.543
  867   HH22  ARG 105          HH12      ARG 105 -14.106  -0.866  20.505
  868    H    TYR 106           HN       TYR 106 -16.175   7.446  16.057
  869    HA   TYR 106           HA       TYR 106 -18.822   6.492  16.195
  870    HB2  TYR 106           HB2      TYR 106 -17.964   8.622  14.228
  871    HB3  TYR 106           HB1      TYR 106 -19.458   8.534  15.162
  872    HD1  TYR 106           HD1      TYR 106 -19.401   8.941  17.635
  873    HD2  TYR 106           HD2      TYR 106 -15.969   9.570  15.130
  874    HE1  TYR 106           HE1      TYR 106 -18.350  10.307  19.418
  875    HE2  TYR 106           HE2      TYR 106 -14.915  10.935  16.911
  876    HH   TYR 106           HH       TYR 106 -16.501  12.265  19.391
  877    H    LEU 107           HN       LEU 107 -16.793   6.912  13.296
  878    HA   LEU 107           HA       LEU 107 -18.710   5.722  11.495
  879    HB2  LEU 107           HB2      LEU 107 -15.710   5.956  11.143
  880    HB3  LEU 107           HB1      LEU 107 -16.914   5.786   9.865
  881    HG   LEU 107           HG       LEU 107 -16.710   8.126  11.788
  882   HD11  LEU 107          HD11      LEU 107 -15.822   9.392   9.975
  883   HD12  LEU 107          HD12      LEU 107 -16.210   8.131   8.805
  884   HD13  LEU 107          HD13      LEU 107 -14.913   7.880   9.973
  885   HD21  LEU 107          HD21      LEU 107 -18.643   7.390   9.587
  886   HD22  LEU 107          HD22      LEU 107 -18.344   9.084   9.974
  887   HD23  LEU 107          HD23      LEU 107 -18.988   8.002  11.206
  888    H    LEU 108           HN       LEU 108 -16.121   4.474  13.501
  889    HA   LEU 108           HA       LEU 108 -15.836   1.933  12.247
  890    HB2  LEU 108           HB2      LEU 108 -14.528   3.142  14.250
  891    HB3  LEU 108           HB1      LEU 108 -15.588   2.131  15.228
  892    HG   LEU 108           HG       LEU 108 -13.696   1.191  13.056
  893   HD11  LEU 108          HD11      LEU 108 -12.719  -0.068  15.036
  894   HD12  LEU 108          HD12      LEU 108 -13.705   0.960  16.071
  895   HD13  LEU 108          HD13      LEU 108 -12.465   1.675  15.038
  896   HD21  LEU 108          HD21      LEU 108 -15.522  -0.291  12.904
  897   HD22  LEU 108          HD22      LEU 108 -15.842  -0.227  14.636
  898   HD23  LEU 108          HD23      LEU 108 -14.440  -1.107  14.030
  899    H    THR 109           HN       THR 109 -17.976   2.972  14.905
  900    HA   THR 109           HA       THR 109 -19.724   0.605  14.330
  901    HB   THR 109           HB       THR 109 -20.081   0.279  16.719
  902    HG1  THR 109           HG1      THR 109 -18.095   2.198  17.237
  903   HG21  THR 109          HG21      THR 109 -17.976  -0.659  15.508
  904   HG22  THR 109          HG22      THR 109 -18.014  -0.703  17.271
  905   HG23  THR 109          HG23      THR 109 -17.094   0.551  16.442
  906    H    GLY 110           HN       GLY 110 -19.402   3.845  15.715
  907    HA2  GLY 110           HA2      GLY 110 -20.958   5.587  15.919
  908    HA3  GLY 110           HA1      GLY 110 -21.750   4.870  14.519
  909    H    GLY 111           HN       GLY 111 -23.868   4.719  15.008
  910    HA2  GLY 111           HA2      GLY 111 -25.787   3.817  16.051
  911    HA3  GLY 111           HA1      GLY 111 -24.741   3.032  17.233
  912    H    GLN 112           HN       GLN 112 -24.488   6.452  16.568
  913    HA   GLN 112           HA       GLN 112 -24.475   7.369  19.170
  914    HB2  GLN 112           HB2      GLN 112 -25.681   8.687  16.727
  915    HB3  GLN 112           HB1      GLN 112 -25.427   9.527  18.257
  916    HG2  GLN 112           HG2      GLN 112 -23.487  10.008  16.971
  917    HG3  GLN 112           HG1      GLN 112 -22.979   8.745  18.090
  918   HE21  GLN 112          HE21      GLN 112 -23.533   9.495  14.711
  919   HE22  GLN 112          HE22      GLN 112 -23.021   7.997  14.097
  920    H    LEU 113           HN       LEU 113 -26.097   8.430  20.511
  921    HA   LEU 113           HA       LEU 113 -28.475   6.815  20.793
  922    HB2  LEU 113           HB2      LEU 113 -27.329   7.743  22.746
  923    HB3  LEU 113           HB1      LEU 113 -27.633   9.380  22.173
  924    HG   LEU 113           HG       LEU 113 -30.055   9.040  22.399
  925   HD11  LEU 113          HD11      LEU 113 -30.477   6.776  21.960
  926   HD12  LEU 113          HD12      LEU 113 -30.697   6.852  23.706
  927   HD13  LEU 113          HD13      LEU 113 -29.193   6.222  23.034
  928   HD21  LEU 113          HD21      LEU 113 -28.674   8.082  24.922
  929   HD22  LEU 113          HD22      LEU 113 -30.167   9.015  24.803
  930   HD23  LEU 113          HD23      LEU 113 -28.627   9.756  24.367
  931    H    GLU 114           HN       GLU 114 -30.488   7.192  20.013
  932    HA   GLU 114           HA       GLU 114 -30.993   9.777  18.584
  933    HB2  GLU 114           HB2      GLU 114 -31.053   7.722  17.196
  934    HB3  GLU 114           HB1      GLU 114 -32.337   7.088  18.228
  935    HG2  GLU 114           HG2      GLU 114 -33.782   8.970  17.642
  936    HG3  GLU 114           HG1      GLU 114 -32.491   9.690  16.682
  937    H    HIS 115           HN       HIS 115 -32.463  11.108  19.478
  938    HA   HIS 115           HA       HIS 115 -34.019  10.224  21.807
  939    HB2  HIS 115           HB2      HIS 115 -33.873  12.896  20.378
  940    HB3  HIS 115           HB1      HIS 115 -34.717  12.608  21.901
  941    HD1  HIS 115           HD1      HIS 115 -33.107  11.599  23.886
  942    HD2  HIS 115           HD2      HIS 115 -31.184  13.497  20.709
  943    HE1  HIS 115           HE1      HIS 115 -30.769  12.150  24.690
  944    H    HIS 116           HN       HIS 116 -35.915   9.215  21.504
  945    HA   HIS 116           HA       HIS 116 -37.393   9.215  19.036
  946    HB2  HIS 116           HB2      HIS 116 -38.148   8.411  21.856
  947    HB3  HIS 116           HB1      HIS 116 -39.167   8.112  20.449
  948    HD1  HIS 116           HD1      HIS 116 -37.949   6.649  18.485
  949    HD2  HIS 116           HD2      HIS 116 -36.229   6.456  22.277
  950    HE1  HIS 116           HE1      HIS 116 -36.457   4.605  18.490
  951    H    HIS 117           HN       HIS 117 -37.803  10.966  22.112
  952    HA   HIS 117           HA       HIS 117 -39.369  13.023  20.696
  953    HB2  HIS 117           HB2      HIS 117 -41.299  12.884  22.191
  954    HB3  HIS 117           HB1      HIS 117 -41.078  11.352  21.351
  955    HD1  HIS 117           HD1      HIS 117 -42.573  11.457  24.052
  956    HD2  HIS 117           HD2      HIS 117 -38.494  10.668  23.714
  957    HE1  HIS 117           HE1      HIS 117 -41.915  10.177  26.134
  958    H    HIS 118           HN       HIS 118 -39.850  14.897  22.179
  959    HA   HIS 118           HA       HIS 118 -37.632  15.215  24.161
  960    HB2  HIS 118           HB2      HIS 118 -39.285  17.240  22.633
  961    HB3  HIS 118           HB1      HIS 118 -38.090  17.665  23.857
  962    HD1  HIS 118           HD1      HIS 118 -38.420  16.439  20.338
  963    HD2  HIS 118           HD2      HIS 118 -35.366  17.143  23.089
  964    HE1  HIS 118           HE1      HIS 118 -36.248  16.391  19.030
  965    H    HIS 119           HN       HIS 119 -38.148  15.318  26.280
  966    HA   HIS 119           HA       HIS 119 -40.949  15.215  27.108
  967    HB2  HIS 119           HB2      HIS 119 -40.042  14.916  29.364
  968    HB3  HIS 119           HB1      HIS 119 -39.212  13.855  28.229
  969    HD1  HIS 119           HD1      HIS 119 -36.737  14.390  27.666
  970    HD2  HIS 119           HD2      HIS 119 -38.431  17.020  30.421
  971    HE1  HIS 119           HE1      HIS 119 -34.822  15.711  28.669
  972    H    HIS 120           HN       HIS 120 -42.095  16.797  28.153
  973    HA   HIS 120           HA       HIS 120 -41.418  19.538  27.700
  974    HB2  HIS 120           HB2      HIS 120 -43.413  18.305  29.621
  975    HB3  HIS 120           HB1      HIS 120 -43.378  20.006  29.153
  976    HD1  HIS 120           HD1      HIS 120 -43.596  20.410  26.447
  977    HD2  HIS 120           HD2      HIS 120 -44.890  16.719  27.888
  978    HE1  HIS 120           HE1      HIS 120 -45.071  19.416  24.645