*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   18-OCT-09   2KPQ              
*TITLE     NMR STRUCTURE OF AGROBACTERIUM TUMEFACIENS PROTEIN ATU1219:           
*TITLE    2 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET ATT14                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UNCHARACTERIZED PROTEIN;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: AGROBACTERIUM TUMEFACIENS STR. C58;             
*SOURCE   3 ORGANISM_TAXID: 176299;                                              
*SOURCE   4 STRAIN: C58 / ATCC33970;                                             
*SOURCE   5 GENE: AGR_C_2251, ATU1219;                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET11                                      
*KEYWDS    PROTEIN, STRUCTURAL GENOMICS, PSI-2, PROTEIN STRUCTURE                
*KEYWDS   2 INITIATIVE, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM, NESG           
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    J.R.CORT, A.YEE, C.H.ARROWSMITH, G.T.MONTELIONE,                      
*AUTHOR   2 M.A.KENNEDY, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM                
*AUTHOR   3 (NESG)                                                               
*REVDAT   1   08-DEC-09 2KPQ    0                                                


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assign (resid  69 and name O    )(resid  73 and name N    )  2.60  0.00  0.70
assign (resid  70 and name O    )(resid  74 and name HN   )  1.60  0.00  0.70
assign (resid  70 and name O    )(resid  74 and name N    )  2.60  0.00  0.70
assign (resid  71 and name O    )(resid  75 and name HN   )  1.60  0.00  0.70
assign (resid  71 and name O    )(resid  75 and name N    )  2.60  0.00  0.70
assign (resid  72 and name O    )(resid  76 and name HN   )  1.60  0.00  0.70
assign (resid  72 and name O    )(resid  76 and name N    )  2.60  0.00  0.70
assign (resid  73 and name O    )(resid  77 and name HN   )  1.60  0.00  0.70
assign (resid  73 and name O    )(resid  77 and name HN   )  1.60  0.00  0.70
assign (resid  74 and name O    )(resid  78 and name HN   )  1.60  0.00  0.70
assign (resid  74 and name O    )(resid  78 and name HN   )  1.60  0.00  0.70

                                                                                                                                                                    
! PHI for VAL 17
assign (resid  16        and name C   )  (resid  17     and name N   )
       (resid  17        and name CA  )  (resid  17     and name C   )  1.0 -126.97 30 2
 
! PSI for VAL 17
assign (resid  17        and name N   )  (resid  17     and name CA  )
       (resid  17        and name C   )  (resid  18     and name N   )  1.0 127.53 40 2
 
! PHI for THR 18
assign (resid  17        and name C   )  (resid  18     and name N   )
       (resid  18        and name CA  )  (resid  18     and name C   )  1.0 -108.5 30 2
 
! PSI for THR 18
assign (resid  18        and name N   )  (resid  18     and name CA  )
       (resid  18        and name C   )  (resid  19     and name N   )  1.0 126.4 40 2
 
! PHI for ILE 19
assign (resid  18        and name C   )  (resid  19     and name N   )
       (resid  19        and name CA  )  (resid  19     and name C   )  1.0 -118.86 30 2
 
! PSI for ILE 19
assign (resid  19        and name N   )  (resid  19     and name CA  )
       (resid  19        and name C   )  (resid  20     and name N   )  1.0 144.5 40 2
 
! PHI for SER 20
assign (resid  19        and name C   )  (resid  20     and name N   )
       (resid  20        and name CA  )  (resid  20     and name C   )  1.0 -104.39 30 2
 
! PSI for SER 20
assign (resid  20        and name N   )  (resid  20     and name CA  )
       (resid  20        and name C   )  (resid  21     and name N   )  1.0 134.81 40 2
 
! PHI for GLN 22
assign (resid  21        and name C   )  (resid  22     and name N   )
       (resid  22        and name CA  )  (resid  22     and name C   )  1.0 -59.54 30 2
 
! PSI for GLN 22
assign (resid  22        and name N   )  (resid  22     and name CA  )
       (resid  22        and name C   )  (resid  23     and name N   )  1.0 -29.805 40 2
 
! PHI for ASN 23
assign (resid  22        and name C   )  (resid  23     and name N   )
       (resid  23        and name CA  )  (resid  23     and name C   )  1.0 -93.72 30 2
 
! PSI for ASN 23
assign (resid  23        and name N   )  (resid  23     and name CA  )
       (resid  23        and name C   )  (resid  24     and name N   )  1.0 1.17 40 2
 
! PHI for ARG 27
assign (resid  26        and name C   )  (resid  27     and name N   )
       (resid  27        and name CA  )  (resid  27     and name C   )  1.0 -100.52 30 2
 
! PSI for ARG 27
assign (resid  27        and name N   )  (resid  27     and name CA  )
       (resid  27        and name C   )  (resid  28     and name N   )  1.0 120.46 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 -107.28 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   )  1.0 124.93 40 2
 
! PHI for VAL 32
assign (resid  31        and name C   )  (resid  32     and name N   )
       (resid  32        and name CA  )  (resid  32     and name C   )  1.0 -63.02 30 2
 
! PSI for VAL 32
assign (resid  32        and name N   )  (resid  32     and name CA  )
       (resid  32        and name C   )  (resid  33     and name N   )  1.0 -40.82 40 2
 
! PHI for TYR 33
assign (resid  32        and name C   )  (resid  33     and name N   )
       (resid  33        and name CA  )  (resid  33     and name C   )  1.0 -61.01 30 2
 
! PSI for TYR 33
assign (resid  33        and name N   )  (resid  33     and name CA  )
       (resid  33        and name C   )  (resid  34     and name N   )  1.0 -41.81 40 2
 
! PHI for GLU 34
assign (resid  33        and name C   )  (resid  34     and name N   )
       (resid  34        and name CA  )  (resid  34     and name C   )  1.0 -64.28 30 2
 
! PSI for GLU 34
assign (resid  34        and name N   )  (resid  34     and name CA  )
       (resid  34        and name C   )  (resid  35     and name N   )  1.0 -36.58 40 2
 
! PHI for ALA 35
assign (resid  34        and name C   )  (resid  35     and name N   )
       (resid  35        and name CA  )  (resid  35     and name C   )  1.0 -64.66 30 2
 
! PSI for ALA 35
assign (resid  35        and name N   )  (resid  35     and name CA  )
       (resid  35        and name C   )  (resid  36     and name N   )  1.0 -43.49 40 2
 
! PHI for PHE 36
assign (resid  35        and name C   )  (resid  36     and name N   )
       (resid  36        and name CA  )  (resid  36     and name C   )  1.0 -63.13 30 2
 
! PSI for PHE 36
assign (resid  36        and name N   )  (resid  36     and name CA  )
       (resid  36        and name C   )  (resid  37     and name N   )  1.0 -43.44 40 2
 
! PHI for ASP 37
assign (resid  36        and name C   )  (resid  37     and name N   )
       (resid  37        and name CA  )  (resid  37     and name C   )  1.0 -66.65 30 2
 
! PSI for ASP 37
assign (resid  37        and name N   )  (resid  37     and name CA  )
       (resid  37        and name C   )  (resid  38     and name N   )  1.0 -41.17 40 2
 
! PHI for PHE 38
assign (resid  37        and name C   )  (resid  38     and name N   )
       (resid  38        and name CA  )  (resid  38     and name C   )  1.0 -60.48 30 2
 
! PSI for PHE 38
assign (resid  38        and name N   )  (resid  38     and name CA  )
       (resid  38        and name C   )  (resid  39     and name N   )  1.0 -45.28 40 2
 
! PHI for LEU 39
assign (resid  38        and name C   )  (resid  39     and name N   )
       (resid  39        and name CA  )  (resid  39     and name C   )  1.0 -63.43 30 2
 
! PSI for LEU 39
assign (resid  39        and name N   )  (resid  39     and name CA  )
       (resid  39        and name C   )  (resid  40     and name N   )  1.0 -39.91 40 2
 
! PHI for GLN 40
assign (resid  39        and name C   )  (resid  40     and name N   )
       (resid  40        and name CA  )  (resid  40     and name C   )  1.0 -70.64 30 2
 
! PSI for GLN 40
assign (resid  40        and name N   )  (resid  40     and name CA  )
       (resid  40        and name C   )  (resid  41     and name N   )  1.0 -30.18 40 2
 
! PHI for TRP 43
assign (resid  42        and name C   )  (resid  43     and name N   )
       (resid  43        and name CA  )  (resid  43     and name C   )  1.0 -94.58 30 2
 
! PSI for TRP 43
assign (resid  43        and name N   )  (resid  43     and name CA  )
       (resid  43        and name C   )  (resid  44     and name N   )  1.0 124.76 40 2
 
! PHI for GLY 47
assign (resid  46        and name C   )  (resid  47     and name N   )
       (resid  47        and name CA  )  (resid  47     and name C   )  1.0 155.08 30 2
 
! PSI for GLY 47
assign (resid  47        and name N   )  (resid  47     and name CA  )
       (resid  47        and name C   )  (resid  48     and name N   )  1.0 -58.34 40 2
 
! PHI for ARG 49
assign (resid  48        and name C   )  (resid  49     and name N   )
       (resid  49        and name CA  )  (resid  49     and name C   )  1.0 -58.21 30 2
 
! PSI for ARG 49
assign (resid  49        and name N   )  (resid  49     and name CA  )
       (resid  49        and name C   )  (resid  50     and name N   )  1.0 -40.05 40 2
 
! PHI for ALA 50
assign (resid  49        and name C   )  (resid  50     and name N   )
       (resid  50        and name CA  )  (resid  50     and name C   )  1.0 -64.14 30 2
 
! PSI for ALA 50
assign (resid  50        and name N   )  (resid  50     and name CA  )
       (resid  50        and name C   )  (resid  51     and name N   )  1.0 -40.31 40 2
 
! PHI for HIS 51
assign (resid  50        and name C   )  (resid  51     and name N   )
       (resid  51        and name CA  )  (resid  51     and name C   )  1.0 -64.79 30 2
 
! PSI for HIS 51
assign (resid  51        and name N   )  (resid  51     and name CA  )
       (resid  51        and name C   )  (resid  52     and name N   )  1.0 -44.49 40 2
 
! PHI for GLU 52
assign (resid  51        and name C   )  (resid  52     and name N   )
       (resid  52        and name CA  )  (resid  52     and name C   )  1.0 -60.74 30 2
 
! PSI for GLU 52
assign (resid  52        and name N   )  (resid  52     and name CA  )
       (resid  52        and name C   )  (resid  53     and name N   )  1.0 -41.74 40 2
 
! PHI for GLN 53
assign (resid  52        and name C   )  (resid  53     and name N   )
       (resid  53        and name CA  )  (resid  53     and name C   )  1.0 -61.74 30 2
 
! PSI for GLN 53
assign (resid  53        and name N   )  (resid  53     and name CA  )
       (resid  53        and name C   )  (resid  54     and name N   )  1.0 -40.36 40 2
 
! PHI for ALA 54
assign (resid  53        and name C   )  (resid  54     and name N   )
       (resid  54        and name CA  )  (resid  54     and name C   )  1.0 -64.88 30 2
 
! PSI for ALA 54
assign (resid  54        and name N   )  (resid  54     and name CA  )
       (resid  54        and name C   )  (resid  55     and name N   )  1.0 -41.17 40 2
 
! PHI for LEU 55
assign (resid  54        and name C   )  (resid  55     and name N   )
       (resid  55        and name CA  )  (resid  55     and name C   )  1.0 -59.18 30 2
 
! PSI for LEU 55
assign (resid  55        and name N   )  (resid  55     and name CA  )
       (resid  55        and name C   )  (resid  56     and name N   )  1.0 -42.69 40 2
 
! PHI for ARG 56
assign (resid  55        and name C   )  (resid  56     and name N   )
       (resid  56        and name CA  )  (resid  56     and name C   )  1.0 -66.29 30 2
 
! PSI for ARG 56
assign (resid  56        and name N   )  (resid  56     and name CA  )
       (resid  56        and name C   )  (resid  57     and name N   )  1.0 -39.37 40 2
 
! PHI for LEU 57
assign (resid  56        and name C   )  (resid  57     and name N   )
       (resid  57        and name CA  )  (resid  57     and name C   )  1.0 -62.27 30 2
 
! PSI for LEU 57
assign (resid  57        and name N   )  (resid  57     and name CA  )
       (resid  57        and name C   )  (resid  58     and name N   )  1.0 -44.01 40 2
 
! PHI for CYS 58
assign (resid  57        and name C   )  (resid  58     and name N   )
       (resid  58        and name CA  )  (resid  58     and name C   )  1.0 -64.19 30 2
 
! PSI for CYS 58
assign (resid  58        and name N   )  (resid  58     and name CA  )
       (resid  58        and name C   )  (resid  59     and name N   )  1.0 -43.02 40 2
 
! PHI for ARG 59
assign (resid  58        and name C   )  (resid  59     and name N   )
       (resid  59        and name CA  )  (resid  59     and name C   )  1.0 -63.73 30 2
 
! PSI for ARG 59
assign (resid  59        and name N   )  (resid  59     and name CA  )
       (resid  59        and name C   )  (resid  60     and name N   )  1.0 -44.65 40 2
 
! PHI for ALA 60
assign (resid  59        and name C   )  (resid  60     and name N   )
       (resid  60        and name CA  )  (resid  60     and name C   )  1.0 -61.25 30 2
 
! PSI for ALA 60
assign (resid  60        and name N   )  (resid  60     and name CA  )
       (resid  60        and name C   )  (resid  61     and name N   )  1.0 -39.48 40 2
 
! PHI for SER 61
assign (resid  60        and name C   )  (resid  61     and name N   )
       (resid  61        and name CA  )  (resid  61     and name C   )  1.0 -66.18 30 2
 
! PSI for SER 61
assign (resid  61        and name N   )  (resid  61     and name CA  )
       (resid  61        and name C   )  (resid  62     and name N   )  1.0 -38.27 40 2
 
! PHI for LEU 62
assign (resid  61        and name C   )  (resid  62     and name N   )
       (resid  62        and name CA  )  (resid  62     and name C   )  1.0 -66.22 30 2
 
! PSI for LEU 62
assign (resid  62        and name N   )  (resid  62     and name CA  )
       (resid  62        and name C   )  (resid  63     and name N   )  1.0 -23.38 40 2
 
! PHI for VAL 66
assign (resid  65        and name C   )  (resid  66     and name N   )
       (resid  66        and name CA  )  (resid  66     and name C   )  1.0 -114.31 30 2
 
! PSI for VAL 66
assign (resid  66        and name N   )  (resid  66     and name CA  )
       (resid  66        and name C   )  (resid  67     and name N   )  1.0 149.97 40 2
 
! PHI for GLU 69
assign (resid  68        and name C   )  (resid  69     and name N   )
       (resid  69        and name CA  )  (resid  69     and name C   )  1.0 -63.79 30 2
 
! PSI for GLU 69
assign (resid  69        and name N   )  (resid  69     and name CA  )
       (resid  69        and name C   )  (resid  70     and name N   )  1.0 -39.87 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 -68.92 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 -37.26 40 2
 
! PHI for ALA 71
assign (resid  70        and name C   )  (resid  71     and name N   )
       (resid  71        and name CA  )  (resid  71     and name C   )  1.0 -67.8 30 2
 
! PSI for ALA 71
assign (resid  71        and name N   )  (resid  71     and name CA  )
       (resid  71        and name C   )  (resid  72     and name N   )  1.0 -40.04 40 2
 
! PHI for ARG 72
assign (resid  71        and name C   )  (resid  72     and name N   )
       (resid  72        and name CA  )  (resid  72     and name C   )  1.0 -66.11 30 2
 
! PSI for ARG 72
assign (resid  72        and name N   )  (resid  72     and name CA  )
       (resid  72        and name C   )  (resid  73     and name N   )  1.0 -41.96 40 2
 
! PHI for THR 73
assign (resid  72        and name C   )  (resid  73     and name N   )
       (resid  73        and name CA  )  (resid  73     and name C   )  1.0 -63.72 30 2
 
! PSI for THR 73
assign (resid  73        and name N   )  (resid  73     and name CA  )
       (resid  73        and name C   )  (resid  74     and name N   )  1.0 -44.63 40 2
 
! PHI for ALA 74
assign (resid  73        and name C   )  (resid  74     and name N   )
       (resid  74        and name CA  )  (resid  74     and name C   )  1.0 -66.39 30 2
 
! PSI for ALA 74
assign (resid  74        and name N   )  (resid  74     and name CA  )
       (resid  74        and name C   )  (resid  75     and name N   )  1.0 -33.57 40 2
 
! PHI for PHE 75
assign (resid  74        and name C   )  (resid  75     and name N   )
       (resid  75        and name CA  )  (resid  75     and name C   )  1.0 -66.74 30 2
 
! PSI for PHE 75
assign (resid  75        and name N   )  (resid  75     and name CA  )
       (resid  75        and name C   )  (resid  76     and name N   )  1.0 -39.87 40 2
 
! PHI for VAL 76
assign (resid  75        and name C   )  (resid  76     and name N   )
       (resid  76        and name CA  )  (resid  76     and name C   )  1.0 -64.72 30 2
 
! PSI for VAL 76
assign (resid  76        and name N   )  (resid  76     and name CA  )
       (resid  76        and name C   )  (resid  77     and name N   )  1.0 -43.68 40 2
 
! PHI for ALA 77
assign (resid  76        and name C   )  (resid  77     and name N   )
       (resid  77        and name CA  )  (resid  77     and name C   )  1.0 -61.43 30 2
 
! PSI for ALA 77
assign (resid  77        and name N   )  (resid  77     and name CA  )
       (resid  77        and name C   )  (resid  78     and name N   )  1.0 -40.1 40 2
 
! PHI for ALA 78
assign (resid  77        and name C   )  (resid  78     and name N   )
       (resid  78        and name CA  )  (resid  78     and name C   )  1.0 -65.68 30 2
 
! PSI for ALA 78
assign (resid  78        and name N   )  (resid  78     and name CA  )
       (resid  78        and name C   )  (resid  79     and name N   )  1.0 -34.68 40 2
 
! PHI for SER 79
assign (resid  78        and name C   )  (resid  79     and name N   )
       (resid  79        and name CA  )  (resid  79     and name C   )  1.0 -66.88 30 2
 
! PSI for SER 79
assign (resid  79        and name N   )  (resid  79     and name CA  )
       (resid  79        and name C   )  (resid  80     and name N   )  1.0 -42.98 40 2
 
! PHI for ARG 80
assign (resid  79        and name C   )  (resid  80     and name N   )
       (resid  80        and name CA  )  (resid  80     and name C   )  1.0 -63.19 30 2
 
! PSI for ARG 80
assign (resid  80        and name N   )  (resid  80     and name CA  )
       (resid  80        and name C   )  (resid  81     and name N   )  1.0 -40.91 40 2
 
! PHI for GLN 81
assign (resid  80        and name C   )  (resid  81     and name N   )
       (resid  81        and name CA  )  (resid  81     and name C   )  1.0 -64.96 30 2
 
! PSI for GLN 81
assign (resid  81        and name N   )  (resid  81     and name CA  )
       (resid  81        and name C   )  (resid  82     and name N   )  1.0 -27.96 40 2
 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1 -22.227  11.142  14.113
    2    H2   MET   1           2H       MET   1 -22.457  11.110  15.793
    3    H3   MET   1           3H       MET   1 -23.796  11.028  14.753
    4    HA   MET   1           HA       MET   1 -23.253   8.871  15.714
    5    HB2  MET   1           1HB      MET   1 -22.891   9.245  12.743
    6    HB3  MET   1           2HB      MET   1 -22.943   7.651  13.478
    7    HG2  MET   1           1HG      MET   1 -25.185   8.135  14.338
    8    HG3  MET   1           2HG      MET   1 -25.125   9.718  13.563
    9    HE1  MET   1           3HE      MET   1 -24.977   5.771  11.165
   10    HE2  MET   1           1HE      MET   1 -25.023   5.821  12.927
   11    HE3  MET   1           2HE      MET   1 -23.606   6.418  12.063
   12    H    GLU   2           H        GLU   2 -21.690   7.673  16.581
   13    HA   GLU   2           HA       GLU   2 -18.934   8.197  16.069
   14    HB2  GLU   2           1HB      GLU   2 -20.247   5.868  17.486
   15    HB3  GLU   2           2HB      GLU   2 -18.521   6.198  17.483
   16    HG2  GLU   2           1HG      GLU   2 -19.023   8.399  18.545
   17    HG3  GLU   2           2HG      GLU   2 -20.698   7.870  18.703
   18    H    VAL   3           H        VAL   3 -18.066   7.729  14.170
   19    HA   VAL   3           HA       VAL   3 -19.124   5.649  12.493
   20    HB   VAL   3           HB       VAL   3 -17.341   6.280  10.906
   21   HG11  VAL   3          1HG1      VAL   3 -18.115   8.574  10.479
   22   HG12  VAL   3          2HG1      VAL   3 -18.857   8.609  12.078
   23   HG13  VAL   3          3HG1      VAL   3 -19.448   7.483  10.857
   24   HG21  VAL   3          3HG2      VAL   3 -15.880   8.184  11.400
   25   HG22  VAL   3          1HG2      VAL   3 -15.581   6.838  12.499
   26   HG23  VAL   3          2HG2      VAL   3 -16.506   8.236  13.047
   27    H    GLN   4           H        GLN   4 -17.885   3.894  11.617
   28    HA   GLN   4           HA       GLN   4 -16.385   2.510  13.631
   29    HB2  GLN   4           1HB      GLN   4 -16.910   1.737  10.754
   30    HB3  GLN   4           2HB      GLN   4 -16.310   0.671  12.019
   31    HG2  GLN   4           1HG      GLN   4 -18.403   1.013  13.264
   32    HG3  GLN   4           2HG      GLN   4 -19.003   2.006  11.940
   33   HE21  GLN   4          2HE2      GLN   4 -20.067  -0.439  13.055
   34   HE22  GLN   4          1HE2      GLN   4 -20.155  -1.574  11.748
   35    H    SER   5           H        SER   5 -15.622   4.727  11.255
   36    HA   SER   5           HA       SER   5 -12.866   3.903  10.929
   37    HB2  SER   5           1HB      SER   5 -14.190   6.514  10.142
   38    HB3  SER   5           2HB      SER   5 -12.652   5.886   9.549
   39    HG   SER   5           HG       SER   5 -14.306   3.981   9.023
   40    H    MET   6           H        MET   6 -11.407   6.191  11.251
   41    HA   MET   6           HA       MET   6 -11.881   6.869  14.081
   42    HB2  MET   6           1HB      MET   6  -9.206   6.460  12.723
   43    HB3  MET   6           2HB      MET   6  -9.442   6.943  14.397
   44    HG2  MET   6           1HG      MET   6 -10.281   4.326  13.175
   45    HG3  MET   6           2HG      MET   6  -8.886   4.586  14.217
   46    HE1  MET   6           3HE      MET   6 -10.008   6.582  16.420
   47    HE2  MET   6           1HE      MET   6  -9.035   5.158  16.786
   48    HE3  MET   6           2HE      MET   6 -10.546   5.437  17.649
   49    H    LEU   7           H        LEU   7 -10.597   8.888  14.715
   50    HA   LEU   7           HA       LEU   7 -11.109  10.954  12.727
   51    HB2  LEU   7           1HB      LEU   7 -11.805  11.282  15.087
   52    HB3  LEU   7           2HB      LEU   7 -10.125  11.190  15.580
   53    HG   LEU   7           HG       LEU   7  -9.647  13.226  14.259
   54   HD11  LEU   7          1HD1      LEU   7 -11.418  13.001  12.600
   55   HD12  LEU   7          2HD1      LEU   7 -11.490  14.568  13.404
   56   HD13  LEU   7          3HD1      LEU   7 -12.631  13.297  13.845
   57   HD21  LEU   7          3HD2      LEU   7 -10.742  14.792  15.765
   58   HD22  LEU   7          1HD2      LEU   7 -10.165  13.376  16.642
   59   HD23  LEU   7          2HD2      LEU   7 -11.880  13.537  16.260
   60    H    LEU   8           H        LEU   8  -8.459   9.419  14.435
   61    HA   LEU   8           HA       LEU   8  -6.437  11.060  13.201
   62    HB2  LEU   8           1HB      LEU   8  -6.231   8.458  14.719
   63    HB3  LEU   8           2HB      LEU   8  -4.863   9.428  14.206
   64    HG   LEU   8           HG       LEU   8  -6.992  10.311  16.158
   65   HD11  LEU   8          1HD1      LEU   8  -4.127   9.488  16.602
   66   HD12  LEU   8          2HD1      LEU   8  -5.559   8.583  17.090
   67   HD13  LEU   8          3HD1      LEU   8  -5.212  10.147  17.827
   68   HD21  LEU   8          3HD2      LEU   8  -4.452  11.656  15.236
   69   HD22  LEU   8          1HD2      LEU   8  -5.481  12.214  16.554
   70   HD23  LEU   8          2HD2      LEU   8  -6.102  12.187  14.903
   71    H    ASN   9           H        ASN   9  -8.254   8.314  12.343
   72    HA   ASN   9           HA       ASN   9  -6.568   7.973   9.956
   73    HB2  ASN   9           1HB      ASN   9  -7.098   5.991  11.846
   74    HB3  ASN   9           2HB      ASN   9  -8.227   5.655  10.535
   75   HD21  ASN   9          2HD2      ASN   9  -4.933   5.772  11.519
   76   HD22  ASN   9          1HD2      ASN   9  -4.264   5.006  10.120
   77    H    ASP  10           H        ASP  10  -7.715   9.353   8.718
   78    HA   ASP  10           HA       ASP  10 -10.398   9.902   8.729
   79    HB2  ASP  10           1HB      ASP  10  -8.598   9.906   6.298
   80    HB3  ASP  10           2HB      ASP  10 -10.094  10.818   6.485
   81    H    VAL  11           H        VAL  11  -8.742   7.502   6.745
   82    HA   VAL  11           HA       VAL  11 -11.354   6.251   6.262
   83    HB   VAL  11           HB       VAL  11 -10.608   7.135   4.162
   84   HG11  VAL  11          1HG1      VAL  11  -8.247   7.412   4.652
   85   HG12  VAL  11          2HG1      VAL  11  -8.465   6.524   3.144
   86   HG13  VAL  11          3HG1      VAL  11  -8.017   5.664   4.618
   87   HG21  VAL  11          3HG2      VAL  11 -10.103   4.161   4.269
   88   HG22  VAL  11          1HG2      VAL  11 -10.447   5.092   2.812
   89   HG23  VAL  11          2HG2      VAL  11 -11.668   4.948   4.075
   90    H    LYS  12           H        LYS  12 -11.508   4.502   7.438
   91    HA   LYS  12           HA       LYS  12  -9.140   2.996   8.183
   92    HB2  LYS  12           1HB      LYS  12 -10.867   3.472   9.880
   93    HB3  LYS  12           2HB      LYS  12 -12.042   2.574   8.929
   94    HG2  LYS  12           1HG      LYS  12 -10.836   0.524   9.276
   95    HG3  LYS  12           2HG      LYS  12  -9.529   1.388  10.086
   96    HD2  LYS  12           1HD      LYS  12 -11.089   2.056  11.857
   97    HD3  LYS  12           2HD      LYS  12 -12.378   1.158  11.051
   98    HE2  LYS  12           1HE      LYS  12 -11.149  -0.911  11.335
   99    HE3  LYS  12           2HE      LYS  12  -9.798  -0.035  12.052
  100    HZ1  LYS  12           3HZ      LYS  12 -11.249   0.621  13.878
  101    HZ2  LYS  12           1HZ      LYS  12 -11.145  -1.066  13.742
  102    HZ3  LYS  12           2HZ      LYS  12 -12.531  -0.261  13.197
  103    H    TRP  13           H        TRP  13  -8.826   0.803   7.675
  104    HA   TRP  13           HA       TRP  13  -9.912   0.136   5.054
  105    HB2  TRP  13           1HB      TRP  13  -7.375  -0.020   6.122
  106    HB3  TRP  13           2HB      TRP  13  -7.930  -1.687   6.224
  107    HD1  TRP  13           HD1      TRP  13  -9.702  -1.260   3.392
  108    HE1  TRP  13           HE1      TRP  13  -8.382  -1.471   1.192
  109    HE3  TRP  13           HE3      TRP  13  -4.983  -0.527   5.216
  110    HZ2  TRP  13           HZ2      TRP  13  -5.685  -1.353   0.350
  111    HZ3  TRP  13           HZ3      TRP  13  -3.089  -0.596   3.651
  112    HH2  TRP  13           HH2      TRP  13  -3.433  -1.001   1.267
  113    H    GLU  14           H        GLU  14  -9.936  -2.479   4.854
  114    HA   GLU  14           HA       GLU  14 -12.191  -3.336   6.324
  115    HB2  GLU  14           1HB      GLU  14 -10.234  -5.004   4.731
  116    HB3  GLU  14           2HB      GLU  14 -11.851  -5.493   5.221
  117    HG2  GLU  14           1HG      GLU  14 -11.141  -3.287   3.302
  118    HG3  GLU  14           2HG      GLU  14 -11.850  -4.850   2.902
  119    H    LYS  15           H        LYS  15  -8.778  -3.660   6.727
  120    HA   LYS  15           HA       LYS  15  -7.806  -3.713   8.866
  121    HB2  LYS  15           1HB      LYS  15  -9.919  -4.140  10.068
  122    HB3  LYS  15           2HB      LYS  15  -9.799  -5.840   9.634
  123    HG2  LYS  15           1HG      LYS  15  -7.632  -5.940  10.830
  124    HG3  LYS  15           2HG      LYS  15  -7.889  -4.275  11.352
  125    HD2  LYS  15           1HD      LYS  15  -9.933  -4.936  12.501
  126    HD3  LYS  15           2HD      LYS  15  -9.720  -6.598  11.947
  127    HE2  LYS  15           1HE      LYS  15  -8.940  -6.494  14.190
  128    HE3  LYS  15           2HE      LYS  15  -7.525  -6.623  13.148
  129    HZ1  LYS  15           3HZ      LYS  15  -7.375  -4.132  13.319
  130    HZ2  LYS  15           1HZ      LYS  15  -7.039  -4.984  14.745
  131    HZ3  LYS  15           2HZ      LYS  15  -8.535  -4.220  14.551
  132    HA   PRO  16           HA       PRO  16  -6.368  -8.221   8.233
  133    HB2  PRO  16           1HB      PRO  16  -7.534  -9.794   6.373
  134    HB3  PRO  16           2HB      PRO  16  -8.123  -9.689   8.036
  135    HG2  PRO  16           1HG      PRO  16  -9.141  -8.329   5.573
  136    HG3  PRO  16           2HG      PRO  16 -10.054  -9.114   6.875
  137    HD2  PRO  16           1HD      PRO  16  -9.724  -6.426   6.717
  138    HD3  PRO  16           2HD      PRO  16  -9.891  -7.289   8.258
  139    H    VAL  17           H        VAL  17  -5.372  -6.067   6.986
  140    HA   VAL  17           HA       VAL  17  -4.550  -7.039   4.322
  141    HB   VAL  17           HB       VAL  17  -4.369  -4.209   5.380
  142   HG11  VAL  17          1HG1      VAL  17  -3.854  -3.621   3.058
  143   HG12  VAL  17          2HG1      VAL  17  -3.889  -5.328   2.620
  144   HG13  VAL  17          3HG1      VAL  17  -2.657  -4.728   3.730
  145   HG21  VAL  17          3HG2      VAL  17  -6.190  -3.700   3.802
  146   HG22  VAL  17          1HG2      VAL  17  -6.693  -4.826   5.062
  147   HG23  VAL  17          2HG2      VAL  17  -6.337  -5.420   3.440
  148    H    THR  18           H        THR  18  -2.692  -8.104   4.506
  149    HA   THR  18           HA       THR  18  -0.756  -7.264   6.564
  150    HB   THR  18           HB       THR  18  -0.882  -9.924   5.146
  151    HG1  THR  18           HG1      THR  18  -2.800  -9.310   6.467
  152   HG21  THR  18          3HG2      THR  18   0.428  -9.060   7.726
  153   HG22  THR  18          1HG2      THR  18   1.257  -9.391   6.205
  154   HG23  THR  18          2HG2      THR  18   0.433 -10.693   7.062
  155    H    ILE  19           H        ILE  19   1.006  -6.250   5.884
  156    HA   ILE  19           HA       ILE  19   2.042  -6.783   3.185
  157    HB   ILE  19           HB       ILE  19   2.637  -4.584   5.170
  158   HG12  ILE  19          1HG1      ILE  19   0.600  -4.329   3.806
  159   HG13  ILE  19          2HG1      ILE  19   1.814  -3.122   3.390
  160   HG21  ILE  19          1HG2      ILE  19   4.740  -5.282   4.134
  161   HG22  ILE  19          2HG2      ILE  19   4.248  -3.683   3.579
  162   HG23  ILE  19          3HG2      ILE  19   4.018  -5.086   2.537
  163   HD11  ILE  19          3HD1      ILE  19   1.296  -5.649   1.846
  164   HD12  ILE  19          1HD1      ILE  19   2.422  -4.362   1.418
  165   HD13  ILE  19          2HD1      ILE  19   0.685  -4.049   1.426
  166    H    SER  20           H        SER  20   3.624  -8.225   2.987
  167    HA   SER  20           HA       SER  20   4.991  -9.202   5.341
  168    HB2  SER  20           1HB      SER  20   4.161 -10.753   3.567
  169    HB3  SER  20           2HB      SER  20   5.334 -10.049   2.453
  170    HG   SER  20           HG       SER  20   5.831 -12.078   3.831
  171    H    LEU  21           H        LEU  21   6.581  -7.940   6.072
  172    HA   LEU  21           HA       LEU  21   8.285  -6.481   4.233
  173    HB2  LEU  21           1HB      LEU  21   8.298  -6.621   7.249
  174    HB3  LEU  21           2HB      LEU  21   9.303  -5.556   6.283
  175    HG   LEU  21           HG       LEU  21   6.288  -5.473   6.392
  176   HD11  LEU  21          1HD1      LEU  21   6.599  -3.394   7.630
  177   HD12  LEU  21          2HD1      LEU  21   8.345  -3.643   7.616
  178   HD13  LEU  21          3HD1      LEU  21   7.302  -4.764   8.491
  179   HD21  LEU  21          3HD2      LEU  21   7.186  -4.740   4.243
  180   HD22  LEU  21          1HD2      LEU  21   8.275  -3.627   5.070
  181   HD23  LEU  21          2HD2      LEU  21   6.531  -3.380   5.155
  182    H    GLN  22           H        GLN  22  10.183  -7.164   3.542
  183    HA   GLN  22           HA       GLN  22  11.138  -9.756   4.050
  184    HB2  GLN  22           1HB      GLN  22  12.577  -7.378   2.855
  185    HB3  GLN  22           2HB      GLN  22  13.143  -9.041   2.782
  186    HG2  GLN  22           1HG      GLN  22  11.190  -9.670   1.484
  187    HG3  GLN  22           2HG      GLN  22  10.575  -8.022   1.591
  188   HE21  GLN  22          2HE2      GLN  22  11.283  -9.641  -0.752
  189   HE22  GLN  22          1HE2      GLN  22  12.460  -8.723  -1.619
  190    H    ASN  23           H        ASN  23  12.285  -6.589   5.160
  191    HA   ASN  23           HA       ASN  23  14.188  -7.915   6.950
  192    HB2  ASN  23           1HB      ASN  23  13.868  -5.029   6.116
  193    HB3  ASN  23           2HB      ASN  23  15.002  -5.554   7.355
  194   HD21  ASN  23          2HD2      ASN  23  15.574  -4.255   4.838
  195   HD22  ASN  23          1HD2      ASN  23  16.602  -5.340   3.956
  196    H    GLY  24           H        GLY  24  11.138  -7.572   7.253
  197    HA2  GLY  24           1HA      GLY  24  11.300  -6.727  10.057
  198    HA3  GLY  24           2HA      GLY  24  10.068  -6.020   9.021
  199    H    ALA  25           H        ALA  25   8.166  -6.956   9.063
  200    HA   ALA  25           HA       ALA  25   7.836  -9.802   9.324
  201    HB1  ALA  25           3HB      ALA  25   8.203  -9.188  11.667
  202    HB2  ALA  25           1HB      ALA  25   6.538  -9.707  11.406
  203    HB3  ALA  25           2HB      ALA  25   6.912  -7.991  11.562
  204    HA   PRO  26           HA       PRO  26   3.904  -9.019   7.290
  205    HB2  PRO  26           1HB      PRO  26   2.665 -10.610   9.486
  206    HB3  PRO  26           2HB      PRO  26   2.506 -10.793   7.735
  207    HG2  PRO  26           1HG      PRO  26   4.013 -12.475   9.129
  208    HG3  PRO  26           2HG      PRO  26   4.536 -11.903   7.533
  209    HD2  PRO  26           1HD      PRO  26   5.476 -11.083  10.245
  210    HD3  PRO  26           2HD      PRO  26   6.398 -11.273   8.740
  211    H    ARG  27           H        ARG  27   3.507  -6.892   7.615
  212    HA   ARG  27           HA       ARG  27   2.514  -6.011  10.218
  213    HB2  ARG  27           1HB      ARG  27   4.346  -4.726   9.259
  214    HB3  ARG  27           2HB      ARG  27   3.418  -4.448   7.793
  215    HG2  ARG  27           1HG      ARG  27   2.209  -2.787   8.713
  216    HG3  ARG  27           2HG      ARG  27   2.143  -3.564  10.298
  217    HD2  ARG  27           1HD      ARG  27   4.594  -2.225   9.156
  218    HD3  ARG  27           2HD      ARG  27   3.459  -1.447  10.262
  219    HE   ARG  27           HE       ARG  27   4.047  -3.462  11.764
  220   HH11  ARG  27          1HH1      ARG  27   6.285  -1.793   9.634
  221   HH12  ARG  27          2HH1      ARG  27   7.683  -2.214  10.568
  222   HH21  ARG  27          1HH2      ARG  27   5.896  -3.998  12.999
  223   HH22  ARG  27          2HH2      ARG  27   7.468  -3.448  12.476
  224    H    ILE  28           H        ILE  28   0.426  -6.111  10.504
  225    HA   ILE  28           HA       ILE  28  -1.405  -5.930   8.244
  226    HB   ILE  28           HB       ILE  28  -1.988  -6.538  11.151
  227   HG12  ILE  28          1HG1      ILE  28  -1.689  -8.417   8.795
  228   HG13  ILE  28          2HG1      ILE  28  -0.516  -8.220  10.093
  229   HG21  ILE  28          1HG2      ILE  28  -4.127  -7.399  10.298
  230   HG22  ILE  28          2HG2      ILE  28  -3.691  -6.850   8.680
  231   HG23  ILE  28          3HG2      ILE  28  -3.932  -5.676   9.974
  232   HD11  ILE  28          3HD1      ILE  28  -3.332  -9.238  10.411
  233   HD12  ILE  28          1HD1      ILE  28  -2.137  -9.067  11.697
  234   HD13  ILE  28          2HD1      ILE  28  -1.867 -10.220  10.391
  235    H    PHE  29           H        PHE  29  -2.313  -4.065   7.719
  236    HA   PHE  29           HA       PHE  29  -2.158  -1.820   9.579
  237    HB2  PHE  29           1HB      PHE  29  -2.980  -1.919   6.668
  238    HB3  PHE  29           2HB      PHE  29  -2.861  -0.453   7.634
  239    HD1  PHE  29           HD1      PHE  29  -0.679   0.409   8.325
  240    HD2  PHE  29           HD2      PHE  29  -1.030  -3.023   5.833
  241    HE1  PHE  29           HE1      PHE  29   1.694   0.622   7.701
  242    HE2  PHE  29           HE2      PHE  29   1.339  -2.816   5.210
  243    HZ   PHE  29           HZ       PHE  29   2.703  -0.995   6.138
  244    H    ASN  30           H        ASN  30  -3.974  -0.484  10.037
  245    HA   ASN  30           HA       ASN  30  -6.516  -1.977   9.969
  246    HB2  ASN  30           1HB      ASN  30  -5.570   0.177  11.876
  247    HB3  ASN  30           2HB      ASN  30  -7.182  -0.532  11.892
  248   HD21  ASN  30          2HD2      ASN  30  -3.848  -0.975  12.673
  249   HD22  ASN  30          1HD2      ASN  30  -4.034  -2.452  13.557
  250    H    GLY  31           H        GLY  31  -4.882   0.910   9.016
  251    HA2  GLY  31           1HA      GLY  31  -7.391   1.871   7.811
  252    HA3  GLY  31           2HA      GLY  31  -6.403   2.971   8.759
  253    H    VAL  32           H        VAL  32  -7.138   3.280   6.028
  254    HA   VAL  32           HA       VAL  32  -4.969   2.524   4.331
  255    HB   VAL  32           HB       VAL  32  -7.014   4.709   3.880
  256   HG11  VAL  32          1HG1      VAL  32  -5.310   3.147   1.943
  257   HG12  VAL  32          2HG1      VAL  32  -5.132   4.852   2.360
  258   HG13  VAL  32          3HG1      VAL  32  -6.569   4.299   1.499
  259   HG21  VAL  32          3HG2      VAL  32  -8.126   2.598   4.363
  260   HG22  VAL  32          1HG2      VAL  32  -7.150   1.788   3.138
  261   HG23  VAL  32          2HG2      VAL  32  -8.311   3.027   2.662
  262    H    TYR  33           H        TYR  33  -5.636   5.168   6.464
  263    HA   TYR  33           HA       TYR  33  -3.835   7.065   5.407
  264    HB2  TYR  33           1HB      TYR  33  -5.582   7.630   7.058
  265    HB3  TYR  33           2HB      TYR  33  -4.727   6.692   8.278
  266    HD1  TYR  33           HD2      TYR  33  -4.472   9.685   6.104
  267    HD2  TYR  33           HD1      TYR  33  -2.964   7.653   9.526
  268    HE1  TYR  33           HE2      TYR  33  -3.163  11.675   6.705
  269    HE2  TYR  33           HE1      TYR  33  -1.652   9.641  10.133
  270    HH   TYR  33           HH       TYR  33  -2.174  12.673   8.778
  271    H    GLU  34           H        GLU  34  -3.442   4.365   7.628
  272    HA   GLU  34           HA       GLU  34  -0.783   4.916   8.430
  273    HB2  GLU  34           1HB      GLU  34  -2.113   2.213   8.149
  274    HB3  GLU  34           2HB      GLU  34  -0.682   2.574   9.099
  275    HG2  GLU  34           1HG      GLU  34  -2.009   3.985  10.575
  276    HG3  GLU  34           2HG      GLU  34  -3.449   3.629   9.618
  277    H    ALA  35           H        ALA  35  -2.180   2.962   5.845
  278    HA   ALA  35           HA       ALA  35   0.222   1.917   4.830
  279    HB1  ALA  35           3HB      ALA  35  -2.033   1.003   4.380
  280    HB2  ALA  35           1HB      ALA  35  -1.077   1.249   2.915
  281    HB3  ALA  35           2HB      ALA  35  -2.352   2.392   3.339
  282    H    PHE  36           H        PHE  36  -1.669   4.777   3.915
  283    HA   PHE  36           HA       PHE  36  -0.113   5.591   1.734
  284    HB2  PHE  36           1HB      PHE  36  -2.322   6.542   2.230
  285    HB3  PHE  36           2HB      PHE  36  -1.682   7.291   3.688
  286    HD1  PHE  36           HD1      PHE  36  -1.146   7.211   0.004
  287    HD2  PHE  36           HD2      PHE  36  -0.944   9.474   3.602
  288    HE1  PHE  36           HE1      PHE  36  -0.558   9.219  -1.292
  289    HE2  PHE  36           HE2      PHE  36  -0.357  11.482   2.312
  290    HZ   PHE  36           HZ       PHE  36  -0.162  11.357  -0.138
  291    H    ASP  37           H        ASP  37   0.174   6.339   5.184
  292    HA   ASP  37           HA       ASP  37   2.397   8.085   4.916
  293    HB2  ASP  37           1HB      ASP  37   0.992   8.095   6.917
  294    HB3  ASP  37           2HB      ASP  37   1.470   6.442   7.282
  295    H    PHE  38           H        PHE  38   2.074   4.639   5.588
  296    HA   PHE  38           HA       PHE  38   4.751   3.985   6.014
  297    HB2  PHE  38           1HB      PHE  38   3.065   2.395   6.543
  298    HB3  PHE  38           2HB      PHE  38   2.421   2.424   4.908
  299    HD1  PHE  38           HD2      PHE  38   5.491   1.495   6.811
  300    HD2  PHE  38           HD1      PHE  38   3.026   0.789   3.414
  301    HE1  PHE  38           HE2      PHE  38   6.848  -0.478   6.236
  302    HE2  PHE  38           HE1      PHE  38   4.377  -1.181   2.835
  303    HZ   PHE  38           HZ       PHE  38   6.287  -1.819   4.242
  304    H    LEU  39           H        LEU  39   2.926   4.283   3.015
  305    HA   LEU  39           HA       LEU  39   4.791   3.218   1.229
  306    HB2  LEU  39           1HB      LEU  39   2.721   5.377   0.863
  307    HB3  LEU  39           2HB      LEU  39   3.646   4.695  -0.459
  308    HG   LEU  39           HG       LEU  39   1.850   3.061   1.332
  309   HD11  LEU  39          1HD1      LEU  39   0.525   4.706   0.130
  310   HD12  LEU  39          2HD1      LEU  39   0.263   3.094  -0.536
  311   HD13  LEU  39          3HD1      LEU  39   1.296   4.242  -1.387
  312   HD21  LEU  39          3HD2      LEU  39   3.168   2.483  -1.319
  313   HD22  LEU  39          1HD2      LEU  39   2.037   1.418  -0.485
  314   HD23  LEU  39          2HD2      LEU  39   3.602   1.783   0.240
  315    H    GLN  40           H        GLN  40   4.802   6.258   2.892
  316    HA   GLN  40           HA       GLN  40   6.782   7.352   1.037
  317    HB2  GLN  40           1HB      GLN  40   5.433   8.685   3.394
  318    HB3  GLN  40           2HB      GLN  40   6.455   9.473   2.199
  319    HG2  GLN  40           1HG      GLN  40   4.814   8.934   0.458
  320    HG3  GLN  40           2HG      GLN  40   3.784   8.184   1.676
  321   HE21  GLN  40          2HE2      GLN  40   4.492  10.231   3.680
  322   HE22  GLN  40          1HE2      GLN  40   3.611  11.649   3.226
  323    H    HIS  41           H        HIS  41   6.492   5.998   4.202
  324    HA   HIS  41           HA       HIS  41   8.920   7.140   5.219
  325    HB2  HIS  41           1HB      HIS  41   6.967   5.120   6.234
  326    HB3  HIS  41           2HB      HIS  41   8.557   5.226   6.982
  327    HD1  HIS  41           HD1      HIS  41   8.687   6.801   8.883
  328    HD2  HIS  41           HD2      HIS  41   5.640   7.792   6.233
  329    HE1  HIS  41           HE1      HIS  41   7.504   8.767   9.909
  330    HE2  HIS  41           HE2      HIS  41   5.502   9.143   8.428
  331    H    GLU  42           H        GLU  42   8.142   3.674   4.929
  332    HA   GLU  42           HA       GLU  42  10.840   3.260   3.874
  333    HB2  GLU  42           1HB      GLU  42   9.701   1.930   6.328
  334    HB3  GLU  42           2HB      GLU  42  11.116   1.333   5.472
  335    HG2  GLU  42           1HG      GLU  42  12.299   3.388   5.927
  336    HG3  GLU  42           2HG      GLU  42  10.869   4.068   6.701
  337    H    TRP  43           H        TRP  43   9.200   3.049   2.036
  338    HA   TRP  43           HA       TRP  43   8.189   0.329   1.817
  339    HB2  TRP  43           1HB      TRP  43   6.880   2.182   0.845
  340    HB3  TRP  43           2HB      TRP  43   8.235   2.593  -0.200
  341    HD1  TRP  43           HD1      TRP  43   8.551   1.202  -2.383
  342    HE1  TRP  43           HE1      TRP  43   7.129  -0.569  -3.593
  343    HE3  TRP  43           HE3      TRP  43   5.225   0.161   1.354
  344    HZ2  TRP  43           HZ2      TRP  43   4.887  -2.189  -3.029
  345    HZ3  TRP  43           HZ3      TRP  43   3.472  -1.515   0.937
  346    HH2  TRP  43           HH2      TRP  43   3.308  -2.664  -1.210
  347    HA   PRO  44           HA       PRO  44  12.247  -1.139   0.905
  348    HB2  PRO  44           1HB      PRO  44  11.379  -3.401  -0.512
  349    HB3  PRO  44           2HB      PRO  44  11.693  -3.302   1.222
  350    HG2  PRO  44           1HG      PRO  44   9.110  -3.103  -0.253
  351    HG3  PRO  44           2HG      PRO  44   9.450  -3.829   1.329
  352    HD2  PRO  44           1HD      PRO  44   8.235  -1.460   1.137
  353    HD3  PRO  44           2HD      PRO  44   9.431  -1.770   2.414
  354    H    ALA  45           H        ALA  45  10.273  -2.141  -1.879
  355    HA   ALA  45           HA       ALA  45  12.230  -0.792  -3.616
  356    HB1  ALA  45           3HB      ALA  45  11.625  -2.405  -5.346
  357    HB2  ALA  45           1HB      ALA  45  10.450  -3.146  -4.259
  358    HB3  ALA  45           2HB      ALA  45  12.173  -3.231  -3.886
  359    H    ARG  46           H        ARG  46  11.449   1.103  -4.239
  360    HA   ARG  46           HA       ARG  46   8.730   1.818  -4.037
  361    HB2  ARG  46           1HB      ARG  46  10.885   3.210  -5.627
  362    HB3  ARG  46           2HB      ARG  46   9.388   3.923  -5.034
  363    HG2  ARG  46           1HG      ARG  46  10.117   3.602  -2.741
  364    HG3  ARG  46           2HG      ARG  46  11.600   2.834  -3.306
  365    HD2  ARG  46           1HD      ARG  46  12.166   4.945  -4.490
  366    HD3  ARG  46           2HD      ARG  46  10.751   5.690  -3.745
  367    HE   ARG  46           HE       ARG  46  13.067   4.645  -2.241
  368   HH11  ARG  46          1HH1      ARG  46  10.388   6.884  -2.593
  369   HH12  ARG  46          2HH1      ARG  46  10.806   7.796  -1.169
  370   HH21  ARG  46          1HH2      ARG  46  13.639   5.872  -0.408
  371   HH22  ARG  46          2HH2      ARG  46  12.667   7.242   0.050
  372    H    GLY  47           H        GLY  47  10.454   2.225  -7.090
  373    HA2  GLY  47           1HA      GLY  47  10.018   0.446  -8.791
  374    HA3  GLY  47           2HA      GLY  47   8.325   0.629  -8.361
  375    H    ASP  48           H        ASP  48   7.147   2.254  -9.194
  376    HA   ASP  48           HA       ASP  48   8.226   4.390 -10.753
  377    HB2  ASP  48           1HB      ASP  48   8.633   2.305 -12.166
  378    HB3  ASP  48           2HB      ASP  48   6.886   2.151 -12.291
  379    H    ARG  49           H        ARG  49   5.760   3.970 -12.580
  380    HA   ARG  49           HA       ARG  49   4.024   5.717 -11.294
  381    HB2  ARG  49           1HB      ARG  49   3.536   3.762 -13.536
  382    HB3  ARG  49           2HB      ARG  49   2.364   4.970 -13.030
  383    HG2  ARG  49           1HG      ARG  49   3.851   6.750 -13.629
  384    HG3  ARG  49           2HG      ARG  49   5.148   5.603 -13.971
  385    HD2  ARG  49           1HD      ARG  49   3.934   4.694 -15.827
  386    HD3  ARG  49           2HD      ARG  49   2.511   5.652 -15.422
  387    HE   ARG  49           HE       ARG  49   3.755   7.627 -16.072
  388   HH11  ARG  49          1HH1      ARG  49   5.179   4.565 -16.987
  389   HH12  ARG  49          2HH1      ARG  49   6.055   5.225 -18.334
  390   HH21  ARG  49          1HH2      ARG  49   4.890   8.507 -17.852
  391   HH22  ARG  49          2HH2      ARG  49   5.892   7.465 -18.823
  392    H    ALA  50           H        ALA  50   4.041   2.178 -11.289
  393    HA   ALA  50           HA       ALA  50   1.503   1.767 -10.173
  394    HB1  ALA  50           3HB      ALA  50   2.324  -0.411  -9.461
  395    HB2  ALA  50           1HB      ALA  50   3.984   0.110  -9.744
  396    HB3  ALA  50           2HB      ALA  50   2.865  -0.044 -11.099
  397    H    HIS  51           H        HIS  51   4.595   2.511  -8.653
  398    HA   HIS  51           HA       HIS  51   3.742   2.291  -5.969
  399    HB2  HIS  51           1HB      HIS  51   6.113   2.395  -6.531
  400    HB3  HIS  51           2HB      HIS  51   5.911   4.007  -7.205
  401    HD1  HIS  51           HD1      HIS  51   6.003   2.186  -3.906
  402    HD2  HIS  51           HD2      HIS  51   6.019   6.076  -5.374
  403    HE1  HIS  51           HE1      HIS  51   6.526   3.654  -1.930
  404    HE2  HIS  51           HE2      HIS  51   6.430   6.016  -2.816
  405    H    GLU  52           H        GLU  52   3.788   4.989  -8.266
  406    HA   GLU  52           HA       GLU  52   2.780   6.927  -6.468
  407    HB2  GLU  52           1HB      GLU  52   2.673   6.801  -9.484
  408    HB3  GLU  52           2HB      GLU  52   2.194   8.204  -8.537
  409    HG2  GLU  52           1HG      GLU  52   4.490   8.285  -7.600
  410    HG3  GLU  52           2HG      GLU  52   4.936   6.978  -8.696
  411    H    GLN  53           H        GLN  53   1.217   4.655  -8.666
  412    HA   GLN  53           HA       GLN  53  -1.417   5.573  -8.431
  413    HB2  GLN  53           1HB      GLN  53  -0.334   2.789  -8.873
  414    HB3  GLN  53           2HB      GLN  53  -2.043   3.187  -8.965
  415    HG2  GLN  53           1HG      GLN  53  -1.633   4.696 -10.806
  416    HG3  GLN  53           2HG      GLN  53   0.103   4.416 -10.676
  417   HE21  GLN  53          2HE2      GLN  53  -1.747   3.967 -12.909
  418   HE22  GLN  53          1HE2      GLN  53  -1.573   2.296 -13.334
  419    H    ALA  54           H        ALA  54   0.473   3.406  -6.388
  420    HA   ALA  54           HA       ALA  54  -1.544   2.591  -4.638
  421    HB1  ALA  54           3HB      ALA  54   0.697   1.598  -4.669
  422    HB2  ALA  54           1HB      ALA  54   0.234   2.110  -3.045
  423    HB3  ALA  54           2HB      ALA  54   1.361   3.083  -3.989
  424    H    LEU  55           H        LEU  55   0.710   5.350  -4.346
  425    HA   LEU  55           HA       LEU  55  -0.474   6.423  -2.012
  426    HB2  LEU  55           1HB      LEU  55   1.243   7.628  -4.163
  427    HB3  LEU  55           2HB      LEU  55   0.577   8.621  -2.884
  428    HG   LEU  55           HG       LEU  55   1.727   7.055  -1.246
  429   HD11  LEU  55          1HD1      LEU  55   2.142   5.186  -2.729
  430   HD12  LEU  55          2HD1      LEU  55   3.662   5.821  -2.100
  431   HD13  LEU  55          3HD1      LEU  55   3.165   6.195  -3.750
  432   HD21  LEU  55          3HD2      LEU  55   2.538   9.292  -1.715
  433   HD22  LEU  55          1HD2      LEU  55   3.410   8.699  -3.130
  434   HD23  LEU  55          2HD2      LEU  55   3.888   8.176  -1.514
  435    H    ARG  56           H        ARG  56  -1.069   6.948  -5.425
  436    HA   ARG  56           HA       ARG  56  -2.757   9.162  -5.308
  437    HB2  ARG  56           1HB      ARG  56  -1.727   8.111  -7.348
  438    HB3  ARG  56           2HB      ARG  56  -2.955   6.858  -7.248
  439    HG2  ARG  56           1HG      ARG  56  -4.692   8.590  -7.509
  440    HG3  ARG  56           2HG      ARG  56  -3.416   9.794  -7.709
  441    HD2  ARG  56           1HD      ARG  56  -2.547   8.353  -9.602
  442    HD3  ARG  56           2HD      ARG  56  -4.060   7.457  -9.488
  443    HE   ARG  56           HE       ARG  56  -4.234  10.348  -9.847
  444   HH11  ARG  56          1HH1      ARG  56  -4.507   7.137 -11.211
  445   HH12  ARG  56          2HH1      ARG  56  -5.296   7.669 -12.665
  446   HH21  ARG  56          1HH2      ARG  56  -5.247  11.072 -11.777
  447   HH22  ARG  56          2HH2      ARG  56  -5.686   9.912 -13.001
  448    H    LEU  57           H        LEU  57  -3.591   5.704  -5.331
  449    HA   LEU  57           HA       LEU  57  -6.384   6.160  -5.144
  450    HB2  LEU  57           1HB      LEU  57  -4.760   3.689  -4.559
  451    HB3  LEU  57           2HB      LEU  57  -6.512   3.733  -4.639
  452    HG   LEU  57           HG       LEU  57  -4.641   4.365  -6.923
  453   HD11  LEU  57          1HD1      LEU  57  -5.485   2.293  -7.894
  454   HD12  LEU  57          2HD1      LEU  57  -6.406   1.979  -6.423
  455   HD13  LEU  57          3HD1      LEU  57  -4.642   2.004  -6.373
  456   HD21  LEU  57          3HD2      LEU  57  -6.700   5.657  -7.044
  457   HD22  LEU  57          1HD2      LEU  57  -7.650   4.187  -6.834
  458   HD23  LEU  57          2HD2      LEU  57  -6.673   4.406  -8.286
  459    H    CYS  58           H        CYS  58  -3.868   5.607  -2.731
  460    HA   CYS  58           HA       CYS  58  -5.593   5.342  -0.512
  461    HB2  CYS  58           1HB      CYS  58  -2.776   6.440  -0.649
  462    HB3  CYS  58           2HB      CYS  58  -3.620   6.028   0.840
  463    HG   CYS  58           HG       CYS  58  -2.397   3.938  -1.550
  464    H    ARG  59           H        ARG  59  -4.253   8.125  -2.183
  465    HA   ARG  59           HA       ARG  59  -5.174  10.122  -0.411
  466    HB2  ARG  59           1HB      ARG  59  -3.482  10.533  -2.149
  467    HB3  ARG  59           2HB      ARG  59  -4.691  10.261  -3.395
  468    HG2  ARG  59           1HG      ARG  59  -5.964  12.196  -2.473
  469    HG3  ARG  59           2HG      ARG  59  -4.596  12.512  -1.406
  470    HD2  ARG  59           1HD      ARG  59  -4.519  13.912  -3.411
  471    HD3  ARG  59           2HD      ARG  59  -3.141  12.815  -3.334
  472    HE   ARG  59           HE       ARG  59  -3.888  11.767  -5.234
  473   HH11  ARG  59          1HH1      ARG  59  -6.415  13.869  -3.993
  474   HH12  ARG  59          2HH1      ARG  59  -7.428  13.667  -5.396
  475   HH21  ARG  59          1HH2      ARG  59  -5.231  11.540  -7.086
  476   HH22  ARG  59          2HH2      ARG  59  -6.766  12.359  -7.135
  477    H    ALA  60           H        ALA  60  -6.615   8.566  -3.238
  478    HA   ALA  60           HA       ALA  60  -8.994  10.116  -3.265
  479    HB1  ALA  60           3HB      ALA  60  -9.850   8.412  -4.789
  480    HB2  ALA  60           1HB      ALA  60  -8.492   7.361  -4.388
  481    HB3  ALA  60           2HB      ALA  60  -8.209   8.886  -5.226
  482    H    SER  61           H        SER  61  -8.012   7.199  -1.595
  483    HA   SER  61           HA       SER  61 -10.545   6.377  -0.683
  484    HB2  SER  61           1HB      SER  61  -7.839   6.012   0.629
  485    HB3  SER  61           2HB      SER  61  -9.301   5.106   1.019
  486    HG   SER  61           HG       SER  61  -7.908   5.121  -1.460
  487    H    LEU  62           H        LEU  62  -8.300   8.814   0.444
  488    HA   LEU  62           HA       LEU  62  -9.424   9.298   2.985
  489    HB2  LEU  62           1HB      LEU  62  -7.983  11.192   1.123
  490    HB3  LEU  62           2HB      LEU  62  -8.327  11.515   2.811
  491    HG   LEU  62           HG       LEU  62  -6.581   9.255   1.830
  492   HD11  LEU  62          1HD1      LEU  62  -5.824  11.937   2.987
  493   HD12  LEU  62          2HD1      LEU  62  -5.566  11.408   1.324
  494   HD13  LEU  62          3HD1      LEU  62  -4.710  10.613   2.646
  495   HD21  LEU  62          3HD2      LEU  62  -7.049  10.370   4.596
  496   HD22  LEU  62          1HD2      LEU  62  -5.898   9.102   4.174
  497   HD23  LEU  62          2HD2      LEU  62  -7.629   8.817   3.991
  498    H    MET  63           H        MET  63 -10.404  10.192  -0.216
  499    HA   MET  63           HA       MET  63 -12.260  12.231   0.667
  500    HB2  MET  63           1HB      MET  63 -11.783  10.940  -2.023
  501    HB3  MET  63           2HB      MET  63 -12.999  12.178  -1.743
  502    HG2  MET  63           1HG      MET  63 -11.283  13.761  -1.107
  503    HG3  MET  63           2HG      MET  63 -10.045  12.521  -1.293
  504    HE1  MET  63           3HE      MET  63 -10.151  15.476  -2.706
  505    HE2  MET  63           1HE      MET  63  -9.486  15.057  -4.284
  506    HE3  MET  63           2HE      MET  63  -8.783  14.370  -2.821
  507    H    GLY  64           H        GLY  64 -12.239   8.849   0.352
  508    HA2  GLY  64           1HA      GLY  64 -13.920   7.364   0.978
  509    HA3  GLY  64           2HA      GLY  64 -15.055   8.706   1.018
  510    H    ASP  65           H        ASP  65 -12.996   8.052  -1.731
  511    HA   ASP  65           HA       ASP  65 -15.394   7.287  -3.254
  512    HB2  ASP  65           1HB      ASP  65 -12.949   8.845  -3.997
  513    HB3  ASP  65           2HB      ASP  65 -13.820   7.959  -5.246
  514    H    VAL  66           H        VAL  66 -13.003   5.820  -1.755
  515    HA   VAL  66           HA       VAL  66 -12.895   3.661  -3.741
  516    HB   VAL  66           HB       VAL  66 -10.554   4.542  -2.030
  517   HG11  VAL  66          1HG1      VAL  66 -10.764   2.311  -4.049
  518   HG12  VAL  66          2HG1      VAL  66 -10.613   2.128  -2.301
  519   HG13  VAL  66          3HG1      VAL  66  -9.287   2.823  -3.234
  520   HG21  VAL  66          3HG2      VAL  66 -10.903   6.051  -3.910
  521   HG22  VAL  66          1HG2      VAL  66 -10.927   4.680  -5.020
  522   HG23  VAL  66          2HG2      VAL  66  -9.449   5.082  -4.147
  523    H    ALA  67           H        ALA  67 -13.255   1.654  -2.893
  524    HA   ALA  67           HA       ALA  67 -13.978   1.553  -0.071
  525    HB1  ALA  67           3HB      ALA  67 -14.404  -0.492  -2.244
  526    HB2  ALA  67           1HB      ALA  67 -15.587   0.698  -1.700
  527    HB3  ALA  67           2HB      ALA  67 -15.043  -0.571  -0.602
  528    H    GLY  68           H        GLY  68 -13.482  -0.637   1.011
  529    HA2  GLY  68           1HA      GLY  68 -10.744  -0.598   1.546
  530    HA3  GLY  68           2HA      GLY  68 -11.861  -1.844   2.074
  531    H    GLU  69           H        GLU  69 -12.552  -3.241  -0.047
  532    HA   GLU  69           HA       GLU  69 -10.177  -4.721  -0.554
  533    HB2  GLU  69           1HB      GLU  69 -12.934  -5.008  -1.759
  534    HB3  GLU  69           2HB      GLU  69 -11.633  -6.178  -1.921
  535    HG2  GLU  69           1HG      GLU  69 -12.862  -5.342   0.696
  536    HG3  GLU  69           2HG      GLU  69 -13.318  -6.779  -0.215
  537    H    ILE  70           H        ILE  70 -11.924  -2.286  -2.312
  538    HA   ILE  70           HA       ILE  70 -10.874  -2.739  -4.886
  539    HB   ILE  70           HB       ILE  70 -11.707  -0.122  -3.619
  540   HG12  ILE  70          1HG1      ILE  70 -13.224  -2.071  -5.371
  541   HG13  ILE  70          2HG1      ILE  70 -13.502  -1.793  -3.656
  542   HG21  ILE  70          1HG2      ILE  70 -11.957   0.696  -5.916
  543   HG22  ILE  70          2HG2      ILE  70 -11.303  -0.824  -6.525
  544   HG23  ILE  70          3HG2      ILE  70 -10.288   0.251  -5.562
  545   HD11  ILE  70          3HD1      ILE  70 -14.177   0.507  -4.146
  546   HD12  ILE  70          1HD1      ILE  70 -15.174  -0.670  -5.001
  547   HD13  ILE  70          2HD1      ILE  70 -13.913   0.211  -5.865
  548    H    ALA  71           H        ALA  71  -9.825  -0.405  -2.392
  549    HA   ALA  71           HA       ALA  71  -7.421   0.321  -3.678
  550    HB1  ALA  71           3HB      ALA  71  -8.467   1.652  -1.887
  551    HB2  ALA  71           1HB      ALA  71  -6.772   1.297  -1.552
  552    HB3  ALA  71           2HB      ALA  71  -8.041   0.396  -0.724
  553    H    ARG  72           H        ARG  72  -8.249  -2.197  -1.398
  554    HA   ARG  72           HA       ARG  72  -5.719  -3.100  -0.666
  555    HB2  ARG  72           1HB      ARG  72  -7.781  -3.811   0.417
  556    HB3  ARG  72           2HB      ARG  72  -8.289  -4.636  -1.047
  557    HG2  ARG  72           1HG      ARG  72  -6.384  -6.177  -0.809
  558    HG3  ARG  72           2HG      ARG  72  -5.955  -5.371   0.706
  559    HD2  ARG  72           1HD      ARG  72  -8.172  -5.914   1.602
  560    HD3  ARG  72           2HD      ARG  72  -8.565  -6.749   0.103
  561    HE   ARG  72           HE       ARG  72  -6.305  -7.992   0.977
  562   HH11  ARG  72          1HH1      ARG  72  -9.459  -7.300   2.324
  563   HH12  ARG  72          2HH1      ARG  72  -9.456  -8.702   3.358
  564   HH21  ARG  72          1HH2      ARG  72  -6.310  -9.847   2.318
  565   HH22  ARG  72          2HH2      ARG  72  -7.679 -10.143   3.356
  566    H    THR  73           H        THR  73  -7.802  -4.207  -3.337
  567    HA   THR  73           HA       THR  73  -6.057  -6.175  -4.318
  568    HB   THR  73           HB       THR  73  -8.060  -4.577  -5.932
  569    HG1  THR  73           HG1      THR  73  -9.092  -5.493  -4.127
  570   HG21  THR  73          3HG2      THR  73  -6.948  -7.363  -6.315
  571   HG22  THR  73          1HG2      THR  73  -6.561  -5.950  -7.295
  572   HG23  THR  73          2HG2      THR  73  -8.196  -6.609  -7.306
  573    H    ALA  74           H        ALA  74  -6.400  -2.744  -5.130
  574    HA   ALA  74           HA       ALA  74  -4.478  -2.791  -7.234
  575    HB1  ALA  74           3HB      ALA  74  -5.518  -0.460  -5.631
  576    HB2  ALA  74           1HB      ALA  74  -6.223  -1.090  -7.119
  577    HB3  ALA  74           2HB      ALA  74  -4.619  -0.357  -7.144
  578    H    PHE  75           H        PHE  75  -4.342  -2.229  -3.781
  579    HA   PHE  75           HA       PHE  75  -1.720  -1.200  -3.637
  580    HB2  PHE  75           1HB      PHE  75  -3.572  -1.327  -1.822
  581    HB3  PHE  75           2HB      PHE  75  -2.946  -2.941  -1.508
  582    HD1  PHE  75           HD2      PHE  75  -2.254   0.643  -1.335
  583    HD2  PHE  75           HD1      PHE  75  -0.805  -3.257  -0.443
  584    HE1  PHE  75           HE2      PHE  75  -0.544   1.620   0.137
  585    HE2  PHE  75           HE1      PHE  75   0.908  -2.283   1.034
  586    HZ   PHE  75           HZ       PHE  75   1.041   0.156   1.322
  587    H    VAL  76           H        VAL  76  -3.030  -4.466  -3.696
  588    HA   VAL  76           HA       VAL  76  -0.600  -5.848  -3.275
  589    HB   VAL  76           HB       VAL  76  -3.080  -6.747  -4.763
  590   HG11  VAL  76          1HG1      VAL  76  -2.275  -9.021  -4.383
  591   HG12  VAL  76          2HG1      VAL  76  -0.803  -8.384  -3.650
  592   HG13  VAL  76          3HG1      VAL  76  -1.130  -8.100  -5.360
  593   HG21  VAL  76          3HG2      VAL  76  -3.633  -7.902  -2.670
  594   HG22  VAL  76          1HG2      VAL  76  -3.536  -6.155  -2.447
  595   HG23  VAL  76          2HG2      VAL  76  -2.212  -7.188  -1.907
  596    H    ALA  77           H        ALA  77  -2.197  -4.592  -6.159
  597    HA   ALA  77           HA       ALA  77  -0.454  -5.715  -8.072
  598    HB1  ALA  77           3HB      ALA  77  -2.030  -3.148  -8.240
  599    HB2  ALA  77           1HB      ALA  77  -2.620  -4.753  -8.671
  600    HB3  ALA  77           2HB      ALA  77  -1.314  -4.014  -9.598
  601    H    ALA  78           H        ALA  78  -0.319  -2.733  -6.194
  602    HA   ALA  78           HA       ALA  78   2.032  -1.712  -7.435
  603    HB1  ALA  78           3HB      ALA  78   0.492  -0.286  -6.173
  604    HB2  ALA  78           1HB      ALA  78   2.134  -0.183  -5.538
  605    HB3  ALA  78           2HB      ALA  78   0.919  -1.138  -4.689
  606    H    SER  79           H        SER  79   1.410  -3.660  -4.550
  607    HA   SER  79           HA       SER  79   4.090  -3.875  -3.687
  608    HB2  SER  79           1HB      SER  79   2.121  -4.423  -2.274
  609    HB3  SER  79           2HB      SER  79   1.818  -5.842  -3.279
  610    HG   SER  79           HG       SER  79   3.380  -5.686  -1.183
  611    H    ARG  80           H        ARG  80   2.261  -5.471  -6.148
  612    HA   ARG  80           HA       ARG  80   3.878  -7.719  -6.603
  613    HB2  ARG  80           1HB      ARG  80   1.709  -7.622  -7.585
  614    HB3  ARG  80           2HB      ARG  80   2.072  -6.111  -8.403
  615    HG2  ARG  80           1HG      ARG  80   3.626  -7.248  -9.874
  616    HG3  ARG  80           2HG      ARG  80   3.344  -8.769  -9.022
  617    HD2  ARG  80           1HD      ARG  80   1.092  -8.861  -9.747
  618    HD3  ARG  80           2HD      ARG  80   1.138  -7.198 -10.329
  619    HE   ARG  80           HE       ARG  80   2.999  -8.307 -11.868
  620   HH11  ARG  80          1HH1      ARG  80  -0.183  -9.481 -10.995
  621   HH12  ARG  80          2HH1      ARG  80  -0.450 -10.290 -12.507
  622   HH21  ARG  80          1HH2      ARG  80   2.654  -9.365 -13.868
  623   HH22  ARG  80          2HH2      ARG  80   1.163 -10.217 -14.148
  624    H    GLN  81           H        GLN  81   4.022  -4.427  -7.906
  625    HA   GLN  81           HA       GLN  81   6.211  -4.839  -9.638
  626    HB2  GLN  81           1HB      GLN  81   4.801  -2.877  -9.857
  627    HB3  GLN  81           2HB      GLN  81   5.233  -2.340  -8.241
  628    HG2  GLN  81           1HG      GLN  81   7.479  -1.880  -8.923
  629    HG3  GLN  81           2HG      GLN  81   7.197  -2.607 -10.504
  630   HE21  GLN  81          2HE2      GLN  81   6.017  -1.498 -12.036
  631   HE22  GLN  81          1HE2      GLN  81   5.668   0.198 -11.900
  632    H    ALA  82           H        ALA  82   5.966  -3.941  -6.250
  633    HA   ALA  82           HA       ALA  82   8.773  -3.550  -5.861
  634    HB1  ALA  82           3HB      ALA  82   7.097  -2.464  -4.446
  635    HB2  ALA  82           1HB      ALA  82   8.213  -3.441  -3.492
  636    HB3  ALA  82           2HB      ALA  82   6.590  -4.040  -3.838
  637    H    HIS  83           H        HIS  83   6.842  -6.279  -6.215
  638    HA   HIS  83           HA       HIS  83   7.114  -8.514  -5.927
  639    HB2  HIS  83           1HB      HIS  83  10.026  -7.872  -5.393
  640    HB3  HIS  83           2HB      HIS  83   9.367  -9.442  -5.832
  641    HD1  HIS  83           HD1      HIS  83  11.497  -7.425  -7.349
  642    HD2  HIS  83           HD2      HIS  83   7.642  -8.496  -8.479
  643    HE1  HIS  83           HE1      HIS  83  11.380  -7.025  -9.832
  644    HE2  HIS  83           HE2      HIS  83   8.990  -7.516 -10.463
  645    H    CYS  84           H        CYS  84   6.459  -6.771  -3.702
  646    HA   CYS  84           HA       CYS  84   7.676  -8.154  -1.404
  647    HB2  CYS  84           1HB      CYS  84   7.738  -5.590  -1.660
  648    HB3  CYS  84           2HB      CYS  84   6.016  -5.633  -1.309
  649    HG   CYS  84           HG       CYS  84   6.741  -7.166   1.172
  650    H    LEU  85           H        LEU  85   5.635  -9.261  -3.111
  651    HA   LEU  85           HA       LEU  85   3.027  -8.936  -2.163
  652    HB2  LEU  85           1HB      LEU  85   4.331 -11.256  -3.574
  653    HB3  LEU  85           2HB      LEU  85   2.608 -11.139  -3.279
  654    HG   LEU  85           HG       LEU  85   4.200  -9.170  -4.921
  655   HD11  LEU  85          1HD1      LEU  85   2.351 -11.386  -5.803
  656   HD12  LEU  85          2HD1      LEU  85   4.103 -11.363  -5.999
  657   HD13  LEU  85          3HD1      LEU  85   3.105 -10.187  -6.854
  658   HD21  LEU  85          3HD2      LEU  85   1.231  -9.503  -4.513
  659   HD22  LEU  85          1HD2      LEU  85   2.002  -8.354  -5.606
  660   HD23  LEU  85          2HD2      LEU  85   2.228  -8.200  -3.863
  661    H    MET  86           H        MET  86   1.839  -9.900  -0.631
  662    HA   MET  86           HA       MET  86   3.079 -11.264   1.524
  663    HB2  MET  86           1HB      MET  86   1.126  -9.939   1.967
  664    HB3  MET  86           2HB      MET  86   0.181 -10.834   0.785
  665    HG2  MET  86           1HG      MET  86   0.446 -12.860   2.212
  666    HG3  MET  86           2HG      MET  86   1.213 -11.840   3.427
  667    HE1  MET  86           3HE      MET  86  -0.627 -12.755   5.188
  668    HE2  MET  86           1HE      MET  86  -1.361 -13.713   3.903
  669    HE3  MET  86           2HE      MET  86  -2.362 -12.656   4.896
  670    H    GLU  87           H        GLU  87   3.589 -13.354   1.658
  671    HA   GLU  87           HA       GLU  87   2.764 -15.255  -0.295
  672    HB2  GLU  87           1HB      GLU  87   4.082 -15.709   2.394
  673    HB3  GLU  87           2HB      GLU  87   3.986 -16.876   1.079
  674    HG2  GLU  87           1HG      GLU  87   5.323 -15.387  -0.336
  675    HG3  GLU  87           2HG      GLU  87   5.428 -14.232   0.989
  676    H    ASP  88           H        ASP  88   0.876 -16.213  -0.393
  677    HA   ASP  88           HA       ASP  88  -1.195 -15.688   1.406
  678    HB2  ASP  88           1HB      ASP  88  -1.606 -16.187  -0.938
  679    HB3  ASP  88           2HB      ASP  88  -0.991 -17.822  -0.726
  680    H    LYS  89           H        LYS  89  -2.199 -16.826   2.981
  681    HA   LYS  89           HA       LYS  89  -0.828 -19.244   3.959
  682    HB2  LYS  89           1HB      LYS  89  -2.094 -16.950   5.436
  683    HB3  LYS  89           2HB      LYS  89  -1.857 -18.509   6.210
  684    HG2  LYS  89           1HG      LYS  89   0.524 -18.346   5.924
  685    HG3  LYS  89           2HG      LYS  89   0.344 -16.858   4.988
  686    HD2  LYS  89           1HD      LYS  89  -0.457 -15.667   6.885
  687    HD3  LYS  89           2HD      LYS  89  -0.621 -17.150   7.824
  688    HE2  LYS  89           1HE      LYS  89   2.001 -16.074   6.803
  689    HE3  LYS  89           2HE      LYS  89   1.365 -15.761   8.416
  690    HZ1  LYS  89           3HZ      LYS  89   2.897 -17.579   8.513
  691    HZ2  LYS  89           1HZ      LYS  89   2.081 -18.416   7.282
  692    HZ3  LYS  89           2HZ      LYS  89   1.337 -18.184   8.786
  693    H    ALA  90           H        ALA  90  -2.258 -20.656   5.321
  694    HA   ALA  90           HA       ALA  90  -4.997 -20.707   4.229
  695    HB1  ALA  90           3HB      ALA  90  -3.282 -23.052   5.047
  696    HB2  ALA  90           1HB      ALA  90  -3.619 -22.555   3.388
  697    HB3  ALA  90           2HB      ALA  90  -4.926 -23.138   4.417
  698    H    GLU  91           H        GLU  91  -6.630 -20.721   5.670
  699    HA   GLU  91           HA       GLU  91  -5.968 -20.569   8.490
  700    HB2  GLU  91           1HB      GLU  91  -8.606 -20.316   7.033
  701    HB3  GLU  91           2HB      GLU  91  -8.399 -20.093   8.766
  702    HG2  GLU  91           1HG      GLU  91  -6.820 -18.246   8.294
  703    HG3  GLU  91           2HG      GLU  91  -7.172 -18.436   6.577
  704    H    ALA  92           H        ALA  92  -6.336 -22.093   9.985
  705    HA   ALA  92           HA       ALA  92  -6.482 -24.193  10.828
  706    HB1  ALA  92           3HB      ALA  92  -8.903 -24.403   9.039
  707    HB2  ALA  92           1HB      ALA  92  -8.883 -23.713  10.661
  708    HB3  ALA  92           2HB      ALA  92  -8.539 -25.426  10.428
  709    HA   PRO  93           HA       PRO  93  -4.581 -26.060   7.064
  710    HB2  PRO  93           1HB      PRO  93  -2.010 -25.971   7.781
  711    HB3  PRO  93           2HB      PRO  93  -2.848 -24.534   7.186
  712    HG2  PRO  93           1HG      PRO  93  -2.105 -25.277   9.975
  713    HG3  PRO  93           2HG      PRO  93  -2.137 -23.681   9.206
  714    HD2  PRO  93           1HD      PRO  93  -4.126 -24.760  10.865
  715    HD3  PRO  93           2HD      PRO  93  -4.298 -23.341   9.814
  716    H    ASN  94           H        ASN  94  -4.704 -26.932  10.362
  717    HA   ASN  94           HA       ASN  94  -3.548 -29.575   9.765
  718    HB2  ASN  94           1HB      ASN  94  -3.735 -28.046  12.352
  719    HB3  ASN  94           2HB      ASN  94  -3.436 -29.779  12.320
  720   HD21  ASN  94          2HD2      ASN  94  -1.890 -29.597   9.838
  721   HD22  ASN  94          1HD2      ASN  94  -0.348 -28.949  10.289
  722    H    THR  95           H        THR  95  -5.215 -30.731   9.051
  723    HA   THR  95           HA       THR  95  -7.660 -30.785  10.693
  724    HB   THR  95           HB       THR  95  -8.758 -31.696   8.614
  725    HG1  THR  95           HG1      THR  95  -6.954 -32.379   7.445
  726   HG21  THR  95          3HG2      THR  95  -9.021 -29.356   9.242
  727   HG22  THR  95          1HG2      THR  95  -8.900 -29.508   7.490
  728   HG23  THR  95          2HG2      THR  95  -7.512 -28.949   8.424
  729    H    ILE  96           H        ILE  96  -8.843 -33.048  10.008
  730    HA   ILE  96           HA       ILE  96  -6.857 -35.193  10.346
  731    HB   ILE  96           HB       ILE  96  -7.905 -34.643  12.535
  732   HG12  ILE  96          1HG1      ILE  96  -8.748 -37.348  11.475
  733   HG13  ILE  96          2HG1      ILE  96  -7.116 -36.940  11.995
  734   HG21  ILE  96          1HG2      ILE  96 -10.466 -35.515  11.207
  735   HG22  ILE  96          2HG2      ILE  96 -10.071 -33.882  11.746
  736   HG23  ILE  96          3HG2      ILE  96 -10.257 -35.180  12.926
  737   HD11  ILE  96          3HD1      ILE  96  -8.331 -38.154  13.715
  738   HD12  ILE  96          1HD1      ILE  96  -9.572 -36.902  13.730
  739   HD13  ILE  96          2HD1      ILE  96  -7.929 -36.521  14.246
  740    H    ALA  97           H        ALA  97  -7.613 -37.297   9.575
  741    HA   ALA  97           HA       ALA  97  -9.061 -36.963   7.117
  742    HB1  ALA  97           3HB      ALA  97  -7.934 -39.468   8.359
  743    HB2  ALA  97           1HB      ALA  97  -7.093 -38.408   7.228
  744    HB3  ALA  97           2HB      ALA  97  -8.519 -39.305   6.704
  745    H    SER  98           H        SER  98  -9.657 -38.561  10.216
  746    HA   SER  98           HA       SER  98 -12.224 -39.552   9.348
  747    HB2  SER  98           1HB      SER  98 -12.427 -40.183  11.807
  748    HB3  SER  98           2HB      SER  98 -11.088 -40.923  10.928
  749    HG   SER  98           HG       SER  98 -11.065 -38.970  12.931
  750    H    GLY  99           H        GLY  99 -13.698 -38.020   8.920
  751    HA2  GLY  99           1HA      GLY  99 -14.390 -36.199  11.125
  752    HA3  GLY  99           2HA      GLY  99 -14.156 -35.543   9.512
  753    H    SER 100           H        SER 100 -15.564 -36.340   7.806
  754    HA   SER 100           HA       SER 100 -18.101 -37.440   8.781
  755    HB2  SER 100           1HB      SER 100 -17.799 -35.108   6.869
  756    HB3  SER 100           2HB      SER 100 -19.324 -35.865   7.330
  757    HG   SER 100           HG       SER 100 -19.050 -35.146   9.418
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1   9.321  18.160   4.509
    2    H2   MET   1           2H       MET   1   9.229  16.655   5.283
    3    H3   MET   1           3H       MET   1   9.162  18.083   6.196
    4    HA   MET   1           HA       MET   1   7.073  18.680   5.163
    5    HB2  MET   1           1HB      MET   1   7.391  15.988   3.818
    6    HB3  MET   1           2HB      MET   1   5.899  16.921   3.826
    7    HG2  MET   1           1HG      MET   1   6.965  18.703   2.596
    8    HG3  MET   1           2HG      MET   1   8.511  17.858   2.660
    9    HE1  MET   1           3HE      MET   1   4.933  16.332   2.081
   10    HE2  MET   1           1HE      MET   1   4.840  16.314   0.321
   11    HE3  MET   1           2HE      MET   1   4.858  17.851   1.187
   12    H    GLU   2           H        GLU   2   5.532  18.471   6.653
   13    HA   GLU   2           HA       GLU   2   5.875  16.458   8.689
   14    HB2  GLU   2           1HB      GLU   2   4.148  18.885   8.413
   15    HB3  GLU   2           2HB      GLU   2   3.764  17.681   9.633
   16    HG2  GLU   2           1HG      GLU   2   5.104  19.545  10.506
   17    HG3  GLU   2           2HG      GLU   2   5.905  17.985  10.683
   18    H    VAL   3           H        VAL   3   5.411  14.698   7.173
   19    HA   VAL   3           HA       VAL   3   2.560  14.223   6.785
   20    HB   VAL   3           HB       VAL   3   3.368  12.030   5.758
   21   HG11  VAL   3          1HG1      VAL   3   4.213  14.650   4.518
   22   HG12  VAL   3          2HG1      VAL   3   2.620  13.903   4.407
   23   HG13  VAL   3          3HG1      VAL   3   4.010  13.130   3.645
   24   HG21  VAL   3          3HG2      VAL   3   6.026  13.461   5.907
   25   HG22  VAL   3          1HG2      VAL   3   5.704  11.994   4.983
   26   HG23  VAL   3          2HG2      VAL   3   5.601  11.968   6.744
   27    H    GLN   4           H        GLN   4   2.186  14.278   9.051
   28    HA   GLN   4           HA       GLN   4   3.502  12.474  10.828
   29    HB2  GLN   4           1HB      GLN   4   0.982  14.078  11.279
   30    HB3  GLN   4           2HB      GLN   4   2.007  13.368  12.518
   31    HG2  GLN   4           1HG      GLN   4   3.819  14.858  11.911
   32    HG3  GLN   4           2HG      GLN   4   2.845  15.535  10.604
   33   HE21  GLN   4          2HE2      GLN   4   4.030  16.878  12.905
   34   HE22  GLN   4          1HE2      GLN   4   2.715  17.629  13.741
   35    H    SER   5           H        SER   5   2.797  10.598  11.704
   36    HA   SER   5           HA       SER   5   0.742   9.116  10.391
   37    HB2  SER   5           1HB      SER   5   2.054   8.458  13.034
   38    HB3  SER   5           2HB      SER   5   1.329   7.337  11.882
   39    HG   SER   5           HG       SER   5   3.017   8.158  10.375
   40    H    MET   6           H        MET   6  -1.292   9.852  10.657
   41    HA   MET   6           HA       MET   6  -2.171  10.757  13.289
   42    HB2  MET   6           1HB      MET   6  -3.510  10.877  10.582
   43    HB3  MET   6           2HB      MET   6  -4.233  11.469  12.071
   44    HG2  MET   6           1HG      MET   6  -2.459  13.096  12.320
   45    HG3  MET   6           2HG      MET   6  -1.659  12.472  10.880
   46    HE1  MET   6           3HE      MET   6  -3.007  16.022   9.810
   47    HE2  MET   6           1HE      MET   6  -1.576  15.004   9.962
   48    HE3  MET   6           2HE      MET   6  -2.423  15.553  11.407
   49    H    LEU   7           H        LEU   7  -3.545   9.671  14.542
   50    HA   LEU   7           HA       LEU   7  -4.079   6.913  13.874
   51    HB2  LEU   7           1HB      LEU   7  -4.869   8.509  16.315
   52    HB3  LEU   7           2HB      LEU   7  -4.970   6.767  16.152
   53    HG   LEU   7           HG       LEU   7  -2.415   8.378  16.146
   54   HD11  LEU   7          1HD1      LEU   7  -2.008   7.328  18.313
   55   HD12  LEU   7          2HD1      LEU   7  -3.593   6.556  18.240
   56   HD13  LEU   7          3HD1      LEU   7  -3.471   8.314  18.342
   57   HD21  LEU   7          3HD2      LEU   7  -1.302   6.204  16.238
   58   HD22  LEU   7          1HD2      LEU   7  -2.250   6.376  14.761
   59   HD23  LEU   7          2HD2      LEU   7  -2.863   5.395  16.093
   60    H    LEU   8           H        LEU   8  -5.761   9.910  13.837
   61    HA   LEU   8           HA       LEU   8  -8.400   8.767  13.832
   62    HB2  LEU   8           1HB      LEU   8  -7.469  11.544  13.092
   63    HB3  LEU   8           2HB      LEU   8  -9.140  11.052  13.289
   64    HG   LEU   8           HG       LEU   8  -7.057  11.089  15.476
   65   HD11  LEU   8          1HD1      LEU   8  -8.352  12.952  16.378
   66   HD12  LEU   8          2HD1      LEU   8  -9.418  12.896  14.974
   67   HD13  LEU   8          3HD1      LEU   8  -7.721  13.329  14.775
   68   HD21  LEU   8          3HD2      LEU   8 -10.011  10.478  15.584
   69   HD22  LEU   8          1HD2      LEU   8  -8.937  10.626  16.976
   70   HD23  LEU   8          2HD2      LEU   8  -8.701   9.320  15.815
   71    H    ASN   9           H        ASN   9  -8.635   7.369  12.155
   72    HA   ASN   9           HA       ASN   9  -8.070   8.366   9.446
   73    HB2  ASN   9           1HB      ASN   9  -8.388   5.575  10.547
   74    HB3  ASN   9           2HB      ASN   9  -8.467   5.904   8.821
   75   HD21  ASN   9          2HD2      ASN   9  -6.357   7.608  11.040
   76   HD22  ASN   9          1HD2      ASN   9  -4.878   6.950  10.434
   77    H    ASP  10           H        ASP  10  -9.729   9.036   8.254
   78    HA   ASP  10           HA       ASP  10 -12.413   8.902   8.992
   79    HB2  ASP  10           1HB      ASP  10 -11.091   9.329   6.320
   80    HB3  ASP  10           2HB      ASP  10 -12.842   9.307   6.483
   81    H    VAL  11           H        VAL  11 -10.589   6.885   6.748
   82    HA   VAL  11           HA       VAL  11 -12.803   4.957   6.808
   83    HB   VAL  11           HB       VAL  11 -10.705   5.271   4.654
   84   HG11  VAL  11          1HG1      VAL  11 -11.512   2.976   4.875
   85   HG12  VAL  11          2HG1      VAL  11 -12.097   3.706   3.379
   86   HG13  VAL  11          3HG1      VAL  11 -13.179   3.543   4.762
   87   HG21  VAL  11          3HG2      VAL  11 -12.535   6.127   3.259
   88   HG22  VAL  11          1HG2      VAL  11 -12.233   7.165   4.654
   89   HG23  VAL  11          2HG2      VAL  11 -13.615   6.070   4.651
   90    H    LYS  12           H        LYS  12 -12.342   3.412   8.212
   91    HA   LYS  12           HA       LYS  12  -9.648   2.339   8.435
   92    HB2  LYS  12           1HB      LYS  12 -10.928   2.511  10.500
   93    HB3  LYS  12           2HB      LYS  12 -12.245   1.577   9.800
   94    HG2  LYS  12           1HG      LYS  12 -10.665  -0.340   9.580
   95    HG3  LYS  12           2HG      LYS  12  -9.480   0.607  10.477
   96    HD2  LYS  12           1HD      LYS  12 -10.870   0.637  12.417
   97    HD3  LYS  12           2HD      LYS  12 -12.224  -0.065  11.525
   98    HE2  LYS  12           1HE      LYS  12  -9.581  -1.411  12.084
   99    HE3  LYS  12           2HE      LYS  12 -11.104  -1.744  12.910
  100    HZ1  LYS  12           3HZ      LYS  12 -12.039  -2.600  10.917
  101    HZ2  LYS  12           1HZ      LYS  12 -10.526  -3.335  11.097
  102    HZ3  LYS  12           2HZ      LYS  12 -10.727  -2.079   9.983
  103    H    TRP  13           H        TRP  13  -9.060   0.284   7.693
  104    HA   TRP  13           HA       TRP  13 -10.639  -0.644   5.473
  105    HB2  TRP  13           1HB      TRP  13  -7.902  -0.894   6.310
  106    HB3  TRP  13           2HB      TRP  13  -8.566  -2.492   5.970
  107    HD1  TRP  13           HD1      TRP  13 -10.290  -2.137   3.516
  108    HE1  TRP  13           HE1      TRP  13  -9.356  -1.339   1.261
  109    HE3  TRP  13           HE3      TRP  13  -6.037   0.156   5.177
  110    HZ2  TRP  13           HZ2      TRP  13  -7.093   0.071   0.305
  111    HZ3  TRP  13           HZ3      TRP  13  -4.539   1.202   3.528
  112    HH2  TRP  13           HH2      TRP  13  -5.057   1.159   1.144
  113    H    GLU  14           H        GLU  14 -12.057  -2.218   5.455
  114    HA   GLU  14           HA       GLU  14 -12.687  -3.657   7.867
  115    HB2  GLU  14           1HB      GLU  14 -13.737  -3.993   5.049
  116    HB3  GLU  14           2HB      GLU  14 -14.407  -4.767   6.478
  117    HG2  GLU  14           1HG      GLU  14 -14.967  -2.579   7.403
  118    HG3  GLU  14           2HG      GLU  14 -14.298  -1.804   5.966
  119    H    LYS  15           H        LYS  15 -11.500  -4.518   4.655
  120    HA   LYS  15           HA       LYS  15 -10.426  -7.020   5.716
  121    HB2  LYS  15           1HB      LYS  15 -10.543  -5.976   2.872
  122    HB3  LYS  15           2HB      LYS  15  -9.950  -7.562   3.351
  123    HG2  LYS  15           1HG      LYS  15 -12.169  -8.140   4.194
  124    HG3  LYS  15           2HG      LYS  15 -12.762  -6.548   3.721
  125    HD2  LYS  15           1HD      LYS  15 -12.222  -7.067   1.374
  126    HD3  LYS  15           2HD      LYS  15 -11.684  -8.675   1.868
  127    HE2  LYS  15           1HE      LYS  15 -13.926  -9.167   2.712
  128    HE3  LYS  15           2HE      LYS  15 -14.463  -7.556   2.240
  129    HZ1  LYS  15           3HZ      LYS  15 -15.143  -9.110   0.585
  130    HZ2  LYS  15           1HZ      LYS  15 -13.573  -9.739   0.430
  131    HZ3  LYS  15           2HZ      LYS  15 -13.910  -8.153  -0.081
  132    HA   PRO  16           HA       PRO  16  -6.921  -4.403   6.564
  133    HB2  PRO  16           1HB      PRO  16  -5.354  -6.372   7.647
  134    HB3  PRO  16           2HB      PRO  16  -6.635  -5.529   8.525
  135    HG2  PRO  16           1HG      PRO  16  -6.703  -8.201   7.179
  136    HG3  PRO  16           2HG      PRO  16  -7.375  -7.721   8.749
  137    HD2  PRO  16           1HD      PRO  16  -8.922  -7.964   6.570
  138    HD3  PRO  16           2HD      PRO  16  -9.224  -6.711   7.792
  139    H    VAL  17           H        VAL  17  -4.912  -3.986   5.739
  140    HA   VAL  17           HA       VAL  17  -4.093  -5.658   3.466
  141    HB   VAL  17           HB       VAL  17  -3.238  -2.830   4.113
  142   HG11  VAL  17          1HG1      VAL  17  -1.610  -4.035   2.782
  143   HG12  VAL  17          2HG1      VAL  17  -2.420  -2.817   1.796
  144   HG13  VAL  17          3HG1      VAL  17  -2.867  -4.515   1.642
  145   HG21  VAL  17          3HG2      VAL  17  -5.281  -3.799   2.122
  146   HG22  VAL  17          1HG2      VAL  17  -4.727  -2.137   2.304
  147   HG23  VAL  17          2HG2      VAL  17  -5.622  -2.916   3.608
  148    H    THR  18           H        THR  18  -2.688  -7.151   4.172
  149    HA   THR  18           HA       THR  18  -0.640  -6.413   6.119
  150    HB   THR  18           HB       THR  18  -1.052  -9.133   4.881
  151    HG1  THR  18           HG1      THR  18  -2.527  -9.573   6.482
  152   HG21  THR  18          3HG2      THR  18  -0.020  -9.907   6.969
  153   HG22  THR  18          1HG2      THR  18   0.133  -8.238   7.514
  154   HG23  THR  18          2HG2      THR  18   1.038  -8.792   6.106
  155    H    ILE  19           H        ILE  19   1.059  -5.422   5.224
  156    HA   ILE  19           HA       ILE  19   2.064  -6.413   2.649
  157    HB   ILE  19           HB       ILE  19   1.649  -3.964   2.869
  158   HG12  ILE  19          1HG1      ILE  19   4.600  -4.514   2.530
  159   HG13  ILE  19          2HG1      ILE  19   3.403  -4.988   1.327
  160   HG21  ILE  19          1HG2      ILE  19   3.233  -2.602   4.182
  161   HG22  ILE  19          2HG2      ILE  19   3.888  -4.084   4.881
  162   HG23  ILE  19          3HG2      ILE  19   2.210  -3.629   5.186
  163   HD11  ILE  19          3HD1      ILE  19   4.471  -2.898   0.728
  164   HD12  ILE  19          1HD1      ILE  19   3.969  -2.185   2.262
  165   HD13  ILE  19          2HD1      ILE  19   2.756  -2.647   1.066
  166    H    SER  20           H        SER  20   3.958  -7.481   2.511
  167    HA   SER  20           HA       SER  20   5.358  -7.959   5.033
  168    HB2  SER  20           1HB      SER  20   6.361  -9.899   3.669
  169    HB3  SER  20           2HB      SER  20   4.662 -10.012   4.129
  170    HG   SER  20           HG       SER  20   5.105 -10.521   1.893
  171    H    LEU  21           H        LEU  21   7.150  -6.871   5.372
  172    HA   LEU  21           HA       LEU  21   8.625  -5.549   3.348
  173    HB2  LEU  21           1HB      LEU  21   9.196  -6.216   6.221
  174    HB3  LEU  21           2HB      LEU  21  10.440  -5.513   5.206
  175    HG   LEU  21           HG       LEU  21   8.946  -3.566   4.789
  176   HD11  LEU  21          1HD1      LEU  21   7.210  -4.834   6.902
  177   HD12  LEU  21          2HD1      LEU  21   6.790  -4.623   5.200
  178   HD13  LEU  21          3HD1      LEU  21   7.012  -3.211   6.235
  179   HD21  LEU  21          3HD2      LEU  21   9.240  -2.569   7.005
  180   HD22  LEU  21          1HD2      LEU  21  10.670  -3.465   6.490
  181   HD23  LEU  21          2HD2      LEU  21   9.567  -4.167   7.673
  182    H    GLN  22           H        GLN  22  11.048  -6.028   3.024
  183    HA   GLN  22           HA       GLN  22  11.026  -8.463   1.579
  184    HB2  GLN  22           1HB      GLN  22  13.303  -6.566   2.153
  185    HB3  GLN  22           2HB      GLN  22  13.355  -7.878   0.980
  186    HG2  GLN  22           1HG      GLN  22  11.548  -6.849  -0.277
  187    HG3  GLN  22           2HG      GLN  22  11.449  -5.551   0.909
  188   HE21  GLN  22          2HE2      GLN  22  12.002  -5.454  -1.965
  189   HE22  GLN  22          1HE2      GLN  22  13.521  -4.647  -2.119
  190    H    ASN  23           H        ASN  23  11.960  -7.772   4.790
  191    HA   ASN  23           HA       ASN  23  13.609 -10.171   5.006
  192    HB2  ASN  23           1HB      ASN  23  12.887  -7.997   6.972
  193    HB3  ASN  23           2HB      ASN  23  13.764  -9.449   7.441
  194   HD21  ASN  23          2HD2      ASN  23  14.573  -6.649   7.501
  195   HD22  ASN  23          1HD2      ASN  23  16.034  -6.563   6.559
  196    H    GLY  24           H        GLY  24  10.518  -9.872   4.626
  197    HA2  GLY  24           1HA      GLY  24   8.782 -11.320   5.088
  198    HA3  GLY  24           2HA      GLY  24   9.851 -12.204   6.167
  199    H    ALA  25           H        ALA  25   8.825  -8.812   6.187
  200    HA   ALA  25           HA       ALA  25   7.849  -9.246   8.930
  201    HB1  ALA  25           3HB      ALA  25   8.877  -6.692   7.696
  202    HB2  ALA  25           1HB      ALA  25   9.765  -7.732   8.809
  203    HB3  ALA  25           2HB      ALA  25   8.316  -6.890   9.356
  204    HA   PRO  26           HA       PRO  26   3.993  -8.288   6.707
  205    HB2  PRO  26           1HB      PRO  26   2.707  -9.728   8.879
  206    HB3  PRO  26           2HB      PRO  26   2.782 -10.145   7.166
  207    HG2  PRO  26           1HG      PRO  26   4.068 -11.572   9.082
  208    HG3  PRO  26           2HG      PRO  26   4.674 -11.420   7.422
  209    HD2  PRO  26           1HD      PRO  26   5.517  -9.935   9.891
  210    HD3  PRO  26           2HD      PRO  26   6.522 -10.642   8.605
  211    H    ARG  27           H        ARG  27   3.318  -6.262   7.021
  212    HA   ARG  27           HA       ARG  27   2.578  -5.466   9.762
  213    HB2  ARG  27           1HB      ARG  27   3.563  -3.789   7.452
  214    HB3  ARG  27           2HB      ARG  27   2.848  -3.102   8.908
  215    HG2  ARG  27           1HG      ARG  27   4.602  -4.177  10.251
  216    HG3  ARG  27           2HG      ARG  27   5.331  -4.801   8.771
  217    HD2  ARG  27           1HD      ARG  27   5.771  -2.557   7.994
  218    HD3  ARG  27           2HD      ARG  27   4.924  -1.877   9.386
  219    HE   ARG  27           HE       ARG  27   6.883  -3.468  10.460
  220   HH11  ARG  27          1HH1      ARG  27   6.856  -0.730   8.273
  221   HH12  ARG  27          2HH1      ARG  27   8.419  -0.154   8.775
  222   HH21  ARG  27          1HH2      ARG  27   8.909  -2.717  11.118
  223   HH22  ARG  27          2HH2      ARG  27   9.586  -1.287  10.399
  224    H    ILE  28           H        ILE  28   0.500  -5.351  10.101
  225    HA   ILE  28           HA       ILE  28  -1.337  -5.411   7.846
  226    HB   ILE  28           HB       ILE  28  -1.875  -5.747  10.803
  227   HG12  ILE  28          1HG1      ILE  28  -1.618  -7.827   8.617
  228   HG13  ILE  28          2HG1      ILE  28  -0.436  -7.525   9.885
  229   HG21  ILE  28          1HG2      ILE  28  -3.639  -6.280   8.417
  230   HG22  ILE  28          2HG2      ILE  28  -3.840  -4.982   9.595
  231   HG23  ILE  28          3HG2      ILE  28  -4.034  -6.664  10.093
  232   HD11  ILE  28          3HD1      ILE  28  -3.250  -8.503  10.304
  233   HD12  ILE  28          1HD1      ILE  28  -2.055  -8.217  11.568
  234   HD13  ILE  28          2HD1      ILE  28  -1.786  -9.485  10.370
  235    H    PHE  29           H        PHE  29  -2.138  -3.563   7.115
  236    HA   PHE  29           HA       PHE  29  -2.091  -1.160   8.697
  237    HB2  PHE  29           1HB      PHE  29  -3.273  -1.679   5.962
  238    HB3  PHE  29           2HB      PHE  29  -3.099  -0.095   6.711
  239    HD1  PHE  29           HD2      PHE  29  -0.514   0.041   7.774
  240    HD2  PHE  29           HD1      PHE  29  -1.790  -1.963   4.245
  241    HE1  PHE  29           HE2      PHE  29   1.758   0.227   6.854
  242    HE2  PHE  29           HE1      PHE  29   0.481  -1.785   3.317
  243    HZ   PHE  29           HZ       PHE  29   2.259  -0.689   4.622
  244    H    ASN  30           H        ASN  30  -3.616  -0.390   9.928
  245    HA   ASN  30           HA       ASN  30  -6.133  -1.812  10.178
  246    HB2  ASN  30           1HB      ASN  30  -5.086   0.604  11.677
  247    HB3  ASN  30           2HB      ASN  30  -6.506  -0.342  12.113
  248   HD21  ASN  30          2HD2      ASN  30  -3.022  -0.297  11.935
  249   HD22  ASN  30          1HD2      ASN  30  -2.763  -1.648  12.993
  250    H    GLY  31           H        GLY  31  -4.966   1.371   9.223
  251    HA2  GLY  31           1HA      GLY  31  -7.651   1.933   8.133
  252    HA3  GLY  31           2HA      GLY  31  -6.725   3.163   8.984
  253    H    VAL  32           H        VAL  32  -7.663   3.528   6.399
  254    HA   VAL  32           HA       VAL  32  -5.836   2.835   4.375
  255    HB   VAL  32           HB       VAL  32  -7.701   5.213   4.495
  256   HG11  VAL  32          1HG1      VAL  32  -7.516   5.287   2.096
  257   HG12  VAL  32          2HG1      VAL  32  -6.432   3.896   2.099
  258   HG13  VAL  32          3HG1      VAL  32  -5.911   5.426   2.807
  259   HG21  VAL  32          3HG2      VAL  32  -8.084   2.451   3.342
  260   HG22  VAL  32          1HG2      VAL  32  -9.213   3.796   3.167
  261   HG23  VAL  32          2HG2      VAL  32  -8.891   3.116   4.763
  262    H    TYR  33           H        TYR  33  -5.978   5.592   6.564
  263    HA   TYR  33           HA       TYR  33  -4.022   7.158   5.239
  264    HB2  TYR  33           1HB      TYR  33  -5.654   8.069   6.881
  265    HB3  TYR  33           2HB      TYR  33  -4.802   7.216   8.162
  266    HD1  TYR  33           HD2      TYR  33  -2.623   7.996   8.947
  267    HD2  TYR  33           HD1      TYR  33  -4.708  10.036   5.848
  268    HE1  TYR  33           HE2      TYR  33  -1.145   9.943   9.232
  269    HE2  TYR  33           HE1      TYR  33  -3.238  11.980   6.126
  270    HH   TYR  33           HH       TYR  33  -0.431  11.887   8.211
  271    H    GLU  34           H        GLU  34  -3.903   4.636   7.647
  272    HA   GLU  34           HA       GLU  34  -1.221   4.993   8.460
  273    HB2  GLU  34           1HB      GLU  34  -2.888   3.686   9.732
  274    HB3  GLU  34           2HB      GLU  34  -2.892   2.471   8.459
  275    HG2  GLU  34           1HG      GLU  34  -0.605   1.915   8.911
  276    HG3  GLU  34           2HG      GLU  34  -0.475   3.241  10.066
  277    H    ALA  35           H        ALA  35  -2.734   3.171   5.863
  278    HA   ALA  35           HA       ALA  35  -0.398   1.844   4.958
  279    HB1  ALA  35           3HB      ALA  35  -2.647   1.119   4.322
  280    HB2  ALA  35           1HB      ALA  35  -1.659   1.450   2.899
  281    HB3  ALA  35           2HB      ALA  35  -2.877   2.614   3.417
  282    H    PHE  36           H        PHE  36  -1.918   4.920   4.158
  283    HA   PHE  36           HA       PHE  36  -0.216   5.688   2.061
  284    HB2  PHE  36           1HB      PHE  36  -2.370   6.790   2.572
  285    HB3  PHE  36           2HB      PHE  36  -1.683   7.432   4.058
  286    HD1  PHE  36           HD1      PHE  36  -1.470   7.552   0.376
  287    HD2  PHE  36           HD2      PHE  36  -0.418   9.423   4.052
  288    HE1  PHE  36           HE1      PHE  36  -0.721   9.546  -0.857
  289    HE2  PHE  36           HE2      PHE  36   0.335  11.418   2.827
  290    HZ   PHE  36           HZ       PHE  36   0.182  11.484   0.370
  291    H    ASP  37           H        ASP  37  -0.027   6.192   5.554
  292    HA   ASP  37           HA       ASP  37   2.246   7.820   5.645
  293    HB2  ASP  37           1HB      ASP  37   0.811   7.448   7.591
  294    HB3  ASP  37           2HB      ASP  37   1.293   5.757   7.645
  295    H    PHE  38           H        PHE  38   1.989   4.292   5.950
  296    HA   PHE  38           HA       PHE  38   4.664   3.682   6.316
  297    HB2  PHE  38           1HB      PHE  38   2.929   2.023   6.613
  298    HB3  PHE  38           2HB      PHE  38   2.508   2.099   4.907
  299    HD1  PHE  38           HD1      PHE  38   5.088   1.003   7.307
  300    HD2  PHE  38           HD2      PHE  38   3.688   0.842   3.292
  301    HE1  PHE  38           HE1      PHE  38   6.646  -0.842   6.839
  302    HE2  PHE  38           HE2      PHE  38   5.244  -1.003   2.817
  303    HZ   PHE  38           HZ       PHE  38   6.725  -1.848   4.593
  304    H    LEU  39           H        LEU  39   2.900   4.166   3.296
  305    HA   LEU  39           HA       LEU  39   4.881   3.219   1.547
  306    HB2  LEU  39           1HB      LEU  39   2.709   5.263   1.112
  307    HB3  LEU  39           2HB      LEU  39   3.684   4.575  -0.171
  308    HG   LEU  39           HG       LEU  39   1.857   2.990   1.635
  309   HD11  LEU  39          1HD1      LEU  39   1.483   3.909  -1.213
  310   HD12  LEU  39          2HD1      LEU  39   0.583   4.472   0.195
  311   HD13  LEU  39          3HD1      LEU  39   0.420   2.802  -0.344
  312   HD21  LEU  39          3HD2      LEU  39   3.401   2.215  -0.840
  313   HD22  LEU  39          1HD2      LEU  39   2.237   1.192   0.002
  314   HD23  LEU  39          2HD2      LEU  39   3.727   1.680   0.808
  315    H    GLN  40           H        GLN  40   4.558   6.293   3.176
  316    HA   GLN  40           HA       GLN  40   6.682   7.412   1.492
  317    HB2  GLN  40           1HB      GLN  40   4.907   8.763   3.527
  318    HB3  GLN  40           2HB      GLN  40   6.123   9.570   2.546
  319    HG2  GLN  40           1HG      GLN  40   4.891   8.857   0.520
  320    HG3  GLN  40           2HG      GLN  40   3.636   8.193   1.563
  321   HE21  GLN  40          2HE2      GLN  40   3.489  10.302  -0.436
  322   HE22  GLN  40          1HE2      GLN  40   2.902  11.709   0.386
  323    H    HIS  41           H        HIS  41   6.035   6.284   4.704
  324    HA   HIS  41           HA       HIS  41   8.425   7.479   5.809
  325    HB2  HIS  41           1HB      HIS  41   6.253   5.729   6.902
  326    HB3  HIS  41           2HB      HIS  41   7.763   5.909   7.790
  327    HD1  HIS  41           HD1      HIS  41   7.789   7.754   9.407
  328    HD2  HIS  41           HD2      HIS  41   5.062   8.437   6.341
  329    HE1  HIS  41           HE1      HIS  41   6.613   9.898  10.005
  330    HE2  HIS  41           HE2      HIS  41   4.817  10.161   8.257
  331    H    GLU  42           H        GLU  42   7.344   4.197   4.963
  332    HA   GLU  42           HA       GLU  42  10.149   3.362   4.955
  333    HB2  GLU  42           1HB      GLU  42   7.949   2.007   6.508
  334    HB3  GLU  42           2HB      GLU  42   9.486   1.241   6.136
  335    HG2  GLU  42           1HG      GLU  42  10.663   2.962   7.381
  336    HG3  GLU  42           2HG      GLU  42   9.135   3.768   7.731
  337    H    TRP  43           H        TRP  43   9.642   3.530   2.627
  338    HA   TRP  43           HA       TRP  43   8.387   1.041   1.695
  339    HB2  TRP  43           1HB      TRP  43   7.406   3.135   0.790
  340    HB3  TRP  43           2HB      TRP  43   8.979   3.562   0.128
  341    HD1  TRP  43           HD1      TRP  43   9.146   3.078  -2.342
  342    HE1  TRP  43           HE1      TRP  43   8.136   1.381  -3.996
  343    HE3  TRP  43           HE3      TRP  43   6.338   0.325   0.938
  344    HZ2  TRP  43           HZ2      TRP  43   6.381  -0.823  -3.914
  345    HZ3  TRP  43           HZ3      TRP  43   5.026  -1.557   0.062
  346    HH2  TRP  43           HH2      TRP  43   5.048  -2.121  -2.312
  347    HA   PRO  44           HA       PRO  44  12.741   0.097   1.230
  348    HB2  PRO  44           1HB      PRO  44  12.502  -2.562   1.234
  349    HB3  PRO  44           2HB      PRO  44  12.218  -1.616   2.700
  350    HG2  PRO  44           1HG      PRO  44  10.238  -2.807   0.801
  351    HG3  PRO  44           2HG      PRO  44  10.196  -2.755   2.571
  352    HD2  PRO  44           1HD      PRO  44   8.829  -1.020   0.915
  353    HD3  PRO  44           2HD      PRO  44   9.273  -0.670   2.596
  354    H    ALA  45           H        ALA  45  11.236   0.844  -1.145
  355    HA   ALA  45           HA       ALA  45  12.794  -0.469  -3.139
  356    HB1  ALA  45           3HB      ALA  45  11.091  -2.208  -2.828
  357    HB2  ALA  45           1HB      ALA  45  10.968  -1.467  -4.425
  358    HB3  ALA  45           2HB      ALA  45   9.824  -1.025  -3.155
  359    H    ARG  46           H        ARG  46  11.547   0.166  -5.413
  360    HA   ARG  46           HA       ARG  46  10.857   3.011  -5.134
  361    HB2  ARG  46           1HB      ARG  46  12.163   1.530  -7.421
  362    HB3  ARG  46           2HB      ARG  46  11.586   3.186  -7.541
  363    HG2  ARG  46           1HG      ARG  46  13.153   3.934  -5.908
  364    HG3  ARG  46           2HG      ARG  46  13.627   2.276  -5.533
  365    HD2  ARG  46           1HD      ARG  46  13.983   3.587  -8.221
  366    HD3  ARG  46           2HD      ARG  46  15.241   3.480  -6.988
  367    HE   ARG  46           HE       ARG  46  14.409   0.903  -7.329
  368   HH11  ARG  46          1HH1      ARG  46  15.591   3.387  -9.506
  369   HH12  ARG  46          2HH1      ARG  46  16.359   2.250 -10.577
  370   HH21  ARG  46          1HH2      ARG  46  15.417  -0.582  -8.735
  371   HH22  ARG  46          2HH2      ARG  46  16.261   0.002 -10.136
  372    H    GLY  47           H        GLY  47  10.235   2.144  -8.269
  373    HA2  GLY  47           1HA      GLY  47   8.249   0.769  -8.941
  374    HA3  GLY  47           2HA      GLY  47   7.417   1.546  -7.599
  375    H    ASP  48           H        ASP  48   8.596   4.108  -8.000
  376    HA   ASP  48           HA       ASP  48   8.157   6.085  -8.994
  377    HB2  ASP  48           1HB      ASP  48   9.623   5.116 -10.739
  378    HB3  ASP  48           2HB      ASP  48   8.202   4.479 -11.556
  379    H    ARG  49           H        ARG  49   6.414   4.448 -11.558
  380    HA   ARG  49           HA       ARG  49   4.105   6.033 -11.221
  381    HB2  ARG  49           1HB      ARG  49   4.488   3.429 -12.702
  382    HB3  ARG  49           2HB      ARG  49   3.053   4.436 -12.825
  383    HG2  ARG  49           1HG      ARG  49   4.358   6.238 -13.775
  384    HG3  ARG  49           2HG      ARG  49   5.840   5.300 -13.570
  385    HD2  ARG  49           1HD      ARG  49   3.490   4.531 -15.300
  386    HD3  ARG  49           2HD      ARG  49   5.015   5.208 -15.875
  387    HE   ARG  49           HE       ARG  49   6.017   3.123 -14.761
  388   HH11  ARG  49          1HH1      ARG  49   2.860   3.239 -16.276
  389   HH12  ARG  49          2HH1      ARG  49   2.869   1.554 -16.719
  390   HH21  ARG  49          1HH2      ARG  49   6.043   0.927 -15.342
  391   HH22  ARG  49          2HH2      ARG  49   4.694   0.234 -16.188
  392    H    ALA  50           H        ALA  50   4.865   2.709 -10.279
  393    HA   ALA  50           HA       ALA  50   2.308   2.059  -9.276
  394    HB1  ALA  50           3HB      ALA  50   4.973   0.905  -8.457
  395    HB2  ALA  50           1HB      ALA  50   4.016   0.378  -9.842
  396    HB3  ALA  50           2HB      ALA  50   3.391   0.169  -8.206
  397    H    HIS  51           H        HIS  51   5.056   3.700  -7.890
  398    HA   HIS  51           HA       HIS  51   4.201   3.531  -5.176
  399    HB2  HIS  51           1HB      HIS  51   6.558   3.937  -5.811
  400    HB3  HIS  51           2HB      HIS  51   6.099   5.499  -6.480
  401    HD1  HIS  51           HD1      HIS  51   6.759   3.746  -3.252
  402    HD2  HIS  51           HD2      HIS  51   5.586   7.504  -4.579
  403    HE1  HIS  51           HE1      HIS  51   6.986   5.265  -1.263
  404    HE2  HIS  51           HE2      HIS  51   6.491   7.571  -2.157
  405    H    GLU  52           H        GLU  52   4.021   6.068  -7.660
  406    HA   GLU  52           HA       GLU  52   2.605   7.924  -6.077
  407    HB2  GLU  52           1HB      GLU  52   2.712   7.606  -9.080
  408    HB3  GLU  52           2HB      GLU  52   2.038   9.000  -8.245
  409    HG2  GLU  52           1HG      GLU  52   4.900   8.071  -8.132
  410    HG3  GLU  52           2HG      GLU  52   4.283   9.460  -9.027
  411    H    GLN  53           H        GLN  53   1.546   5.383  -8.296
  412    HA   GLN  53           HA       GLN  53  -1.202   5.874  -8.224
  413    HB2  GLN  53           1HB      GLN  53  -0.162   4.303  -9.780
  414    HB3  GLN  53           2HB      GLN  53   0.270   3.242  -8.448
  415    HG2  GLN  53           1HG      GLN  53  -2.066   2.806  -7.995
  416    HG3  GLN  53           2HG      GLN  53  -2.539   3.936  -9.265
  417   HE21  GLN  53          2HE2      GLN  53  -2.236   3.369 -11.418
  418   HE22  GLN  53          1HE2      GLN  53  -1.964   1.728 -11.897
  419    H    ALA  54           H        ALA  54   0.787   3.787  -6.132
  420    HA   ALA  54           HA       ALA  54  -1.251   2.810  -4.503
  421    HB1  ALA  54           3HB      ALA  54   1.612   3.361  -3.738
  422    HB2  ALA  54           1HB      ALA  54   1.022   1.902  -4.529
  423    HB3  ALA  54           2HB      ALA  54   0.499   2.288  -2.890
  424    H    LEU  55           H        LEU  55   0.700   5.758  -4.170
  425    HA   LEU  55           HA       LEU  55  -0.388   6.597  -1.709
  426    HB2  LEU  55           1HB      LEU  55   0.768   8.226  -3.974
  427    HB3  LEU  55           2HB      LEU  55   0.403   8.859  -2.382
  428    HG   LEU  55           HG       LEU  55   2.444   6.716  -2.990
  429   HD11  LEU  55          1HD1      LEU  55   4.080   8.422  -2.369
  430   HD12  LEU  55          2HD1      LEU  55   2.781   9.600  -2.177
  431   HD13  LEU  55          3HD1      LEU  55   3.130   8.924  -3.769
  432   HD21  LEU  55          3HD2      LEU  55   3.093   6.990  -0.643
  433   HD22  LEU  55          1HD2      LEU  55   1.437   6.403  -0.798
  434   HD23  LEU  55          2HD2      LEU  55   1.739   8.094  -0.401
  435    H    ARG  56           H        ARG  56  -1.313   7.254  -5.056
  436    HA   ARG  56           HA       ARG  56  -3.405   9.057  -4.494
  437    HB2  ARG  56           1HB      ARG  56  -2.480   8.952  -6.704
  438    HB3  ARG  56           2HB      ARG  56  -2.897   7.249  -6.855
  439    HG2  ARG  56           1HG      ARG  56  -5.252   7.793  -6.867
  440    HG3  ARG  56           2HG      ARG  56  -4.880   9.499  -6.618
  441    HD2  ARG  56           1HD      ARG  56  -3.864   9.679  -8.754
  442    HD3  ARG  56           2HD      ARG  56  -3.876   7.930  -8.978
  443    HE   ARG  56           HE       ARG  56  -6.371   8.139  -9.009
  444   HH11  ARG  56          1HH1      ARG  56  -4.330  10.858  -9.899
  445   HH12  ARG  56          2HH1      ARG  56  -5.510  11.543 -10.974
  446   HH21  ARG  56          1HH2      ARG  56  -7.910   9.045 -10.425
  447   HH22  ARG  56          2HH2      ARG  56  -7.543  10.515 -11.279
  448    H    LEU  57           H        LEU  57  -3.347   5.540  -4.879
  449    HA   LEU  57           HA       LEU  57  -6.077   5.015  -4.769
  450    HB2  LEU  57           1HB      LEU  57  -3.813   3.397  -3.589
  451    HB3  LEU  57           2HB      LEU  57  -5.441   2.805  -3.855
  452    HG   LEU  57           HG       LEU  57  -3.611   3.753  -6.058
  453   HD11  LEU  57          1HD1      LEU  57  -4.249   0.942  -5.175
  454   HD12  LEU  57          2HD1      LEU  57  -2.706   1.769  -4.962
  455   HD13  LEU  57          3HD1      LEU  57  -3.290   1.400  -6.584
  456   HD21  LEU  57          3HD2      LEU  57  -5.984   3.932  -6.587
  457   HD22  LEU  57          1HD2      LEU  57  -6.225   2.249  -6.118
  458   HD23  LEU  57          2HD2      LEU  57  -5.225   2.640  -7.517
  459    H    CYS  58           H        CYS  58  -3.748   5.245  -2.099
  460    HA   CYS  58           HA       CYS  58  -5.630   4.867  -0.029
  461    HB2  CYS  58           1HB      CYS  58  -3.000   6.356   0.096
  462    HB3  CYS  58           2HB      CYS  58  -3.872   5.654   1.455
  463    HG   CYS  58           HG       CYS  58  -2.123   4.052  -0.993
  464    H    ARG  59           H        ARG  59  -4.351   7.741  -1.618
  465    HA   ARG  59           HA       ARG  59  -5.467   9.683   0.072
  466    HB2  ARG  59           1HB      ARG  59  -3.698   9.951  -1.756
  467    HB3  ARG  59           2HB      ARG  59  -5.035  10.023  -2.892
  468    HG2  ARG  59           1HG      ARG  59  -5.911  11.991  -1.736
  469    HG3  ARG  59           2HG      ARG  59  -4.563  11.918  -0.598
  470    HD2  ARG  59           1HD      ARG  59  -4.020  13.548  -2.255
  471    HD3  ARG  59           2HD      ARG  59  -3.013  12.132  -2.550
  472    HE   ARG  59           HE       ARG  59  -5.491  12.621  -4.075
  473   HH11  ARG  59          1HH1      ARG  59  -2.040  11.942  -3.976
  474   HH12  ARG  59          2HH1      ARG  59  -1.919  11.715  -5.697
  475   HH21  ARG  59          1HH2      ARG  59  -5.320  12.346  -6.315
  476   HH22  ARG  59          2HH2      ARG  59  -3.783  11.960  -7.032
  477    H    ALA  60           H        ALA  60  -6.702   8.246  -2.941
  478    HA   ALA  60           HA       ALA  60  -9.111   9.761  -2.969
  479    HB1  ALA  60           3HB      ALA  60  -8.484   7.166  -4.371
  480    HB2  ALA  60           1HB      ALA  60  -8.151   8.782  -4.996
  481    HB3  ALA  60           2HB      ALA  60  -9.818   8.260  -4.747
  482    H    SER  61           H        SER  61  -8.184   6.737  -1.495
  483    HA   SER  61           HA       SER  61 -10.820   5.844  -0.913
  484    HB2  SER  61           1HB      SER  61  -8.190   5.173   0.417
  485    HB3  SER  61           2HB      SER  61  -9.704   4.312   0.686
  486    HG   SER  61           HG       SER  61  -8.130   4.451  -1.658
  487    H    LEU  62           H        LEU  62  -8.472   7.859   0.776
  488    HA   LEU  62           HA       LEU  62  -9.973   8.156   3.170
  489    HB2  LEU  62           1HB      LEU  62  -7.843   9.879   1.908
  490    HB3  LEU  62           2HB      LEU  62  -8.545  10.213   3.479
  491    HG   LEU  62           HG       LEU  62  -7.057   7.681   2.783
  492   HD11  LEU  62          1HD1      LEU  62  -5.561   9.601   2.716
  493   HD12  LEU  62          2HD1      LEU  62  -5.242   8.609   4.140
  494   HD13  LEU  62          3HD1      LEU  62  -6.138  10.120   4.300
  495   HD21  LEU  62          3HD2      LEU  62  -8.687   7.391   4.565
  496   HD22  LEU  62          1HD2      LEU  62  -8.030   8.789   5.416
  497   HD23  LEU  62          2HD2      LEU  62  -7.047   7.340   5.213
  498    H    MET  63           H        MET  63 -10.050   9.683   0.051
  499    HA   MET  63           HA       MET  63 -11.733  11.868   0.779
  500    HB2  MET  63           1HB      MET  63 -11.225  10.539  -1.890
  501    HB3  MET  63           2HB      MET  63 -12.182  12.000  -1.685
  502    HG2  MET  63           1HG      MET  63 -10.247  13.180  -0.833
  503    HG3  MET  63           2HG      MET  63  -9.279  11.712  -0.946
  504    HE1  MET  63           3HE      MET  63 -11.996  12.919  -3.530
  505    HE2  MET  63           1HE      MET  63 -11.018  13.890  -4.632
  506    HE3  MET  63           2HE      MET  63 -11.278  14.432  -2.973
  507    H    GLY  64           H        GLY  64 -12.240   8.554  -0.195
  508    HA2  GLY  64           1HA      GLY  64 -14.179   7.370   0.550
  509    HA3  GLY  64           2HA      GLY  64 -15.087   8.872   0.456
  510    H    ASP  65           H        ASP  65 -12.966   8.174  -2.160
  511    HA   ASP  65           HA       ASP  65 -15.304   7.648  -3.837
  512    HB2  ASP  65           1HB      ASP  65 -12.571   8.728  -4.409
  513    HB3  ASP  65           2HB      ASP  65 -13.507   7.995  -5.709
  514    H    VAL  66           H        VAL  66 -12.465   6.119  -2.620
  515    HA   VAL  66           HA       VAL  66 -12.913   3.825  -4.390
  516    HB   VAL  66           HB       VAL  66 -10.629   4.312  -2.468
  517   HG11  VAL  66          1HG1      VAL  66  -9.563   2.428  -3.633
  518   HG12  VAL  66          2HG1      VAL  66 -11.046   2.173  -4.551
  519   HG13  VAL  66          3HG1      VAL  66 -11.041   1.950  -2.801
  520   HG21  VAL  66          3HG2      VAL  66  -9.278   4.713  -4.473
  521   HG22  VAL  66          1HG2      VAL  66 -10.583   5.891  -4.328
  522   HG23  VAL  66          2HG2      VAL  66 -10.721   4.560  -5.476
  523    H    ALA  67           H        ALA  67 -14.184   2.270  -3.667
  524    HA   ALA  67           HA       ALA  67 -15.110   2.280  -0.958
  525    HB1  ALA  67           3HB      ALA  67 -16.611   0.517  -1.655
  526    HB2  ALA  67           1HB      ALA  67 -15.716   0.320  -3.162
  527    HB3  ALA  67           2HB      ALA  67 -16.595   1.815  -2.849
  528    H    GLY  68           H        GLY  68 -12.685   1.869  -0.336
  529    HA2  GLY  68           1HA      GLY  68 -11.489   0.559   1.110
  530    HA3  GLY  68           2HA      GLY  68 -12.868  -0.517   1.156
  531    H    GLU  69           H        GLU  69 -13.015  -2.168  -0.541
  532    HA   GLU  69           HA       GLU  69 -10.566  -3.588  -0.479
  533    HB2  GLU  69           1HB      GLU  69 -12.813  -4.634  -0.322
  534    HB3  GLU  69           2HB      GLU  69 -13.061  -4.276  -2.027
  535    HG2  GLU  69           1HG      GLU  69 -11.169  -5.683  -2.614
  536    HG3  GLU  69           2HG      GLU  69 -10.878  -6.021  -0.909
  537    H    ILE  70           H        ILE  70 -12.070  -1.613  -2.908
  538    HA   ILE  70           HA       ILE  70 -10.737  -2.557  -5.180
  539    HB   ILE  70           HB       ILE  70 -11.579   0.274  -4.541
  540   HG12  ILE  70          1HG1      ILE  70 -12.971  -1.939  -6.065
  541   HG13  ILE  70          2HG1      ILE  70 -13.423  -1.346  -4.471
  542   HG21  ILE  70          1HG2      ILE  70 -11.536   0.646  -6.961
  543   HG22  ILE  70          2HG2      ILE  70 -10.889  -0.977  -7.197
  544   HG23  ILE  70          3HG2      ILE  70  -9.935   0.235  -6.341
  545   HD11  ILE  70          3HD1      ILE  70 -14.897  -0.463  -6.171
  546   HD12  ILE  70          1HD1      ILE  70 -13.523   0.213  -7.043
  547   HD13  ILE  70          2HD1      ILE  70 -13.949   0.836  -5.450
  548    H    ALA  71           H        ALA  71  -9.758  -0.208  -2.721
  549    HA   ALA  71           HA       ALA  71  -7.242   0.392  -3.922
  550    HB1  ALA  71           3HB      ALA  71  -6.712   1.480  -1.800
  551    HB2  ALA  71           1HB      ALA  71  -8.141   0.755  -1.064
  552    HB3  ALA  71           2HB      ALA  71  -8.319   1.936  -2.361
  553    H    ARG  72           H        ARG  72  -8.384  -1.904  -1.523
  554    HA   ARG  72           HA       ARG  72  -5.940  -2.863  -0.566
  555    HB2  ARG  72           1HB      ARG  72  -8.185  -3.421   0.378
  556    HB3  ARG  72           2HB      ARG  72  -8.470  -4.465  -1.008
  557    HG2  ARG  72           1HG      ARG  72  -6.468  -5.787  -0.336
  558    HG3  ARG  72           2HG      ARG  72  -6.377  -4.809   1.125
  559    HD2  ARG  72           1HD      ARG  72  -8.818  -5.510   1.503
  560    HD3  ARG  72           2HD      ARG  72  -8.501  -6.755   0.294
  561    HE   ARG  72           HE       ARG  72  -6.807  -6.521   2.688
  562   HH11  ARG  72          1HH1      ARG  72  -8.966  -8.416   0.661
  563   HH12  ARG  72          2HH1      ARG  72  -8.701  -9.882   1.565
  564   HH21  ARG  72          1HH2      ARG  72  -6.487  -8.440   3.864
  565   HH22  ARG  72          2HH2      ARG  72  -7.303  -9.899   3.368
  566    H    THR  73           H        THR  73  -7.915  -3.957  -3.290
  567    HA   THR  73           HA       THR  73  -6.242  -6.098  -4.051
  568    HB   THR  73           HB       THR  73  -8.143  -4.559  -5.828
  569    HG1  THR  73           HG1      THR  73  -9.332  -5.198  -4.059
  570   HG21  THR  73          3HG2      THR  73  -8.371  -6.713  -6.991
  571   HG22  THR  73          1HG2      THR  73  -7.179  -7.423  -5.902
  572   HG23  THR  73          2HG2      THR  73  -6.705  -6.141  -7.015
  573    H    ALA  74           H        ALA  74  -6.477  -2.736  -5.159
  574    HA   ALA  74           HA       ALA  74  -4.572  -3.008  -7.246
  575    HB1  ALA  74           3HB      ALA  74  -4.632  -0.576  -7.355
  576    HB2  ALA  74           1HB      ALA  74  -5.489  -0.521  -5.814
  577    HB3  ALA  74           2HB      ALA  74  -6.259  -1.242  -7.227
  578    H    PHE  75           H        PHE  75  -4.354  -2.063  -3.861
  579    HA   PHE  75           HA       PHE  75  -1.731  -1.120  -3.793
  580    HB2  PHE  75           1HB      PHE  75  -3.397  -1.025  -1.917
  581    HB3  PHE  75           2HB      PHE  75  -3.119  -2.739  -1.641
  582    HD1  PHE  75           HD1      PHE  75  -0.943  -3.518  -0.780
  583    HD2  PHE  75           HD2      PHE  75  -1.854   0.618  -1.178
  584    HE1  PHE  75           HE1      PHE  75   0.922  -2.968   0.724
  585    HE2  PHE  75           HE2      PHE  75   0.012   1.175   0.326
  586    HZ   PHE  75           HZ       PHE  75   1.402  -0.617   1.278
  587    H    VAL  76           H        VAL  76  -2.959  -4.415  -3.277
  588    HA   VAL  76           HA       VAL  76  -0.442  -5.649  -2.988
  589    HB   VAL  76           HB       VAL  76  -3.062  -6.838  -3.932
  590   HG11  VAL  76          1HG1      VAL  76  -1.162  -8.222  -4.614
  591   HG12  VAL  76          2HG1      VAL  76  -2.110  -9.006  -3.350
  592   HG13  VAL  76          3HG1      VAL  76  -0.575  -8.236  -2.950
  593   HG21  VAL  76          3HG2      VAL  76  -1.755  -6.835  -1.213
  594   HG22  VAL  76          1HG2      VAL  76  -3.265  -7.641  -1.634
  595   HG23  VAL  76          2HG2      VAL  76  -3.161  -5.881  -1.684
  596    H    ALA  77           H        ALA  77  -2.492  -5.052  -5.806
  597    HA   ALA  77           HA       ALA  77  -1.081  -6.543  -7.696
  598    HB1  ALA  77           3HB      ALA  77  -2.608  -3.980  -8.135
  599    HB2  ALA  77           1HB      ALA  77  -3.300  -5.601  -8.103
  600    HB3  ALA  77           2HB      ALA  77  -2.163  -5.151  -9.376
  601    H    ALA  78           H        ALA  78  -0.650  -3.160  -6.693
  602    HA   ALA  78           HA       ALA  78   1.461  -2.609  -8.509
  603    HB1  ALA  78           3HB      ALA  78   1.848  -0.614  -7.160
  604    HB2  ALA  78           1HB      ALA  78   0.808  -1.262  -5.890
  605    HB3  ALA  78           2HB      ALA  78   0.124  -0.845  -7.461
  606    H    SER  79           H        SER  79   1.333  -3.975  -5.296
  607    HA   SER  79           HA       SER  79   4.123  -3.646  -4.744
  608    HB2  SER  79           1HB      SER  79   2.068  -5.386  -3.355
  609    HB3  SER  79           2HB      SER  79   3.655  -4.942  -2.723
  610    HG   SER  79           HG       SER  79   1.420  -3.262  -3.200
  611    H    ARG  80           H        ARG  80   2.434  -5.815  -6.702
  612    HA   ARG  80           HA       ARG  80   3.804  -8.228  -6.165
  613    HB2  ARG  80           1HB      ARG  80   2.619  -7.339  -8.800
  614    HB3  ARG  80           2HB      ARG  80   3.026  -8.988  -8.347
  615    HG2  ARG  80           1HG      ARG  80   1.354  -8.773  -6.481
  616    HG3  ARG  80           2HG      ARG  80   0.848  -7.252  -7.221
  617    HD2  ARG  80           1HD      ARG  80  -0.642  -8.851  -8.066
  618    HD3  ARG  80           2HD      ARG  80   0.527  -8.597  -9.363
  619    HE   ARG  80           HE       ARG  80   0.584 -10.903  -7.513
  620   HH11  ARG  80          1HH1      ARG  80   1.057  -9.507 -10.693
  621   HH12  ARG  80          2HH1      ARG  80   1.535 -11.010 -11.426
  622   HH21  ARG  80          1HH2      ARG  80   1.197 -12.874  -8.471
  623   HH22  ARG  80          2HH2      ARG  80   1.601 -12.934 -10.161
  624    H    GLN  81           H        GLN  81   4.614  -5.416  -8.064
  625    HA   GLN  81           HA       GLN  81   6.708  -6.583  -9.576
  626    HB2  GLN  81           1HB      GLN  81   5.646  -4.488 -10.242
  627    HB3  GLN  81           2HB      GLN  81   6.251  -3.699  -8.793
  628    HG2  GLN  81           1HG      GLN  81   8.520  -3.910  -9.560
  629    HG3  GLN  81           2HG      GLN  81   8.001  -4.873 -10.943
  630   HE21  GLN  81          2HE2      GLN  81   9.479  -2.350 -10.831
  631   HE22  GLN  81          1HE2      GLN  81   8.555  -1.225 -11.764
  632    H    ALA  82           H        ALA  82   6.498  -5.388  -6.336
  633    HA   ALA  82           HA       ALA  82   9.300  -5.052  -5.907
  634    HB1  ALA  82           3HB      ALA  82   7.605  -3.927  -4.522
  635    HB2  ALA  82           1HB      ALA  82   8.734  -4.874  -3.554
  636    HB3  ALA  82           2HB      ALA  82   7.113  -5.494  -3.876
  637    H    HIS  83           H        HIS  83   7.247  -7.733  -6.157
  638    HA   HIS  83           HA       HIS  83   7.554  -9.967  -6.001
  639    HB2  HIS  83           1HB      HIS  83  10.465  -9.166  -5.848
  640    HB3  HIS  83           2HB      HIS  83   9.905 -10.828  -6.013
  641    HD1  HIS  83           HD1      HIS  83  11.205  -8.271  -8.022
  642    HD2  HIS  83           HD2      HIS  83   7.983 -10.867  -8.433
  643    HE1  HIS  83           HE1      HIS  83  10.685  -8.322 -10.483
  644    HE2  HIS  83           HE2      HIS  83   8.603  -9.734 -10.667
  645    H    CYS  84           H        CYS  84   6.908  -8.551  -3.663
  646    HA   CYS  84           HA       CYS  84   7.707 -10.523  -1.714
  647    HB2  CYS  84           1HB      CYS  84   9.391  -8.679  -1.517
  648    HB3  CYS  84           2HB      CYS  84   8.074  -7.577  -1.130
  649    HG   CYS  84           HG       CYS  84   7.698  -8.289   1.354
  650    H    LEU  85           H        LEU  85   5.623 -11.203  -1.697
  651    HA   LEU  85           HA       LEU  85   3.624  -9.325  -0.623
  652    HB2  LEU  85           1HB      LEU  85   3.188 -11.644  -2.512
  653    HB3  LEU  85           2HB      LEU  85   1.911 -10.681  -1.795
  654    HG   LEU  85           HG       LEU  85   4.016  -9.621  -3.683
  655   HD11  LEU  85          1HD1      LEU  85   2.510 -11.153  -4.817
  656   HD12  LEU  85          2HD1      LEU  85   2.182  -9.488  -5.303
  657   HD13  LEU  85          3HD1      LEU  85   1.117 -10.298  -4.153
  658   HD21  LEU  85          3HD2      LEU  85   2.584  -7.632  -3.760
  659   HD22  LEU  85          1HD2      LEU  85   3.197  -7.932  -2.134
  660   HD23  LEU  85          2HD2      LEU  85   1.533  -8.346  -2.539
  661    H    MET  86           H        MET  86   1.714 -10.736   0.356
  662    HA   MET  86           HA       MET  86   2.880 -12.382   2.395
  663    HB2  MET  86           1HB      MET  86   0.033 -11.634   1.754
  664    HB3  MET  86           2HB      MET  86   0.446 -12.745   3.054
  665    HG2  MET  86           1HG      MET  86   1.357  -9.887   2.815
  666    HG3  MET  86           2HG      MET  86   0.086 -10.488   3.880
  667    HE1  MET  86           3HE      MET  86   0.535 -12.092   5.974
  668    HE2  MET  86           1HE      MET  86   2.118 -12.785   6.333
  669    HE3  MET  86           2HE      MET  86   1.268 -13.242   4.855
  670    H    GLU  87           H        GLU  87   1.328 -12.893  -0.650
  671    HA   GLU  87           HA       GLU  87   0.818 -15.679  -0.280
  672    HB2  GLU  87           1HB      GLU  87   1.138 -14.124  -2.858
  673    HB3  GLU  87           2HB      GLU  87   0.466 -15.741  -2.705
  674    HG2  GLU  87           1HG      GLU  87  -1.349 -14.779  -1.299
  675    HG3  GLU  87           2HG      GLU  87  -0.706 -13.177  -1.656
  676    H    ASP  88           H        ASP  88   2.602 -16.777   0.354
  677    HA   ASP  88           HA       ASP  88   5.120 -16.417  -1.040
  678    HB2  ASP  88           1HB      ASP  88   6.040 -17.975   0.568
  679    HB3  ASP  88           2HB      ASP  88   5.054 -16.793   1.421
  680    H    LYS  89           H        LYS  89   6.006 -19.140  -0.960
  681    HA   LYS  89           HA       LYS  89   4.959 -19.921  -3.504
  682    HB2  LYS  89           1HB      LYS  89   6.894 -21.394  -1.717
  683    HB3  LYS  89           2HB      LYS  89   6.587 -21.737  -3.415
  684    HG2  LYS  89           1HG      LYS  89   7.412 -19.474  -3.977
  685    HG3  LYS  89           2HG      LYS  89   7.817 -19.238  -2.275
  686    HD2  LYS  89           1HD      LYS  89   9.306 -21.205  -2.392
  687    HD3  LYS  89           2HD      LYS  89   8.947 -21.344  -4.115
  688    HE2  LYS  89           1HE      LYS  89   9.810 -19.026  -4.405
  689    HE3  LYS  89           2HE      LYS  89  10.311 -19.055  -2.715
  690    HZ1  LYS  89           3HZ      LYS  89  11.303 -20.759  -4.927
  691    HZ2  LYS  89           1HZ      LYS  89  11.639 -21.074  -3.292
  692    HZ3  LYS  89           2HZ      LYS  89  12.180 -19.635  -4.006
  693    H    ALA  90           H        ALA  90   2.758 -20.134  -2.730
  694    HA   ALA  90           HA       ALA  90   2.220 -22.964  -2.205
  695    HB1  ALA  90           3HB      ALA  90   0.741 -20.704  -0.844
  696    HB2  ALA  90           1HB      ALA  90   1.881 -21.801  -0.063
  697    HB3  ALA  90           2HB      ALA  90   0.364 -22.421  -0.714
  698    H    GLU  91           H        GLU  91   2.143 -22.652  -4.587
  699    HA   GLU  91           HA       GLU  91  -0.140 -21.140  -5.584
  700    HB2  GLU  91           1HB      GLU  91   1.967 -22.667  -7.119
  701    HB3  GLU  91           2HB      GLU  91   0.802 -21.532  -7.789
  702    HG2  GLU  91           1HG      GLU  91   1.841 -19.704  -6.603
  703    HG3  GLU  91           2HG      GLU  91   2.954 -20.819  -5.808
  704    H    ALA  92           H        ALA  92  -1.915 -22.304  -5.056
  705    HA   ALA  92           HA       ALA  92  -2.159 -24.941  -6.347
  706    HB1  ALA  92           3HB      ALA  92  -2.166 -25.154  -3.901
  707    HB2  ALA  92           1HB      ALA  92  -3.725 -25.598  -4.599
  708    HB3  ALA  92           2HB      ALA  92  -3.524 -24.033  -3.811
  709    HA   PRO  93           HA       PRO  93  -5.094 -22.265  -8.573
  710    HB2  PRO  93           1HB      PRO  93  -5.398 -24.058 -10.634
  711    HB3  PRO  93           2HB      PRO  93  -4.134 -22.827 -10.563
  712    HG2  PRO  93           1HG      PRO  93  -3.991 -25.736  -9.901
  713    HG3  PRO  93           2HG      PRO  93  -2.800 -24.712 -10.726
  714    HD2  PRO  93           1HD      PRO  93  -2.541 -25.424  -8.134
  715    HD3  PRO  93           2HD      PRO  93  -1.977 -23.856  -8.749
  716    H    ASN  94           H        ASN  94  -5.544 -25.801  -8.754
  717    HA   ASN  94           HA       ASN  94  -8.387 -25.424  -8.214
  718    HB2  ASN  94           1HB      ASN  94  -8.661 -27.745  -8.919
  719    HB3  ASN  94           2HB      ASN  94  -7.756 -26.847 -10.131
  720   HD21  ASN  94          2HD2      ASN  94  -7.887 -29.719  -9.588
  721   HD22  ASN  94          1HD2      ASN  94  -6.254 -30.221  -9.316
  722    H    THR  95           H        THR  95  -9.338 -27.331  -6.845
  723    HA   THR  95           HA       THR  95  -7.881 -27.246  -4.317
  724    HB   THR  95           HB       THR  95 -10.199 -28.157  -3.502
  725    HG1  THR  95           HG1      THR  95 -11.169 -28.498  -5.506
  726   HG21  THR  95          3HG2      THR  95 -10.997 -25.851  -3.262
  727   HG22  THR  95          1HG2      THR  95  -9.829 -25.319  -4.471
  728   HG23  THR  95          2HG2      THR  95  -9.268 -25.966  -2.928
  729    H    ILE  96           H        ILE  96  -6.807 -28.950  -3.648
  730    HA   ILE  96           HA       ILE  96  -7.674 -31.634  -4.487
  731    HB   ILE  96           HB       ILE  96  -4.962 -30.709  -3.486
  732   HG12  ILE  96          1HG1      ILE  96  -4.277 -31.699  -5.776
  733   HG13  ILE  96          2HG1      ILE  96  -5.985 -31.574  -6.182
  734   HG21  ILE  96          1HG2      ILE  96  -5.432 -32.926  -2.622
  735   HG22  ILE  96          2HG2      ILE  96  -4.195 -33.006  -3.877
  736   HG23  ILE  96          3HG2      ILE  96  -5.851 -33.489  -4.240
  737   HD11  ILE  96          3HD1      ILE  96  -4.728 -29.673  -7.010
  738   HD12  ILE  96          1HD1      ILE  96  -4.193 -29.296  -5.373
  739   HD13  ILE  96          2HD1      ILE  96  -5.903 -29.171  -5.792
  740    H    ALA  97           H        ALA  97  -7.880 -33.250  -2.861
  741    HA   ALA  97           HA       ALA  97  -9.003 -32.243  -0.440
  742    HB1  ALA  97           3HB      ALA  97  -9.512 -34.547   0.071
  743    HB2  ALA  97           1HB      ALA  97  -8.410 -35.099  -1.190
  744    HB3  ALA  97           2HB      ALA  97  -9.873 -34.214  -1.623
  745    H    SER  98           H        SER  98  -5.949 -32.096  -0.980
  746    HA   SER  98           HA       SER  98  -4.902 -33.506   1.331
  747    HB2  SER  98           1HB      SER  98  -2.731 -32.448   0.606
  748    HB3  SER  98           2HB      SER  98  -3.484 -33.474  -0.616
  749    HG   SER  98           HG       SER  98  -3.151 -30.704  -0.555
  750    H    GLY  99           H        GLY  99  -6.799 -31.021   1.203
  751    HA2  GLY  99           1HA      GLY  99  -5.554 -28.827   2.383
  752    HA3  GLY  99           2HA      GLY  99  -7.252 -29.237   2.563
  753    H    SER 100           H        SER 100  -4.366 -28.835   4.133
  754    HA   SER 100           HA       SER 100  -5.407 -30.066   6.567
  755    HB2  SER 100           1HB      SER 100  -3.753 -31.618   5.452
  756    HB3  SER 100           2HB      SER 100  -2.532 -30.365   5.653
  757    HG   SER 100           HG       SER 100  -3.205 -30.503   7.993
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1  -4.607  23.804   8.805
    2    H2   MET   1           2H       MET   1  -4.700  25.204   7.850
    3    H3   MET   1           3H       MET   1  -5.755  23.907   7.558
    4    HA   MET   1           HA       MET   1  -5.676  25.551  10.020
    5    HB2  MET   1           1HB      MET   1  -6.559  26.718   7.987
    6    HB3  MET   1           2HB      MET   1  -7.785  25.465   7.853
    7    HG2  MET   1           1HG      MET   1  -8.677  26.087  10.029
    8    HG3  MET   1           2HG      MET   1  -7.435  27.327  10.192
    9    HE1  MET   1           3HE      MET   1 -10.495  29.611   9.677
   10    HE2  MET   1           1HE      MET   1  -9.026  29.305  10.605
   11    HE3  MET   1           2HE      MET   1 -10.363  28.154  10.664
   12    H    GLU   2           H        GLU   2  -6.251  24.343  11.696
   13    HA   GLU   2           HA       GLU   2  -7.472  21.790  11.357
   14    HB2  GLU   2           1HB      GLU   2  -7.007  23.357  13.895
   15    HB3  GLU   2           2HB      GLU   2  -7.428  21.654  13.800
   16    HG2  GLU   2           1HG      GLU   2  -5.302  21.313  12.508
   17    HG3  GLU   2           2HG      GLU   2  -4.881  22.974  12.924
   18    H    VAL   3           H        VAL   3  -9.518  21.650  10.778
   19    HA   VAL   3           HA       VAL   3 -11.519  23.375  12.011
   20    HB   VAL   3           HB       VAL   3 -13.140  22.160  10.542
   21   HG11  VAL   3          1HG1      VAL   3 -12.387  23.186   8.447
   22   HG12  VAL   3          2HG1      VAL   3 -10.775  23.395   9.134
   23   HG13  VAL   3          3HG1      VAL   3 -12.145  24.263   9.823
   24   HG21  VAL   3          3HG2      VAL   3 -12.287  20.734   8.752
   25   HG22  VAL   3          1HG2      VAL   3 -11.917  20.051  10.335
   26   HG23  VAL   3          2HG2      VAL   3 -10.656  20.868   9.412
   27    H    GLN   4           H        GLN   4 -13.165  22.580  13.346
   28    HA   GLN   4           HA       GLN   4 -12.346  20.624  15.180
   29    HB2  GLN   4           1HB      GLN   4 -15.114  21.754  14.749
   30    HB3  GLN   4           2HB      GLN   4 -14.572  20.890  16.182
   31    HG2  GLN   4           1HG      GLN   4 -12.852  22.672  16.503
   32    HG3  GLN   4           2HG      GLN   4 -13.619  23.563  15.191
   33   HE21  GLN   4          2HE2      GLN   4 -13.288  24.305  17.969
   34   HE22  GLN   4          1HE2      GLN   4 -14.875  24.568  18.605
   35    H    SER   5           H        SER   5 -14.731  20.491  12.570
   36    HA   SER   5           HA       SER   5 -14.573  17.563  12.726
   37    HB2  SER   5           1HB      SER   5 -16.811  18.496  13.419
   38    HB3  SER   5           2HB      SER   5 -16.980  19.146  11.789
   39    HG   SER   5           HG       SER   5 -17.317  17.192  11.010
   40    H    MET   6           H        MET   6 -13.848  16.616  10.915
   41    HA   MET   6           HA       MET   6 -13.302  18.360   8.629
   42    HB2  MET   6           1HB      MET   6 -12.217  15.621   9.314
   43    HB3  MET   6           2HB      MET   6 -11.745  16.573   7.914
   44    HG2  MET   6           1HG      MET   6 -10.854  18.302   9.390
   45    HG3  MET   6           2HG      MET   6 -11.327  17.345  10.793
   46    HE1  MET   6           3HE      MET   6  -9.827  16.071   7.375
   47    HE2  MET   6           1HE      MET   6  -8.103  16.051   7.749
   48    HE3  MET   6           2HE      MET   6  -8.971  17.585   7.664
   49    H    LEU   7           H        LEU   7 -13.968  17.891   6.558
   50    HA   LEU   7           HA       LEU   7 -16.245  16.210   6.216
   51    HB2  LEU   7           1HB      LEU   7 -15.882  18.252   4.875
   52    HB3  LEU   7           2HB      LEU   7 -14.475  17.510   4.139
   53    HG   LEU   7           HG       LEU   7 -15.935  15.772   3.153
   54   HD11  LEU   7          1HD1      LEU   7 -18.356  16.094   3.160
   55   HD12  LEU   7          2HD1      LEU   7 -18.174  17.463   4.257
   56   HD13  LEU   7          3HD1      LEU   7 -17.740  15.839   4.792
   57   HD21  LEU   7          3HD2      LEU   7 -15.320  17.721   1.847
   58   HD22  LEU   7          1HD2      LEU   7 -16.684  18.621   2.513
   59   HD23  LEU   7          2HD2      LEU   7 -16.970  17.227   1.471
   60    H    LEU   8           H        LEU   8 -12.812  15.961   5.488
   61    HA   LEU   8           HA       LEU   8 -13.097  13.272   4.452
   62    HB2  LEU   8           1HB      LEU   8 -10.608  14.853   5.126
   63    HB3  LEU   8           2HB      LEU   8 -10.640  13.308   4.296
   64    HG   LEU   8           HG       LEU   8 -11.725  15.925   3.254
   65   HD11  LEU   8          1HD1      LEU   8  -9.414  14.211   2.357
   66   HD12  LEU   8          2HD1      LEU   8  -9.299  15.765   3.186
   67   HD13  LEU   8          3HD1      LEU   8  -9.983  15.680   1.562
   68   HD21  LEU   8          3HD2      LEU   8 -13.148  14.069   2.555
   69   HD22  LEU   8          1HD2      LEU   8 -11.732  13.193   1.973
   70   HD23  LEU   8          2HD2      LEU   8 -12.218  14.700   1.196
   71    H    ASN   9           H        ASN   9 -13.140  11.529   5.695
   72    HA   ASN   9           HA       ASN   9 -12.607  11.915   8.554
   73    HB2  ASN   9           1HB      ASN   9 -14.312   9.870   7.116
   74    HB3  ASN   9           2HB      ASN   9 -14.054   9.904   8.856
   75   HD21  ASN   9          2HD2      ASN   9 -14.070  12.841   8.922
   76   HD22  ASN   9          1HD2      ASN   9 -15.725  13.304   8.756
   77    H    ASP  10           H        ASP  10 -11.768  10.042   9.742
   78    HA   ASP  10           HA       ASP  10  -9.452   8.927   8.538
   79    HB2  ASP  10           1HB      ASP  10 -10.873   8.364  11.146
   80    HB3  ASP  10           2HB      ASP  10  -9.402   7.524  10.665
   81    H    VAL  11           H        VAL  11  -9.751   7.560   6.891
   82    HA   VAL  11           HA       VAL  11 -11.986   5.711   6.945
   83    HB   VAL  11           HB       VAL  11  -9.960   6.163   4.745
   84   HG11  VAL  11          1HG1      VAL  11 -11.604   5.046   3.317
   85   HG12  VAL  11          2HG1      VAL  11 -12.643   4.782   4.719
   86   HG13  VAL  11          3HG1      VAL  11 -11.069   3.990   4.624
   87   HG21  VAL  11          3HG2      VAL  11 -11.217   8.199   5.191
   88   HG22  VAL  11          1HG2      VAL  11 -12.732   7.303   5.090
   89   HG23  VAL  11          2HG2      VAL  11 -11.719   7.485   3.657
   90    H    LYS  12           H        LYS  12 -11.594   4.016   8.170
   91    HA   LYS  12           HA       LYS  12  -9.012   2.697   8.086
   92    HB2  LYS  12           1HB      LYS  12 -11.519   2.285   9.711
   93    HB3  LYS  12           2HB      LYS  12 -10.224   1.098   9.712
   94    HG2  LYS  12           1HG      LYS  12  -9.812   3.985  10.443
   95    HG3  LYS  12           2HG      LYS  12 -10.206   2.726  11.616
   96    HD2  LYS  12           1HD      LYS  12  -8.200   1.473  10.863
   97    HD3  LYS  12           2HD      LYS  12  -7.785   2.835   9.823
   98    HE2  LYS  12           1HE      LYS  12  -7.564   4.283  11.743
   99    HE3  LYS  12           2HE      LYS  12  -8.103   2.993  12.816
  100    HZ1  LYS  12           3HZ      LYS  12  -5.720   3.168  12.897
  101    HZ2  LYS  12           1HZ      LYS  12  -5.597   3.020  11.208
  102    HZ3  LYS  12           2HZ      LYS  12  -6.135   1.708  12.137
  103    H    TRP  13           H        TRP  13  -8.895   0.388   7.607
  104    HA   TRP  13           HA       TRP  13 -10.591  -0.275   5.341
  105    HB2  TRP  13           1HB      TRP  13  -7.908  -0.989   6.231
  106    HB3  TRP  13           2HB      TRP  13  -8.837  -2.398   5.728
  107    HD1  TRP  13           HD1      TRP  13 -10.346  -1.496   3.258
  108    HE1  TRP  13           HE1      TRP  13  -9.148  -0.746   1.114
  109    HE3  TRP  13           HE3      TRP  13  -5.813  -0.253   5.260
  110    HZ2  TRP  13           HZ2      TRP  13  -6.611   0.239   0.365
  111    HZ3  TRP  13           HZ3      TRP  13  -4.052   0.584   3.763
  112    HH2  TRP  13           HH2      TRP  13  -4.442   0.826   1.365
  113    H    GLU  14           H        GLU  14 -10.706  -2.959   5.362
  114    HA   GLU  14           HA       GLU  14 -12.717  -3.606   7.220
  115    HB2  GLU  14           1HB      GLU  14 -12.514  -4.775   5.092
  116    HB3  GLU  14           2HB      GLU  14 -10.945  -5.412   5.564
  117    HG2  GLU  14           1HG      GLU  14 -11.921  -6.790   7.239
  118    HG3  GLU  14           2HG      GLU  14 -13.493  -6.016   7.039
  119    H    LYS  15           H        LYS  15  -9.370  -4.815   7.011
  120    HA   LYS  15           HA       LYS  15  -8.719  -4.293   9.667
  121    HB2  LYS  15           1HB      LYS  15 -10.412  -6.452   9.616
  122    HB3  LYS  15           2HB      LYS  15  -8.840  -7.233   9.549
  123    HG2  LYS  15           1HG      LYS  15  -9.858  -5.364  11.678
  124    HG3  LYS  15           2HG      LYS  15  -9.530  -7.089  11.831
  125    HD2  LYS  15           1HD      LYS  15  -7.484  -4.932  11.312
  126    HD3  LYS  15           2HD      LYS  15  -7.759  -5.746  12.850
  127    HE2  LYS  15           1HE      LYS  15  -6.867  -7.086  10.298
  128    HE3  LYS  15           2HE      LYS  15  -5.811  -6.638  11.635
  129    HZ1  LYS  15           3HZ      LYS  15  -7.030  -8.148  13.064
  130    HZ2  LYS  15           1HZ      LYS  15  -6.411  -8.968  11.713
  131    HZ3  LYS  15           2HZ      LYS  15  -8.060  -8.578  11.785
  132    HA   PRO  16           HA       PRO  16  -5.271  -6.962   8.004
  133    HB2  PRO  16           1HB      PRO  16  -5.607  -8.874   6.173
  134    HB3  PRO  16           2HB      PRO  16  -6.174  -9.073   7.833
  135    HG2  PRO  16           1HG      PRO  16  -7.717  -8.544   5.359
  136    HG3  PRO  16           2HG      PRO  16  -8.205  -9.405   6.828
  137    HD2  PRO  16           1HD      PRO  16  -8.789  -6.711   6.126
  138    HD3  PRO  16           2HD      PRO  16  -9.154  -7.530   7.656
  139    H    VAL  17           H        VAL  17  -3.777  -5.853   6.956
  140    HA   VAL  17           HA       VAL  17  -3.760  -6.006   4.038
  141    HB   VAL  17           HB       VAL  17  -2.914  -3.506   5.538
  142   HG11  VAL  17          1HG1      VAL  17  -1.515  -3.975   3.595
  143   HG12  VAL  17          2HG1      VAL  17  -2.528  -2.558   3.316
  144   HG13  VAL  17          3HG1      VAL  17  -2.952  -4.103   2.579
  145   HG21  VAL  17          3HG2      VAL  17  -5.347  -3.663   5.407
  146   HG22  VAL  17          1HG2      VAL  17  -5.243  -3.912   3.665
  147   HG23  VAL  17          2HG2      VAL  17  -4.738  -2.375   4.365
  148    H    THR  18           H        THR  18  -2.308  -7.690   4.175
  149    HA   THR  18           HA       THR  18  -0.076  -7.544   6.026
  150    HB   THR  18           HB       THR  18  -0.658  -9.751   4.054
  151    HG1  THR  18           HG1      THR  18  -2.543  -9.522   5.241
  152   HG21  THR  18          3HG2      THR  18   1.523  -9.833   5.178
  153   HG22  THR  18          1HG2      THR  18   0.475 -11.144   5.720
  154   HG23  THR  18          2HG2      THR  18   0.719  -9.730   6.745
  155    H    ILE  19           H        ILE  19   1.554  -6.263   5.371
  156    HA   ILE  19           HA       ILE  19   2.717  -6.813   2.712
  157    HB   ILE  19           HB       ILE  19   3.067  -4.386   4.491
  158   HG12  ILE  19          1HG1      ILE  19   0.906  -4.505   3.265
  159   HG13  ILE  19          2HG1      ILE  19   1.912  -3.150   2.763
  160   HG21  ILE  19          1HG2      ILE  19   4.402  -3.446   2.659
  161   HG22  ILE  19          2HG2      ILE  19   4.294  -4.985   1.805
  162   HG23  ILE  19          3HG2      ILE  19   5.144  -4.891   3.347
  163   HD11  ILE  19          3HD1      ILE  19   2.580  -4.354   0.781
  164   HD12  ILE  19          1HD1      ILE  19   0.825  -4.235   0.881
  165   HD13  ILE  19          2HD1      ILE  19   1.629  -5.752   1.287
  166    H    SER  20           H        SER  20   4.187  -8.413   3.017
  167    HA   SER  20           HA       SER  20   5.773  -8.560   5.420
  168    HB2  SER  20           1HB      SER  20   5.903 -10.190   2.873
  169    HB3  SER  20           2HB      SER  20   6.799 -10.542   4.349
  170    HG   SER  20           HG       SER  20   4.710 -11.669   3.996
  171    H    LEU  21           H        LEU  21   7.214  -6.956   5.620
  172    HA   LEU  21           HA       LEU  21   8.637  -5.817   3.429
  173    HB2  LEU  21           1HB      LEU  21   9.235  -5.651   6.383
  174    HB3  LEU  21           2HB      LEU  21   9.903  -4.612   5.138
  175    HG   LEU  21           HG       LEU  21   7.001  -4.744   5.963
  176   HD11  LEU  21          1HD1      LEU  21   9.073  -2.587   6.351
  177   HD12  LEU  21          2HD1      LEU  21   8.459  -3.663   7.608
  178   HD13  LEU  21          3HD1      LEU  21   7.378  -2.506   6.832
  179   HD21  LEU  21          3HD2      LEU  21   7.230  -4.271   3.588
  180   HD22  LEU  21          1HD2      LEU  21   8.388  -2.989   3.942
  181   HD23  LEU  21          2HD2      LEU  21   6.711  -2.832   4.466
  182    H    GLN  22           H        GLN  22  10.735  -6.107   2.776
  183    HA   GLN  22           HA       GLN  22  12.011  -8.574   3.086
  184    HB2  GLN  22           1HB      GLN  22  12.451  -7.118   1.192
  185    HB3  GLN  22           2HB      GLN  22  13.124  -5.888   2.251
  186    HG2  GLN  22           1HG      GLN  22  14.966  -7.393   2.821
  187    HG3  GLN  22           2HG      GLN  22  14.289  -8.617   1.747
  188   HE21  GLN  22          2HE2      GLN  22  16.874  -7.198   1.702
  189   HE22  GLN  22          1HE2      GLN  22  16.970  -6.476   0.132
  190    H    ASN  23           H        ASN  23  11.929  -5.835   5.108
  191    HA   ASN  23           HA       ASN  23  14.338  -6.171   6.548
  192    HB2  ASN  23           1HB      ASN  23  11.715  -4.967   7.472
  193    HB3  ASN  23           2HB      ASN  23  13.269  -4.769   8.271
  194   HD21  ASN  23          2HD2      ASN  23  11.503  -2.744   7.213
  195   HD22  ASN  23          1HD2      ASN  23  12.418  -1.863   6.037
  196    H    GLY  24           H        GLY  24  11.540  -8.060   6.392
  197    HA2  GLY  24           1HA      GLY  24  11.347 -10.175   7.408
  198    HA3  GLY  24           2HA      GLY  24  12.458  -9.651   8.666
  199    H    ALA  25           H        ALA  25   9.474  -8.155   7.465
  200    HA   ALA  25           HA       ALA  25   8.080  -8.770   9.920
  201    HB1  ALA  25           3HB      ALA  25   9.419  -6.833  10.584
  202    HB2  ALA  25           1HB      ALA  25   7.698  -6.451  10.568
  203    HB3  ALA  25           2HB      ALA  25   8.735  -5.903   9.251
  204    HA   PRO  26           HA       PRO  26   4.860  -8.308   6.757
  205    HB2  PRO  26           1HB      PRO  26   3.281 -10.009   8.483
  206    HB3  PRO  26           2HB      PRO  26   3.910 -10.361   6.873
  207    HG2  PRO  26           1HG      PRO  26   4.784 -11.607   9.146
  208    HG3  PRO  26           2HG      PRO  26   5.777 -11.401   7.693
  209    HD2  PRO  26           1HD      PRO  26   5.786  -9.817  10.235
  210    HD3  PRO  26           2HD      PRO  26   7.156 -10.357   9.238
  211    H    ARG  27           H        ARG  27   4.389  -6.177   7.241
  212    HA   ARG  27           HA       ARG  27   3.086  -5.515   9.739
  213    HB2  ARG  27           1HB      ARG  27   3.981  -3.898   7.367
  214    HB3  ARG  27           2HB      ARG  27   2.949  -3.200   8.609
  215    HG2  ARG  27           1HG      ARG  27   4.659  -3.831  10.298
  216    HG3  ARG  27           2HG      ARG  27   5.704  -4.342   8.972
  217    HD2  ARG  27           1HD      ARG  27   5.883  -2.142   8.134
  218    HD3  ARG  27           2HD      ARG  27   4.542  -1.573   9.131
  219    HE   ARG  27           HE       ARG  27   6.304  -2.399  10.983
  220   HH11  ARG  27          1HH1      ARG  27   6.643  -0.284   8.204
  221   HH12  ARG  27          2HH1      ARG  27   7.923   0.654   8.915
  222   HH21  ARG  27          1HH2      ARG  27   7.976  -1.153  11.918
  223   HH22  ARG  27          2HH2      ARG  27   8.691   0.148  11.010
  224    H    ILE  28           H        ILE  28   1.028  -5.778  10.041
  225    HA   ILE  28           HA       ILE  28  -0.788  -5.847   7.744
  226    HB   ILE  28           HB       ILE  28  -1.305  -6.572  10.636
  227   HG12  ILE  28          1HG1      ILE  28  -0.877  -8.349   8.223
  228   HG13  ILE  28          2HG1      ILE  28   0.299  -8.082   9.505
  229   HG21  ILE  28          1HG2      ILE  28  -3.371  -7.583   9.797
  230   HG22  ILE  28          2HG2      ILE  28  -3.002  -6.992   8.177
  231   HG23  ILE  28          3HG2      ILE  28  -3.328  -5.849   9.481
  232   HD11  ILE  28          3HD1      ILE  28  -2.401  -9.372   9.828
  233   HD12  ILE  28          1HD1      ILE  28  -1.224  -9.108  11.114
  234   HD13  ILE  28          2HD1      ILE  28  -0.847 -10.203   9.784
  235    H    PHE  29           H        PHE  29  -1.436  -3.865   7.190
  236    HA   PHE  29           HA       PHE  29  -1.886  -1.803   9.186
  237    HB2  PHE  29           1HB      PHE  29  -2.513  -1.649   6.231
  238    HB3  PHE  29           2HB      PHE  29  -2.228  -0.315   7.344
  239    HD1  PHE  29           HD2      PHE  29   0.067   0.189   8.114
  240    HD2  PHE  29           HD1      PHE  29  -0.722  -2.822   5.211
  241    HE1  PHE  29           HE2      PHE  29   2.445   0.185   7.466
  242    HE2  PHE  29           HE1      PHE  29   1.644  -2.831   4.572
  243    HZ   PHE  29           HZ       PHE  29   3.231  -1.333   5.685
  244    H    ASN  30           H        ASN  30  -3.917  -0.882   9.663
  245    HA   ASN  30           HA       ASN  30  -6.197  -2.556   8.831
  246    HB2  ASN  30           1HB      ASN  30  -7.234  -2.033  11.033
  247    HB3  ASN  30           2HB      ASN  30  -5.744  -2.956  11.171
  248   HD21  ASN  30          2HD2      ASN  30  -3.911  -1.974  12.021
  249   HD22  ASN  30          1HD2      ASN  30  -3.991  -0.497  12.914
  250    H    GLY  31           H        GLY  31  -4.845   0.449   8.596
  251    HA2  GLY  31           1HA      GLY  31  -7.453   1.577   7.838
  252    HA3  GLY  31           2HA      GLY  31  -6.329   2.516   8.812
  253    H    VAL  32           H        VAL  32  -7.326   3.332   6.316
  254    HA   VAL  32           HA       VAL  32  -5.514   2.654   4.217
  255    HB   VAL  32           HB       VAL  32  -7.436   4.982   4.373
  256   HG11  VAL  32          1HG1      VAL  32  -7.328   4.975   1.949
  257   HG12  VAL  32          2HG1      VAL  32  -6.174   3.643   1.986
  258   HG13  VAL  32          3HG1      VAL  32  -5.726   5.220   2.640
  259   HG21  VAL  32          3HG2      VAL  32  -8.975   3.542   3.100
  260   HG22  VAL  32          1HG2      VAL  32  -8.617   2.886   4.697
  261   HG23  VAL  32          2HG2      VAL  32  -7.840   2.202   3.269
  262    H    TYR  33           H        TYR  33  -5.680   5.179   6.634
  263    HA   TYR  33           HA       TYR  33  -3.881   6.980   5.383
  264    HB2  TYR  33           1HB      TYR  33  -5.427   7.674   7.179
  265    HB3  TYR  33           2HB      TYR  33  -4.523   6.690   8.326
  266    HD1  TYR  33           HD2      TYR  33  -4.316   9.656   6.126
  267    HD2  TYR  33           HD1      TYR  33  -2.539   7.505   9.340
  268    HE1  TYR  33           HE2      TYR  33  -2.812  11.551   6.552
  269    HE2  TYR  33           HE1      TYR  33  -1.030   9.396   9.777
  270    HH   TYR  33           HH       TYR  33  -1.496  12.455   8.513
  271    H    GLU  34           H        GLU  34  -3.463   4.264   7.584
  272    HA   GLU  34           HA       GLU  34  -0.753   4.684   8.206
  273    HB2  GLU  34           1HB      GLU  34  -2.317   2.108   8.032
  274    HB3  GLU  34           2HB      GLU  34  -0.698   2.239   8.704
  275    HG2  GLU  34           1HG      GLU  34  -1.600   2.671  10.670
  276    HG3  GLU  34           2HG      GLU  34  -2.241   4.176  10.015
  277    H    ALA  35           H        ALA  35  -2.323   2.977   5.547
  278    HA   ALA  35           HA       ALA  35   0.024   1.867   4.439
  279    HB1  ALA  35           3HB      ALA  35  -2.565   2.541   3.048
  280    HB2  ALA  35           1HB      ALA  35  -2.229   1.046   3.921
  281    HB3  ALA  35           2HB      ALA  35  -1.318   1.440   2.463
  282    H    PHE  36           H        PHE  36  -1.744   4.863   3.774
  283    HA   PHE  36           HA       PHE  36  -0.173   5.757   1.624
  284    HB2  PHE  36           1HB      PHE  36  -2.370   6.724   2.222
  285    HB3  PHE  36           2HB      PHE  36  -1.663   7.410   3.680
  286    HD1  PHE  36           HD2      PHE  36  -1.687   7.569   0.000
  287    HD2  PHE  36           HD1      PHE  36  -0.420   9.430   3.611
  288    HE1  PHE  36           HE2      PHE  36  -1.073   9.590  -1.260
  289    HE2  PHE  36           HE1      PHE  36   0.191  11.455   2.357
  290    HZ   PHE  36           HZ       PHE  36  -0.132  11.537  -0.082
  291    H    ASP  37           H        ASP  37   0.104   6.291   5.107
  292    HA   ASP  37           HA       ASP  37   2.312   8.065   4.962
  293    HB2  ASP  37           1HB      ASP  37   0.738   7.799   6.914
  294    HB3  ASP  37           2HB      ASP  37   1.549   6.283   7.283
  295    H    PHE  38           H        PHE  38   2.012   4.580   5.427
  296    HA   PHE  38           HA       PHE  38   4.680   3.937   5.915
  297    HB2  PHE  38           1HB      PHE  38   3.140   2.210   6.276
  298    HB3  PHE  38           2HB      PHE  38   2.383   2.424   4.703
  299    HD1  PHE  38           HD2      PHE  38   5.615   1.392   6.246
  300    HD2  PHE  38           HD1      PHE  38   2.914   0.983   2.980
  301    HE1  PHE  38           HE2      PHE  38   7.006  -0.413   5.322
  302    HE2  PHE  38           HE1      PHE  38   4.301  -0.820   2.055
  303    HZ   PHE  38           HZ       PHE  38   6.348  -1.521   3.224
  304    H    LEU  39           H        LEU  39   2.986   4.431   2.863
  305    HA   LEU  39           HA       LEU  39   4.923   3.352   1.156
  306    HB2  LEU  39           1HB      LEU  39   2.883   5.512   0.670
  307    HB3  LEU  39           2HB      LEU  39   3.853   4.783  -0.595
  308    HG   LEU  39           HG       LEU  39   1.903   3.299   1.168
  309   HD11  LEU  39          1HD1      LEU  39   0.550   3.118  -0.869
  310   HD12  LEU  39          2HD1      LEU  39   1.689   4.170  -1.710
  311   HD13  LEU  39          3HD1      LEU  39   0.749   4.792  -0.354
  312   HD21  LEU  39          3HD2      LEU  39   3.757   1.901   0.441
  313   HD22  LEU  39          1HD2      LEU  39   3.494   2.400  -1.231
  314   HD23  LEU  39          2HD2      LEU  39   2.269   1.449  -0.391
  315    H    GLN  40           H        GLN  40   4.790   6.452   2.746
  316    HA   GLN  40           HA       GLN  40   6.977   7.463   1.100
  317    HB2  GLN  40           1HB      GLN  40   5.454   8.747   3.377
  318    HB3  GLN  40           2HB      GLN  40   6.740   9.531   2.472
  319    HG2  GLN  40           1HG      GLN  40   5.407   9.353   0.430
  320    HG3  GLN  40           2HG      GLN  40   4.115   8.581   1.351
  321   HE21  GLN  40          2HE2      GLN  40   4.157  11.098  -0.182
  322   HE22  GLN  40          1HE2      GLN  40   3.666  12.323   0.940
  323    H    HIS  41           H        HIS  41   6.650   5.546   3.771
  324    HA   HIS  41           HA       HIS  41   9.017   6.621   5.115
  325    HB2  HIS  41           1HB      HIS  41   6.771   4.865   5.989
  326    HB3  HIS  41           2HB      HIS  41   8.323   4.715   6.804
  327    HD1  HIS  41           HD1      HIS  41   8.382   6.038   8.858
  328    HD2  HIS  41           HD2      HIS  41   6.071   7.870   5.927
  329    HE1  HIS  41           HE1      HIS  41   7.539   8.174   9.892
  330    HE2  HIS  41           HE2      HIS  41   5.985   9.158   8.165
  331    H    GLU  42           H        GLU  42   7.907   3.254   4.898
  332    HA   GLU  42           HA       GLU  42  10.720   2.577   4.342
  333    HB2  GLU  42           1HB      GLU  42   8.733   1.161   6.121
  334    HB3  GLU  42           2HB      GLU  42  10.347   0.567   5.750
  335    HG2  GLU  42           1HG      GLU  42  11.367   2.391   6.872
  336    HG3  GLU  42           2HG      GLU  42   9.825   3.229   7.037
  337    H    TRP  43           H        TRP  43   8.666   2.851   2.297
  338    HA   TRP  43           HA       TRP  43   7.924   0.258   1.409
  339    HB2  TRP  43           1HB      TRP  43   6.921   2.330   0.506
  340    HB3  TRP  43           2HB      TRP  43   8.465   2.755  -0.222
  341    HD1  TRP  43           HD1      TRP  43   8.812   1.983  -2.635
  342    HE1  TRP  43           HE1      TRP  43   7.632   0.354  -4.247
  343    HE3  TRP  43           HE3      TRP  43   5.472  -0.101   0.636
  344    HZ2  TRP  43           HZ2      TRP  43   5.561  -1.558  -4.131
  345    HZ3  TRP  43           HZ3      TRP  43   3.928  -1.823  -0.200
  346    HH2  TRP  43           HH2      TRP  43   3.972  -2.535  -2.536
  347    HA   PRO  44           HA       PRO  44  12.200  -0.808   0.811
  348    HB2  PRO  44           1HB      PRO  44  11.917  -3.456   0.789
  349    HB3  PRO  44           2HB      PRO  44  11.587  -2.516   2.250
  350    HG2  PRO  44           1HG      PRO  44   9.674  -3.693   0.281
  351    HG3  PRO  44           2HG      PRO  44   9.552  -3.599   2.047
  352    HD2  PRO  44           1HD      PRO  44   8.323  -1.866   0.248
  353    HD3  PRO  44           2HD      PRO  44   8.598  -1.537   1.969
  354    H    ALA  45           H        ALA  45  10.524  -0.184  -1.615
  355    HA   ALA  45           HA       ALA  45  12.291  -1.393  -3.536
  356    HB1  ALA  45           3HB      ALA  45   9.329  -1.948  -3.711
  357    HB2  ALA  45           1HB      ALA  45  10.581  -3.136  -3.350
  358    HB3  ALA  45           2HB      ALA  45  10.532  -2.359  -4.934
  359    H    ARG  46           H        ARG  46  11.269  -0.695  -5.855
  360    HA   ARG  46           HA       ARG  46  10.859   2.183  -5.653
  361    HB2  ARG  46           1HB      ARG  46  11.203   0.412  -8.083
  362    HB3  ARG  46           2HB      ARG  46  11.149   2.169  -8.097
  363    HG2  ARG  46           1HG      ARG  46  13.194   2.254  -6.775
  364    HG3  ARG  46           2HG      ARG  46  13.244   0.490  -6.736
  365    HD2  ARG  46           1HD      ARG  46  13.332   0.504  -9.225
  366    HD3  ARG  46           2HD      ARG  46  13.462   2.261  -9.163
  367    HE   ARG  46           HE       ARG  46  15.465   1.230  -7.531
  368   HH11  ARG  46          1HH1      ARG  46  14.596   1.269 -10.934
  369   HH12  ARG  46          2HH1      ARG  46  16.234   1.031 -11.474
  370   HH21  ARG  46          1HH2      ARG  46  17.604   0.908  -8.251
  371   HH22  ARG  46          2HH2      ARG  46  17.942   0.849  -9.955
  372    H    GLY  47           H        GLY  47   9.368   2.741  -7.845
  373    HA2  GLY  47           1HA      GLY  47   7.145   1.176  -8.406
  374    HA3  GLY  47           2HA      GLY  47   6.715   2.176  -7.024
  375    H    ASP  48           H        ASP  48   7.998   4.489  -7.554
  376    HA   ASP  48           HA       ASP  48   7.691   6.493  -8.552
  377    HB2  ASP  48           1HB      ASP  48   9.112   5.227 -10.257
  378    HB3  ASP  48           2HB      ASP  48   7.626   5.022 -11.180
  379    H    ARG  49           H        ARG  49   5.991   4.917 -11.179
  380    HA   ARG  49           HA       ARG  49   3.686   6.589 -10.629
  381    HB2  ARG  49           1HB      ARG  49   4.402   4.811 -12.957
  382    HB3  ARG  49           2HB      ARG  49   2.888   5.705 -12.845
  383    HG2  ARG  49           1HG      ARG  49   4.083   7.796 -12.764
  384    HG3  ARG  49           2HG      ARG  49   5.625   6.945 -12.756
  385    HD2  ARG  49           1HD      ARG  49   5.203   6.099 -14.983
  386    HD3  ARG  49           2HD      ARG  49   3.606   6.852 -14.990
  387    HE   ARG  49           HE       ARG  49   5.404   8.881 -14.467
  388   HH11  ARG  49          1HH1      ARG  49   4.918   6.579 -17.057
  389   HH12  ARG  49          2HH1      ARG  49   5.446   7.676 -18.300
  390   HH21  ARG  49          1HH2      ARG  49   6.108  10.317 -16.095
  391   HH22  ARG  49          2HH2      ARG  49   6.136   9.788 -17.752
  392    H    ALA  50           H        ALA  50   4.578   3.193 -10.582
  393    HA   ALA  50           HA       ALA  50   1.939   2.248  -9.995
  394    HB1  ALA  50           3HB      ALA  50   3.056   0.184  -9.282
  395    HB2  ALA  50           1HB      ALA  50   4.619   0.993  -9.386
  396    HB3  ALA  50           2HB      ALA  50   3.663   0.732 -10.845
  397    H    HIS  51           H        HIS  51   4.593   3.583  -8.222
  398    HA   HIS  51           HA       HIS  51   3.604   3.045  -5.604
  399    HB2  HIS  51           1HB      HIS  51   5.990   3.627  -6.174
  400    HB3  HIS  51           2HB      HIS  51   5.457   5.275  -6.477
  401    HD1  HIS  51           HD1      HIS  51   6.418   2.954  -3.784
  402    HD2  HIS  51           HD2      HIS  51   4.643   6.693  -4.128
  403    HE1  HIS  51           HE1      HIS  51   6.527   3.965  -1.490
  404    HE2  HIS  51           HE2      HIS  51   5.697   6.325  -1.797
  405    H    GLU  52           H        GLU  52   3.408   5.770  -7.853
  406    HA   GLU  52           HA       GLU  52   1.808   7.480  -6.317
  407    HB2  GLU  52           1HB      GLU  52   2.804   8.402  -8.234
  408    HB3  GLU  52           2HB      GLU  52   2.222   7.112  -9.271
  409    HG2  GLU  52           1HG      GLU  52   1.097   9.245  -9.683
  410    HG3  GLU  52           2HG      GLU  52  -0.016   7.979  -9.179
  411    H    GLN  53           H        GLN  53   0.945   4.847  -8.528
  412    HA   GLN  53           HA       GLN  53  -1.813   5.067  -8.485
  413    HB2  GLN  53           1HB      GLN  53  -0.559   3.456  -9.879
  414    HB3  GLN  53           2HB      GLN  53  -0.180   2.518  -8.442
  415    HG2  GLN  53           1HG      GLN  53  -2.563   2.073  -8.109
  416    HG3  GLN  53           2HG      GLN  53  -2.933   3.008  -9.556
  417   HE21  GLN  53          2HE2      GLN  53  -2.419   2.160 -11.577
  418   HE22  GLN  53          1HE2      GLN  53  -2.068   0.482 -11.811
  419    H    ALA  54           H        ALA  54   0.293   3.311  -6.225
  420    HA   ALA  54           HA       ALA  54  -1.747   2.426  -4.497
  421    HB1  ALA  54           3HB      ALA  54   1.156   2.945  -3.865
  422    HB2  ALA  54           1HB      ALA  54   0.498   1.451  -4.534
  423    HB3  ALA  54           2HB      ALA  54   0.041   1.967  -2.910
  424    H    LEU  55           H        LEU  55   0.327   5.312  -4.404
  425    HA   LEU  55           HA       LEU  55  -0.599   6.394  -1.988
  426    HB2  LEU  55           1HB      LEU  55   0.425   7.750  -4.482
  427    HB3  LEU  55           2HB      LEU  55   0.082   8.606  -2.994
  428    HG   LEU  55           HG       LEU  55   2.129   6.404  -3.262
  429   HD11  LEU  55          1HD1      LEU  55   2.480   9.397  -3.152
  430   HD12  LEU  55          2HD1      LEU  55   2.762   8.368  -4.556
  431   HD13  LEU  55          3HD1      LEU  55   3.777   8.204  -3.123
  432   HD21  LEU  55          3HD2      LEU  55   1.223   6.609  -1.010
  433   HD22  LEU  55          1HD2      LEU  55   1.539   8.345  -1.028
  434   HD23  LEU  55          2HD2      LEU  55   2.883   7.204  -1.071
  435    H    ARG  56           H        ARG  56  -1.770   6.718  -5.288
  436    HA   ARG  56           HA       ARG  56  -3.734   8.681  -4.768
  437    HB2  ARG  56           1HB      ARG  56  -2.743   8.059  -7.003
  438    HB3  ARG  56           2HB      ARG  56  -3.768   6.632  -6.980
  439    HG2  ARG  56           1HG      ARG  56  -5.751   8.002  -6.981
  440    HG3  ARG  56           2HG      ARG  56  -4.771   9.467  -6.866
  441    HD2  ARG  56           1HD      ARG  56  -4.856   7.504  -9.148
  442    HD3  ARG  56           2HD      ARG  56  -5.437   9.170  -9.152
  443    HE   ARG  56           HE       ARG  56  -2.720   9.197  -8.470
  444   HH11  ARG  56          1HH1      ARG  56  -4.746   8.439 -11.220
  445   HH12  ARG  56          2HH1      ARG  56  -3.527   8.834 -12.393
  446   HH21  ARG  56          1HH2      ARG  56  -1.119   9.716  -9.991
  447   HH22  ARG  56          2HH2      ARG  56  -1.452   9.579 -11.694
  448    H    LEU  57           H        LEU  57  -3.839   5.148  -4.877
  449    HA   LEU  57           HA       LEU  57  -6.572   4.741  -4.535
  450    HB2  LEU  57           1HB      LEU  57  -4.270   3.160  -3.384
  451    HB3  LEU  57           2HB      LEU  57  -5.931   2.602  -3.453
  452    HG   LEU  57           HG       LEU  57  -4.304   3.292  -5.894
  453   HD11  LEU  57          1HD1      LEU  57  -3.273   1.435  -4.708
  454   HD12  LEU  57          2HD1      LEU  57  -4.050   0.878  -6.190
  455   HD13  LEU  57          3HD1      LEU  57  -4.828   0.606  -4.631
  456   HD21  LEU  57          3HD2      LEU  57  -6.052   2.036  -7.063
  457   HD22  LEU  57          1HD2      LEU  57  -6.721   3.422  -6.203
  458   HD23  LEU  57          2HD2      LEU  57  -6.904   1.800  -5.537
  459    H    CYS  58           H        CYS  58  -4.048   5.016  -2.056
  460    HA   CYS  58           HA       CYS  58  -5.769   4.899   0.166
  461    HB2  CYS  58           1HB      CYS  58  -3.084   6.281  -0.008
  462    HB3  CYS  58           2HB      CYS  58  -3.863   5.671   1.449
  463    HG   CYS  58           HG       CYS  58  -2.355   3.906  -1.045
  464    H    ARG  59           H        ARG  59  -4.527   7.568  -1.742
  465    HA   ARG  59           HA       ARG  59  -5.403   9.693  -0.124
  466    HB2  ARG  59           1HB      ARG  59  -3.805   9.582  -2.206
  467    HB3  ARG  59           2HB      ARG  59  -5.276   9.904  -3.109
  468    HG2  ARG  59           1HG      ARG  59  -5.603  11.962  -1.803
  469    HG3  ARG  59           2HG      ARG  59  -4.087  11.641  -0.955
  470    HD2  ARG  59           1HD      ARG  59  -4.512  12.298  -3.853
  471    HD3  ARG  59           2HD      ARG  59  -3.514  13.144  -2.671
  472    HE   ARG  59           HE       ARG  59  -2.280  10.807  -2.738
  473   HH11  ARG  59          1HH1      ARG  59  -3.446  12.814  -5.356
  474   HH12  ARG  59          2HH1      ARG  59  -2.313  12.180  -6.520
  475   HH21  ARG  59          1HH2      ARG  59  -0.794   9.958  -4.271
  476   HH22  ARG  59          2HH2      ARG  59  -0.814  10.541  -5.905
  477    H    ALA  60           H        ALA  60  -6.878   8.185  -2.995
  478    HA   ALA  60           HA       ALA  60  -9.172   9.844  -3.009
  479    HB1  ALA  60           3HB      ALA  60  -8.799   7.125  -4.259
  480    HB2  ALA  60           1HB      ALA  60  -8.374   8.667  -5.002
  481    HB3  ALA  60           2HB      ALA  60 -10.062   8.289  -4.656
  482    H    SER  61           H        SER  61  -8.453   6.768  -1.460
  483    HA   SER  61           HA       SER  61 -11.107   6.169  -0.685
  484    HB2  SER  61           1HB      SER  61  -8.510   5.373   0.650
  485    HB3  SER  61           2HB      SER  61 -10.084   4.640   0.953
  486    HG   SER  61           HG       SER  61  -8.461   4.503  -1.348
  487    H    LEU  62           H        LEU  62  -8.479   7.958   0.900
  488    HA   LEU  62           HA       LEU  62  -9.941   8.596   3.244
  489    HB2  LEU  62           1HB      LEU  62  -7.548   9.857   1.922
  490    HB3  LEU  62           2HB      LEU  62  -8.238  10.495   3.402
  491    HG   LEU  62           HG       LEU  62  -7.175   7.684   3.097
  492   HD11  LEU  62          1HD1      LEU  62  -5.269   8.463   4.413
  493   HD12  LEU  62          2HD1      LEU  62  -5.907  10.107   4.369
  494   HD13  LEU  62          3HD1      LEU  62  -5.383   9.325   2.878
  495   HD21  LEU  62          3HD2      LEU  62  -8.892   7.907   4.815
  496   HD22  LEU  62          1HD2      LEU  62  -8.022   9.266   5.526
  497   HD23  LEU  62          2HD2      LEU  62  -7.307   7.655   5.545
  498    H    MET  63           H        MET  63  -9.844   9.949   0.045
  499    HA   MET  63           HA       MET  63 -11.286  12.338   0.740
  500    HB2  MET  63           1HB      MET  63 -10.693  11.029  -1.918
  501    HB3  MET  63           2HB      MET  63 -11.591  12.531  -1.762
  502    HG2  MET  63           1HG      MET  63  -9.659  13.587  -0.714
  503    HG3  MET  63           2HG      MET  63  -8.757  12.078  -0.848
  504    HE1  MET  63           3HE      MET  63 -10.177  14.551  -4.478
  505    HE2  MET  63           1HE      MET  63 -10.460  15.022  -2.803
  506    HE3  MET  63           2HE      MET  63 -11.266  13.601  -3.469
  507    H    GLY  64           H        GLY  64 -12.136   9.118   0.487
  508    HA2  GLY  64           1HA      GLY  64 -14.232   8.204   0.900
  509    HA3  GLY  64           2HA      GLY  64 -14.942   9.795   0.676
  510    H    ASP  65           H        ASP  65 -12.805   8.645  -1.775
  511    HA   ASP  65           HA       ASP  65 -15.077   8.475  -3.604
  512    HB2  ASP  65           1HB      ASP  65 -13.109   9.880  -4.204
  513    HB3  ASP  65           2HB      ASP  65 -12.120   8.423  -4.240
  514    H    VAL  66           H        VAL  66 -12.160   6.590  -2.823
  515    HA   VAL  66           HA       VAL  66 -13.230   4.263  -4.174
  516    HB   VAL  66           HB       VAL  66 -10.710   4.543  -2.524
  517   HG11  VAL  66          1HG1      VAL  66 -11.561   2.365  -4.429
  518   HG12  VAL  66          2HG1      VAL  66 -11.470   2.229  -2.673
  519   HG13  VAL  66          3HG1      VAL  66 -10.000   2.474  -3.617
  520   HG21  VAL  66          3HG2      VAL  66 -10.668   5.996  -4.471
  521   HG22  VAL  66          1HG2      VAL  66 -11.107   4.639  -5.510
  522   HG23  VAL  66          2HG2      VAL  66  -9.550   4.647  -4.680
  523    H    ALA  67           H        ALA  67 -14.181   2.542  -3.233
  524    HA   ALA  67           HA       ALA  67 -15.154   2.906  -0.543
  525    HB1  ALA  67           3HB      ALA  67 -16.641   2.190  -2.355
  526    HB2  ALA  67           1HB      ALA  67 -16.613   1.029  -1.029
  527    HB3  ALA  67           2HB      ALA  67 -15.720   0.694  -2.512
  528    H    GLY  68           H        GLY  68 -12.274   2.160  -0.990
  529    HA2  GLY  68           1HA      GLY  68 -10.833   1.145   0.515
  530    HA3  GLY  68           2HA      GLY  68 -12.202   0.312   1.226
  531    H    GLU  69           H        GLU  69 -13.212  -1.202  -0.741
  532    HA   GLU  69           HA       GLU  69 -11.510  -3.418  -0.755
  533    HB2  GLU  69           1HB      GLU  69 -13.793  -2.878  -2.658
  534    HB3  GLU  69           2HB      GLU  69 -13.110  -4.450  -2.267
  535    HG2  GLU  69           1HG      GLU  69 -13.926  -4.314  -0.023
  536    HG3  GLU  69           2HG      GLU  69 -14.459  -2.650  -0.271
  537    H    ILE  70           H        ILE  70 -12.379  -1.267  -3.450
  538    HA   ILE  70           HA       ILE  70 -10.796  -2.396  -5.430
  539    HB   ILE  70           HB       ILE  70 -11.413   0.548  -5.099
  540   HG12  ILE  70          1HG1      ILE  70 -12.988  -1.606  -6.532
  541   HG13  ILE  70          2HG1      ILE  70 -13.434  -0.881  -4.992
  542   HG21  ILE  70          1HG2      ILE  70 -11.191   0.640  -7.538
  543   HG22  ILE  70          2HG2      ILE  70 -10.745  -1.065  -7.560
  544   HG23  ILE  70          3HG2      ILE  70  -9.693   0.110  -6.771
  545   HD11  ILE  70          3HD1      ILE  70 -14.712   0.067  -6.826
  546   HD12  ILE  70          1HD1      ILE  70 -13.221   0.568  -7.621
  547   HD13  ILE  70          2HD1      ILE  70 -13.679   1.286  -6.077
  548    H    ALA  71           H        ALA  71  -9.947  -0.135  -2.882
  549    HA   ALA  71           HA       ALA  71  -7.416   0.611  -3.891
  550    HB1  ALA  71           3HB      ALA  71  -8.386   0.619  -1.037
  551    HB2  ALA  71           1HB      ALA  71  -8.613   1.922  -2.204
  552    HB3  ALA  71           2HB      ALA  71  -6.988   1.491  -1.667
  553    H    ARG  72           H        ARG  72  -8.518  -2.042  -1.843
  554    HA   ARG  72           HA       ARG  72  -5.962  -2.873  -0.949
  555    HB2  ARG  72           1HB      ARG  72  -8.457  -4.544  -1.310
  556    HB3  ARG  72           2HB      ARG  72  -7.025  -5.031  -0.419
  557    HG2  ARG  72           1HG      ARG  72  -7.442  -2.980   1.035
  558    HG3  ARG  72           2HG      ARG  72  -9.040  -2.933   0.284
  559    HD2  ARG  72           1HD      ARG  72  -9.272  -4.168   2.299
  560    HD3  ARG  72           2HD      ARG  72  -9.314  -5.340   0.980
  561    HE   ARG  72           HE       ARG  72  -7.015  -4.864   2.762
  562   HH11  ARG  72          1HH1      ARG  72  -8.826  -6.969   0.610
  563   HH12  ARG  72          2HH1      ARG  72  -7.764  -8.320   0.864
  564   HH21  ARG  72          1HH2      ARG  72  -5.666  -6.647   3.109
  565   HH22  ARG  72          2HH2      ARG  72  -5.961  -8.150   2.282
  566    H    THR  73           H        THR  73  -8.046  -4.107  -3.547
  567    HA   THR  73           HA       THR  73  -6.372  -6.131  -4.445
  568    HB   THR  73           HB       THR  73  -8.271  -4.489  -6.127
  569    HG1  THR  73           HG1      THR  73  -8.849  -6.907  -4.737
  570   HG21  THR  73          3HG2      THR  73  -7.273  -7.325  -6.433
  571   HG22  THR  73          1HG2      THR  73  -6.838  -5.957  -7.457
  572   HG23  THR  73          2HG2      THR  73  -8.497  -6.556  -7.443
  573    H    ALA  74           H        ALA  74  -6.575  -2.755  -5.558
  574    HA   ALA  74           HA       ALA  74  -4.589  -3.104  -7.578
  575    HB1  ALA  74           3HB      ALA  74  -5.645  -0.554  -6.360
  576    HB2  ALA  74           1HB      ALA  74  -6.323  -1.390  -7.757
  577    HB3  ALA  74           2HB      ALA  74  -4.708  -0.686  -7.848
  578    H    PHE  75           H        PHE  75  -4.530  -2.134  -4.210
  579    HA   PHE  75           HA       PHE  75  -1.905  -1.076  -4.156
  580    HB2  PHE  75           1HB      PHE  75  -3.584  -0.760  -2.345
  581    HB3  PHE  75           2HB      PHE  75  -3.409  -2.458  -1.920
  582    HD1  PHE  75           HD1      PHE  75  -1.542   0.734  -2.168
  583    HD2  PHE  75           HD2      PHE  75  -1.750  -3.145  -0.434
  584    HE1  PHE  75           HE1      PHE  75   0.298   1.323  -0.645
  585    HE2  PHE  75           HE2      PHE  75   0.089  -2.565   1.093
  586    HZ   PHE  75           HZ       PHE  75   1.116  -0.329   0.988
  587    H    VAL  76           H        VAL  76  -3.206  -4.318  -3.591
  588    HA   VAL  76           HA       VAL  76  -0.719  -5.557  -3.036
  589    HB   VAL  76           HB       VAL  76  -3.244  -6.808  -4.148
  590   HG11  VAL  76          1HG1      VAL  76  -0.915  -8.085  -2.715
  591   HG12  VAL  76          2HG1      VAL  76  -1.267  -8.230  -4.437
  592   HG13  VAL  76          3HG1      VAL  76  -2.384  -8.905  -3.250
  593   HG21  VAL  76          3HG2      VAL  76  -3.648  -5.648  -2.042
  594   HG22  VAL  76          1HG2      VAL  76  -2.305  -6.514  -1.295
  595   HG23  VAL  76          2HG2      VAL  76  -3.738  -7.395  -1.821
  596    H    ALA  77           H        ALA  77  -2.408  -4.755  -5.988
  597    HA   ALA  77           HA       ALA  77  -0.817  -6.323  -7.747
  598    HB1  ALA  77           3HB      ALA  77  -2.380  -3.807  -8.326
  599    HB2  ALA  77           1HB      ALA  77  -3.010  -5.453  -8.398
  600    HB3  ALA  77           2HB      ALA  77  -1.754  -4.937  -9.525
  601    H    ALA  78           H        ALA  78  -0.560  -3.042  -6.480
  602    HA   ALA  78           HA       ALA  78   1.742  -2.351  -8.028
  603    HB1  ALA  78           3HB      ALA  78   0.253  -0.642  -7.119
  604    HB2  ALA  78           1HB      ALA  78   1.906  -0.415  -6.548
  605    HB3  ALA  78           2HB      ALA  78   0.694  -1.122  -5.480
  606    H    SER  79           H        SER  79   1.192  -3.942  -4.986
  607    HA   SER  79           HA       SER  79   3.810  -3.629  -3.927
  608    HB2  SER  79           1HB      SER  79   1.674  -5.667  -3.269
  609    HB3  SER  79           2HB      SER  79   3.116  -5.355  -2.306
  610    HG   SER  79           HG       SER  79   1.040  -3.499  -2.882
  611    H    ARG  80           H        ARG  80   2.823  -5.351  -6.569
  612    HA   ARG  80           HA       ARG  80   4.246  -7.777  -6.283
  613    HB2  ARG  80           1HB      ARG  80   3.450  -6.241  -8.760
  614    HB3  ARG  80           2HB      ARG  80   4.155  -7.851  -8.787
  615    HG2  ARG  80           1HG      ARG  80   2.248  -8.683  -7.474
  616    HG3  ARG  80           2HG      ARG  80   1.534  -7.071  -7.530
  617    HD2  ARG  80           1HD      ARG  80   1.459  -7.192  -9.971
  618    HD3  ARG  80           2HD      ARG  80   2.180  -8.800  -9.915
  619    HE   ARG  80           HE       ARG  80  -0.224  -8.623  -8.366
  620   HH11  ARG  80          1HH1      ARG  80   1.055  -9.063 -11.595
  621   HH12  ARG  80          2HH1      ARG  80  -0.358  -9.888 -12.182
  622   HH21  ARG  80          1HH2      ARG  80  -2.089  -9.689  -9.132
  623   HH22  ARG  80          2HH2      ARG  80  -2.167 -10.228 -10.781
  624    H    GLN  81           H        GLN  81   5.190  -4.546  -7.240
  625    HA   GLN  81           HA       GLN  81   7.708  -5.251  -8.354
  626    HB2  GLN  81           1HB      GLN  81   6.744  -2.634  -7.188
  627    HB3  GLN  81           2HB      GLN  81   8.230  -2.839  -8.107
  628    HG2  GLN  81           1HG      GLN  81   6.948  -3.522 -10.058
  629    HG3  GLN  81           2HG      GLN  81   5.452  -3.367  -9.139
  630   HE21  GLN  81          2HE2      GLN  81   6.315  -2.009 -11.575
  631   HE22  GLN  81          1HE2      GLN  81   6.240  -0.316 -11.229
  632    H    ALA  82           H        ALA  82   6.580  -4.599  -5.118
  633    HA   ALA  82           HA       ALA  82   9.242  -4.560  -3.988
  634    HB1  ALA  82           3HB      ALA  82   7.458  -3.235  -2.965
  635    HB2  ALA  82           1HB      ALA  82   8.098  -4.427  -1.833
  636    HB3  ALA  82           2HB      ALA  82   6.551  -4.711  -2.630
  637    H    HIS  83           H        HIS  83   6.939  -6.867  -4.909
  638    HA   HIS  83           HA       HIS  83   6.824  -9.121  -4.819
  639    HB2  HIS  83           1HB      HIS  83   9.660  -8.800  -3.853
  640    HB3  HIS  83           2HB      HIS  83   8.901 -10.381  -4.012
  641    HD1  HIS  83           HD1      HIS  83   8.674 -11.354  -6.339
  642    HD2  HIS  83           HD2      HIS  83  10.101  -7.445  -6.323
  643    HE1  HIS  83           HE1      HIS  83   9.403 -10.885  -8.704
  644    HE2  HIS  83           HE2      HIS  83  10.092  -8.456  -8.706
  645    H    CYS  84           H        CYS  84   6.317  -7.270  -2.440
  646    HA   CYS  84           HA       CYS  84   6.467  -9.088  -0.188
  647    HB2  CYS  84           1HB      CYS  84   5.187  -6.357  -0.474
  648    HB3  CYS  84           2HB      CYS  84   5.362  -7.244   1.037
  649    HG   CYS  84           HG       CYS  84   8.044  -7.029   1.251
  650    H    LEU  85           H        LEU  85   4.986 -10.053  -2.401
  651    HA   LEU  85           HA       LEU  85   2.206  -9.524  -2.112
  652    HB2  LEU  85           1HB      LEU  85   3.690 -11.682  -3.587
  653    HB3  LEU  85           2HB      LEU  85   1.946 -11.510  -3.624
  654    HG   LEU  85           HG       LEU  85   3.955  -9.503  -4.619
  655   HD11  LEU  85          1HD1      LEU  85   2.991 -10.011  -6.806
  656   HD12  LEU  85          2HD1      LEU  85   1.944 -11.219  -6.060
  657   HD13  LEU  85          3HD1      LEU  85   3.693 -11.449  -6.063
  658   HD21  LEU  85          3HD2      LEU  85   2.031  -8.386  -3.636
  659   HD22  LEU  85          1HD2      LEU  85   0.945  -9.387  -4.602
  660   HD23  LEU  85          2HD2      LEU  85   2.017  -8.231  -5.392
  661    H    MET  86           H        MET  86   0.990 -10.177  -0.584
  662    HA   MET  86           HA       MET  86   1.233 -12.922   0.417
  663    HB2  MET  86           1HB      MET  86   1.015 -10.415   2.081
  664    HB3  MET  86           2HB      MET  86   0.588 -12.001   2.702
  665    HG2  MET  86           1HG      MET  86   3.293 -11.277   1.610
  666    HG3  MET  86           2HG      MET  86   2.861 -11.245   3.319
  667    HE1  MET  86           3HE      MET  86   2.094 -13.442   4.677
  668    HE2  MET  86           1HE      MET  86   2.026 -15.049   3.951
  669    HE3  MET  86           2HE      MET  86   0.898 -13.799   3.431
  670    H    GLU  87           H        GLU  87  -0.688 -13.952   0.604
  671    HA   GLU  87           HA       GLU  87  -3.127 -12.387   0.237
  672    HB2  GLU  87           1HB      GLU  87  -2.717 -15.390   0.322
  673    HB3  GLU  87           2HB      GLU  87  -4.253 -14.586   0.023
  674    HG2  GLU  87           1HG      GLU  87  -3.192 -13.505  -1.973
  675    HG3  GLU  87           2HG      GLU  87  -1.799 -14.551  -1.712
  676    H    ASP  88           H        ASP  88  -4.538 -12.032   1.875
  677    HA   ASP  88           HA       ASP  88  -3.432 -12.080   4.463
  678    HB2  ASP  88           1HB      ASP  88  -6.267 -11.474   3.618
  679    HB3  ASP  88           2HB      ASP  88  -5.573 -11.107   5.195
  680    H    LYS  89           H        LYS  89  -4.929 -12.727   6.365
  681    HA   LYS  89           HA       LYS  89  -4.925 -15.620   6.218
  682    HB2  LYS  89           1HB      LYS  89  -3.803 -14.192   8.020
  683    HB3  LYS  89           2HB      LYS  89  -5.417 -13.926   8.661
  684    HG2  LYS  89           1HG      LYS  89  -5.690 -16.337   8.967
  685    HG3  LYS  89           2HG      LYS  89  -4.062 -16.594   8.334
  686    HD2  LYS  89           1HD      LYS  89  -3.165 -15.215  10.176
  687    HD3  LYS  89           2HD      LYS  89  -4.799 -15.057  10.825
  688    HE2  LYS  89           1HE      LYS  89  -3.599 -16.804  11.999
  689    HE3  LYS  89           2HE      LYS  89  -4.924 -17.494  11.065
  690    HZ1  LYS  89           3HZ      LYS  89  -2.050 -17.495  10.314
  691    HZ2  LYS  89           1HZ      LYS  89  -3.305 -18.079   9.329
  692    HZ3  LYS  89           2HZ      LYS  89  -2.965 -18.831  10.809
  693    H    ALA  90           H        ALA  90  -7.186 -13.800   5.170
  694    HA   ALA  90           HA       ALA  90  -9.459 -14.502   6.782
  695    HB1  ALA  90           3HB      ALA  90  -9.517 -12.496   5.406
  696    HB2  ALA  90           1HB      ALA  90 -10.786 -13.616   4.908
  697    HB3  ALA  90           2HB      ALA  90  -9.314 -13.467   3.948
  698    H    GLU  91           H        GLU  91  -7.801 -15.776   3.994
  699    HA   GLU  91           HA       GLU  91  -9.340 -18.268   4.264
  700    HB2  GLU  91           1HB      GLU  91  -8.413 -16.973   1.686
  701    HB3  GLU  91           2HB      GLU  91  -9.096 -18.587   1.801
  702    HG2  GLU  91           1HG      GLU  91 -11.176 -17.580   2.708
  703    HG3  GLU  91           2HG      GLU  91 -10.483 -15.989   2.392
  704    H    ALA  92           H        ALA  92  -7.730 -19.613   2.266
  705    HA   ALA  92           HA       ALA  92  -5.762 -20.656   1.906
  706    HB1  ALA  92           3HB      ALA  92  -3.653 -19.628   2.502
  707    HB2  ALA  92           1HB      ALA  92  -4.481 -18.474   3.546
  708    HB3  ALA  92           2HB      ALA  92  -4.739 -18.428   1.801
  709    HA   PRO  93           HA       PRO  93  -6.076 -22.860   5.855
  710    HB2  PRO  93           1HB      PRO  93  -6.302 -25.319   4.763
  711    HB3  PRO  93           2HB      PRO  93  -7.675 -24.215   4.905
  712    HG2  PRO  93           1HG      PRO  93  -6.002 -24.865   2.524
  713    HG3  PRO  93           2HG      PRO  93  -7.746 -24.569   2.626
  714    HD2  PRO  93           1HD      PRO  93  -5.887 -22.715   1.781
  715    HD3  PRO  93           2HD      PRO  93  -7.488 -22.315   2.435
  716    H    ASN  94           H        ASN  94  -4.093 -23.649   3.030
  717    HA   ASN  94           HA       ASN  94  -1.883 -24.314   4.847
  718    HB2  ASN  94           1HB      ASN  94  -2.543 -25.846   2.314
  719    HB3  ASN  94           2HB      ASN  94  -1.162 -26.133   3.362
  720   HD21  ASN  94          2HD2      ASN  94  -4.512 -26.667   2.835
  721   HD22  ASN  94          1HD2      ASN  94  -4.782 -27.710   4.195
  722    H    THR  95           H        THR  95   0.201 -23.822   4.022
  723    HA   THR  95           HA       THR  95   0.313 -21.622   2.221
  724    HB   THR  95           HB       THR  95   2.642 -23.364   3.043
  725    HG1  THR  95           HG1      THR  95   1.682 -22.793   4.955
  726   HG21  THR  95          3HG2      THR  95   3.130 -21.690   1.326
  727   HG22  THR  95          1HG2      THR  95   3.915 -21.273   2.847
  728   HG23  THR  95          2HG2      THR  95   2.449 -20.428   2.351
  729    H    ILE  96           H        ILE  96   0.312 -25.008   1.834
  730    HA   ILE  96           HA       ILE  96   1.567 -25.241  -0.693
  731    HB   ILE  96           HB       ILE  96  -0.650 -26.987   0.402
  732   HG12  ILE  96          1HG1      ILE  96   2.336 -27.230   0.850
  733   HG13  ILE  96          2HG1      ILE  96   1.171 -26.701   2.059
  734   HG21  ILE  96          1HG2      ILE  96   1.586 -27.567  -1.537
  735   HG22  ILE  96          2HG2      ILE  96  -0.120 -27.377  -1.942
  736   HG23  ILE  96          3HG2      ILE  96   0.405 -28.738  -0.950
  737   HD11  ILE  96          3HD1      ILE  96   0.093 -28.890   1.971
  738   HD12  ILE  96          1HD1      ILE  96   1.800 -29.018   2.394
  739   HD13  ILE  96          2HD1      ILE  96   1.265 -29.416   0.762
  740    H    ALA  97           H        ALA  97  -1.491 -24.085   0.363
  741    HA   ALA  97           HA       ALA  97  -2.579 -24.143  -2.364
  742    HB1  ALA  97           3HB      ALA  97  -3.982 -23.642   0.261
  743    HB2  ALA  97           1HB      ALA  97  -3.998 -25.154  -0.645
  744    HB3  ALA  97           2HB      ALA  97  -4.752 -23.712  -1.324
  745    H    SER  98           H        SER  98  -3.999 -22.166  -2.830
  746    HA   SER  98           HA       SER  98  -3.139 -19.697  -1.571
  747    HB2  SER  98           1HB      SER  98  -2.735 -20.138  -4.546
  748    HB3  SER  98           2HB      SER  98  -2.395 -18.655  -3.655
  749    HG   SER  98           HG       SER  98  -1.058 -20.452  -2.373
  750    H    GLY  99           H        GLY  99  -4.300 -17.789  -2.835
  751    HA2  GLY  99           1HA      GLY  99  -7.090 -18.303  -2.743
  752    HA3  GLY  99           2HA      GLY  99  -6.331 -16.838  -3.345
  753    H    SER 100           H        SER 100  -4.767 -18.396  -5.320
  754    HA   SER 100           HA       SER 100  -6.863 -18.654  -7.328
  755    HB2  SER 100           1HB      SER 100  -4.801 -17.264  -7.754
  756    HB3  SER 100           2HB      SER 100  -3.858 -18.752  -7.713
  757    HG   SER 100           HG       SER 100  -4.688 -19.371  -9.592
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1  -1.728  37.028   6.409
    2    H2   MET   1           2H       MET   1  -2.100  36.575   4.820
    3    H3   MET   1           3H       MET   1  -0.660  37.410   5.149
    4    HA   MET   1           HA       MET   1  -0.185  35.103   4.778
    5    HB2  MET   1           1HB      MET   1  -0.003  35.779   7.727
    6    HB3  MET   1           2HB      MET   1   0.999  34.625   6.859
    7    HG2  MET   1           1HG      MET   1   2.083  36.339   5.643
    8    HG3  MET   1           2HG      MET   1   0.926  37.551   6.190
    9    HE1  MET   1           3HE      MET   1   2.711  39.254   7.003
   10    HE2  MET   1           1HE      MET   1   3.965  38.194   6.356
   11    HE3  MET   1           2HE      MET   1   4.105  38.826   7.996
   12    H    GLU   2           H        GLU   2  -1.970  33.839   4.245
   13    HA   GLU   2           HA       GLU   2  -3.534  32.793   6.515
   14    HB2  GLU   2           1HB      GLU   2  -4.356  32.795   3.607
   15    HB3  GLU   2           2HB      GLU   2  -5.350  32.365   4.988
   16    HG2  GLU   2           1HG      GLU   2  -6.096  34.476   4.426
   17    HG3  GLU   2           2HG      GLU   2  -4.975  34.790   5.750
   18    H    VAL   3           H        VAL   3  -3.081  30.770   7.066
   19    HA   VAL   3           HA       VAL   3  -2.126  28.949   4.958
   20    HB   VAL   3           HB       VAL   3  -0.429  29.159   6.633
   21   HG11  VAL   3          1HG1      VAL   3  -0.783  28.661   8.996
   22   HG12  VAL   3          2HG1      VAL   3  -2.507  28.447   8.698
   23   HG13  VAL   3          3HG1      VAL   3  -1.765  30.029   8.472
   24   HG21  VAL   3          3HG2      VAL   3  -1.922  26.570   7.026
   25   HG22  VAL   3          1HG2      VAL   3  -0.228  26.851   7.430
   26   HG23  VAL   3          2HG2      VAL   3  -0.757  26.922   5.748
   27    H    GLN   4           H        GLN   4  -3.891  27.981   4.183
   28    HA   GLN   4           HA       GLN   4  -6.034  27.126   5.934
   29    HB2  GLN   4           1HB      GLN   4  -6.547  27.979   3.687
   30    HB3  GLN   4           2HB      GLN   4  -5.610  26.677   2.970
   31    HG2  GLN   4           1HG      GLN   4  -7.178  25.042   3.899
   32    HG3  GLN   4           2HG      GLN   4  -8.122  26.355   4.601
   33   HE21  GLN   4          2HE2      GLN   4  -8.875  24.312   2.652
   34   HE22  GLN   4          1HE2      GLN   4  -9.452  25.168   1.265
   35    H    SER   5           H        SER   5  -5.714  25.388   7.149
   36    HA   SER   5           HA       SER   5  -3.979  23.260   6.182
   37    HB2  SER   5           1HB      SER   5  -4.278  22.357   8.515
   38    HB3  SER   5           2HB      SER   5  -3.548  23.959   8.440
   39    HG   SER   5           HG       SER   5  -5.497  24.864   9.053
   40    H    MET   6           H        MET   6  -4.897  21.783   4.922
   41    HA   MET   6           HA       MET   6  -7.682  21.152   5.025
   42    HB2  MET   6           1HB      MET   6  -5.385  19.713   3.674
   43    HB3  MET   6           2HB      MET   6  -7.084  19.328   3.437
   44    HG2  MET   6           1HG      MET   6  -5.759  21.944   2.756
   45    HG3  MET   6           2HG      MET   6  -6.194  20.677   1.614
   46    HE1  MET   6           3HE      MET   6 -10.109  20.718   1.814
   47    HE2  MET   6           1HE      MET   6  -8.986  19.694   2.709
   48    HE3  MET   6           2HE      MET   6  -8.707  20.026   0.999
   49    H    LEU   7           H        LEU   7  -8.590  20.040   6.605
   50    HA   LEU   7           HA       LEU   7  -7.123  18.569   8.517
   51    HB2  LEU   7           1HB      LEU   7 -10.088  18.560   7.954
   52    HB3  LEU   7           2HB      LEU   7  -9.328  17.896   9.389
   53    HG   LEU   7           HG       LEU   7  -9.386  20.803   8.576
   54   HD11  LEU   7          1HD1      LEU   7 -11.502  19.980   9.449
   55   HD12  LEU   7          2HD1      LEU   7 -10.731  21.085  10.586
   56   HD13  LEU   7          3HD1      LEU   7 -10.678  19.346  10.873
   57   HD21  LEU   7          3HD2      LEU   7  -8.134  19.499  10.988
   58   HD22  LEU   7          1HD2      LEU   7  -8.289  21.235  10.718
   59   HD23  LEU   7          2HD2      LEU   7  -7.273  20.263   9.653
   60    H    LEU   8           H        LEU   8  -6.799  16.422   8.791
   61    HA   LEU   8           HA       LEU   8  -6.989  14.816   6.391
   62    HB2  LEU   8           1HB      LEU   8  -5.828  14.191   9.108
   63    HB3  LEU   8           2HB      LEU   8  -5.700  13.158   7.699
   64    HG   LEU   8           HG       LEU   8  -4.524  15.929   7.942
   65   HD11  LEU   8          1HD1      LEU   8  -3.207  13.217   7.982
   66   HD12  LEU   8          2HD1      LEU   8  -3.379  14.307   9.358
   67   HD13  LEU   8          3HD1      LEU   8  -2.373  14.771   7.985
   68   HD21  LEU   8          3HD2      LEU   8  -4.301  13.860   5.761
   69   HD22  LEU   8          1HD2      LEU   8  -3.388  15.365   5.842
   70   HD23  LEU   8          2HD2      LEU   8  -5.141  15.407   5.655
   71    H    ASN   9           H        ASN   9  -8.096  12.890   6.178
   72    HA   ASN   9           HA       ASN   9 -10.225  12.440   8.160
   73    HB2  ASN   9           1HB      ASN   9 -10.925  13.055   5.820
   74    HB3  ASN   9           2HB      ASN   9 -10.178  11.564   5.257
   75   HD21  ASN   9          2HD2      ASN   9 -12.108  10.747   4.494
   76   HD22  ASN   9          1HD2      ASN   9 -13.359  10.185   5.554
   77    H    ASP  10           H        ASP  10 -10.892  10.091   8.356
   78    HA   ASP  10           HA       ASP  10  -8.571   8.310   8.029
   79    HB2  ASP  10           1HB      ASP  10  -8.552   8.950  10.351
   80    HB3  ASP  10           2HB      ASP  10 -10.279   8.633  10.503
   81    H    VAL  11           H        VAL  11  -9.003   6.356   7.257
   82    HA   VAL  11           HA       VAL  11 -11.679   5.248   7.514
   83    HB   VAL  11           HB       VAL  11 -11.768   6.345   5.342
   84   HG11  VAL  11          1HG1      VAL  11 -10.286   5.674   3.501
   85   HG12  VAL  11          2HG1      VAL  11  -9.339   4.705   4.632
   86   HG13  VAL  11          3HG1      VAL  11  -9.408   6.458   4.816
   87   HG21  VAL  11          3HG2      VAL  11 -12.333   4.417   3.936
   88   HG22  VAL  11          1HG2      VAL  11 -12.955   4.237   5.576
   89   HG23  VAL  11          2HG2      VAL  11 -11.513   3.351   5.076
   90    H    LYS  12           H        LYS  12 -11.649   3.105   7.910
   91    HA   LYS  12           HA       LYS  12  -8.995   1.872   8.034
   92    HB2  LYS  12           1HB      LYS  12 -11.569   0.937   9.306
   93    HB3  LYS  12           2HB      LYS  12  -9.963   0.285   9.595
   94    HG2  LYS  12           1HG      LYS  12 -10.986   3.007  10.362
   95    HG3  LYS  12           2HG      LYS  12 -10.576   1.674  11.439
   96    HD2  LYS  12           1HD      LYS  12  -8.223   1.835  10.620
   97    HD3  LYS  12           2HD      LYS  12  -8.689   3.280   9.720
   98    HE2  LYS  12           1HE      LYS  12  -9.508   4.218  11.923
   99    HE3  LYS  12           2HE      LYS  12  -8.683   2.868  12.698
  100    HZ1  LYS  12           3HZ      LYS  12  -7.265   4.775  12.705
  101    HZ2  LYS  12           1HZ      LYS  12  -7.442   4.990  11.033
  102    HZ3  LYS  12           2HZ      LYS  12  -6.612   3.632  11.632
  103    H    TRP  13           H        TRP  13  -8.970  -0.544   7.662
  104    HA   TRP  13           HA       TRP  13 -10.372  -1.070   5.143
  105    HB2  TRP  13           1HB      TRP  13  -7.705  -1.663   6.130
  106    HB3  TRP  13           2HB      TRP  13  -8.509  -3.103   5.502
  107    HD1  TRP  13           HD1      TRP  13 -10.068  -1.953   3.083
  108    HE1  TRP  13           HE1      TRP  13  -8.841  -1.043   1.022
  109    HE3  TRP  13           HE3      TRP  13  -5.523  -1.003   5.221
  110    HZ2  TRP  13           HZ2      TRP  13  -6.265  -0.056   0.384
  111    HZ3  TRP  13           HZ3      TRP  13  -3.730  -0.080   3.813
  112    HH2  TRP  13           HH2      TRP  13  -4.095   0.383   1.445
  113    H    GLU  14           H        GLU  14 -11.671  -2.761   4.852
  114    HA   GLU  14           HA       GLU  14 -12.796  -3.996   7.183
  115    HB2  GLU  14           1HB      GLU  14 -13.325  -4.603   4.268
  116    HB3  GLU  14           2HB      GLU  14 -14.341  -5.061   5.629
  117    HG2  GLU  14           1HG      GLU  14 -13.781  -2.265   4.668
  118    HG3  GLU  14           2HG      GLU  14 -15.288  -3.163   4.483
  119    H    LYS  15           H        LYS  15 -10.632  -4.934   4.619
  120    HA   LYS  15           HA       LYS  15 -10.041  -7.402   6.096
  121    HB2  LYS  15           1HB      LYS  15 -10.076  -6.991   3.099
  122    HB3  LYS  15           2HB      LYS  15  -9.374  -8.400   3.883
  123    HG2  LYS  15           1HG      LYS  15 -11.508  -9.058   4.749
  124    HG3  LYS  15           2HG      LYS  15 -12.250  -7.564   4.177
  125    HD2  LYS  15           1HD      LYS  15 -12.823  -9.356   2.679
  126    HD3  LYS  15           2HD      LYS  15 -11.730  -8.245   1.855
  127    HE2  LYS  15           1HE      LYS  15 -11.114 -10.524   1.356
  128    HE3  LYS  15           2HE      LYS  15  -9.857  -9.770   2.335
  129    HZ1  LYS  15           3HZ      LYS  15 -11.979 -11.359   3.627
  130    HZ2  LYS  15           1HZ      LYS  15 -10.400 -11.042   4.166
  131    HZ3  LYS  15           2HZ      LYS  15 -10.658 -12.137   2.900
  132    HA   PRO  16           HA       PRO  16  -6.379  -4.888   6.755
  133    HB2  PRO  16           1HB      PRO  16  -5.477  -7.558   7.742
  134    HB3  PRO  16           2HB      PRO  16  -5.326  -5.968   8.500
  135    HG2  PRO  16           1HG      PRO  16  -7.167  -7.680   9.340
  136    HG3  PRO  16           2HG      PRO  16  -7.539  -5.951   9.205
  137    HD2  PRO  16           1HD      PRO  16  -8.354  -8.211   7.440
  138    HD3  PRO  16           2HD      PRO  16  -9.245  -6.739   7.878
  139    H    VAL  17           H        VAL  17  -4.546  -4.546   5.646
  140    HA   VAL  17           HA       VAL  17  -3.872  -6.509   3.563
  141    HB   VAL  17           HB       VAL  17  -3.188  -3.565   3.663
  142   HG11  VAL  17          1HG1      VAL  17  -2.868  -5.596   1.452
  143   HG12  VAL  17          2HG1      VAL  17  -1.566  -4.870   2.397
  144   HG13  VAL  17          3HG1      VAL  17  -2.537  -3.867   1.317
  145   HG21  VAL  17          3HG2      VAL  17  -5.585  -3.908   3.394
  146   HG22  VAL  17          1HG2      VAL  17  -5.290  -5.012   2.052
  147   HG23  VAL  17          2HG2      VAL  17  -4.869  -3.307   1.899
  148    H    THR  18           H        THR  18  -2.137  -7.685   3.918
  149    HA   THR  18           HA       THR  18  -0.126  -6.800   5.840
  150    HB   THR  18           HB       THR  18  -0.218  -9.469   4.435
  151    HG1  THR  18           HG1      THR  18  -1.999  -9.866   5.501
  152   HG21  THR  18          3HG2      THR  18   0.895 -10.232   6.500
  153   HG22  THR  18          1HG2      THR  18   0.874  -8.576   7.107
  154   HG23  THR  18          2HG2      THR  18   1.820  -8.978   5.674
  155    H    ILE  19           H        ILE  19   1.505  -5.600   4.987
  156    HA   ILE  19           HA       ILE  19   2.448  -6.251   2.296
  157    HB   ILE  19           HB       ILE  19   2.095  -3.855   2.867
  158   HG12  ILE  19          1HG1      ILE  19   4.987  -4.535   2.309
  159   HG13  ILE  19          2HG1      ILE  19   3.698  -4.535   1.108
  160   HG21  ILE  19          1HG2      ILE  19   4.371  -4.285   4.790
  161   HG22  ILE  19          2HG2      ILE  19   2.723  -3.790   5.180
  162   HG23  ILE  19          3HG2      ILE  19   3.780  -2.705   4.273
  163   HD11  ILE  19          3HD1      ILE  19   5.023  -2.507   0.991
  164   HD12  ILE  19          1HD1      ILE  19   4.648  -2.153   2.677
  165   HD13  ILE  19          2HD1      ILE  19   3.364  -2.150   1.469
  166    H    SER  20           H        SER  20   4.173  -7.495   1.974
  167    HA   SER  20           HA       SER  20   5.621  -8.394   4.335
  168    HB2  SER  20           1HB      SER  20   4.580  -9.952   2.537
  169    HB3  SER  20           2HB      SER  20   5.988  -9.525   1.569
  170    HG   SER  20           HG       SER  20   7.273 -10.585   2.926
  171    H    LEU  21           H        LEU  21   7.165  -6.958   4.810
  172    HA   LEU  21           HA       LEU  21   8.764  -5.694   2.787
  173    HB2  LEU  21           1HB      LEU  21   9.135  -5.766   5.787
  174    HB3  LEU  21           2HB      LEU  21   9.951  -4.686   4.670
  175    HG   LEU  21           HG       LEU  21   6.979  -4.722   5.212
  176   HD11  LEU  21          1HD1      LEU  21   7.382  -2.528   6.249
  177   HD12  LEU  21          2HD1      LEU  21   9.118  -2.767   6.040
  178   HD13  LEU  21          3HD1      LEU  21   8.205  -3.837   7.102
  179   HD21  LEU  21          3HD2      LEU  21   7.513  -4.079   2.914
  180   HD22  LEU  21          1HD2      LEU  21   8.638  -2.863   3.516
  181   HD23  LEU  21          2HD2      LEU  21   6.912  -2.704   3.843
  182    H    GLN  22           H        GLN  22  10.942  -6.051   2.369
  183    HA   GLN  22           HA       GLN  22  11.607  -8.742   2.082
  184    HB2  GLN  22           1HB      GLN  22  12.431  -6.963   0.606
  185    HB3  GLN  22           2HB      GLN  22  13.434  -6.341   1.910
  186    HG2  GLN  22           1HG      GLN  22  14.670  -8.468   1.942
  187    HG3  GLN  22           2HG      GLN  22  13.694  -9.033   0.590
  188   HE21  GLN  22          2HE2      GLN  22  16.568  -8.643   0.818
  189   HE22  GLN  22          1HE2      GLN  22  17.003  -7.538  -0.446
  190    H    ASN  23           H        ASN  23  12.334  -6.535   4.667
  191    HA   ASN  23           HA       ASN  23  14.504  -8.065   5.739
  192    HB2  ASN  23           1HB      ASN  23  12.809  -5.934   7.059
  193    HB3  ASN  23           2HB      ASN  23  14.305  -6.594   7.709
  194   HD21  ASN  23          2HD2      ASN  23  16.274  -6.141   6.620
  195   HD22  ASN  23          1HD2      ASN  23  16.414  -4.750   5.590
  196    H    GLY  24           H        GLY  24  11.313  -8.749   5.515
  197    HA2  GLY  24           1HA      GLY  24  10.338 -10.711   6.347
  198    HA3  GLY  24           2HA      GLY  24  11.539 -10.743   7.630
  199    H    ALA  25           H        ALA  25   9.542  -7.988   6.752
  200    HA   ALA  25           HA       ALA  25   8.233  -8.222   9.376
  201    HB1  ALA  25           3HB      ALA  25   8.211  -5.805   9.530
  202    HB2  ALA  25           1HB      ALA  25   8.964  -5.671   7.941
  203    HB3  ALA  25           2HB      ALA  25   9.862  -6.373   9.286
  204    HA   PRO  26           HA       PRO  26   4.656  -8.151   6.567
  205    HB2  PRO  26           1HB      PRO  26   3.279  -9.599   8.655
  206    HB3  PRO  26           2HB      PRO  26   3.727 -10.163   7.044
  207    HG2  PRO  26           1HG      PRO  26   4.844 -11.121   9.350
  208    HG3  PRO  26           2HG      PRO  26   5.669 -11.123   7.782
  209    HD2  PRO  26           1HD      PRO  26   5.963  -9.218  10.077
  210    HD3  PRO  26           2HD      PRO  26   7.213  -9.914   9.021
  211    H    ARG  27           H        ARG  27   4.210  -5.975   6.823
  212    HA   ARG  27           HA       ARG  27   3.205  -5.034   9.389
  213    HB2  ARG  27           1HB      ARG  27   4.820  -3.746   7.808
  214    HB3  ARG  27           2HB      ARG  27   3.366  -3.362   6.899
  215    HG2  ARG  27           1HG      ARG  27   2.398  -2.345   8.921
  216    HG3  ARG  27           2HG      ARG  27   3.903  -2.678   9.781
  217    HD2  ARG  27           1HD      ARG  27   5.031  -1.369   7.872
  218    HD3  ARG  27           2HD      ARG  27   3.409  -0.783   7.508
  219    HE   ARG  27           HE       ARG  27   4.792  -0.353  10.088
  220   HH11  ARG  27          1HH1      ARG  27   2.494   0.667   7.650
  221   HH12  ARG  27          2HH1      ARG  27   2.275   2.242   8.335
  222   HH21  ARG  27          1HH2      ARG  27   4.520   1.741  10.969
  223   HH22  ARG  27          2HH2      ARG  27   3.417   2.850  10.212
  224    H    ILE  28           H        ILE  28   1.143  -5.345   9.831
  225    HA   ILE  28           HA       ILE  28  -0.786  -5.738   7.697
  226    HB   ILE  28           HB       ILE  28  -1.138  -5.914  10.696
  227   HG12  ILE  28          1HG1      ILE  28  -0.803  -8.100   8.627
  228   HG13  ILE  28          2HG1      ILE  28   0.432  -7.592   9.774
  229   HG21  ILE  28          1HG2      ILE  28  -2.956  -6.806   8.460
  230   HG22  ILE  28          2HG2      ILE  28  -3.230  -5.433   9.530
  231   HG23  ILE  28          3HG2      ILE  28  -3.229  -7.071  10.181
  232   HD11  ILE  28          3HD1      ILE  28  -0.986  -8.322  11.619
  233   HD12  ILE  28          1HD1      ILE  28  -0.657  -9.636  10.491
  234   HD13  ILE  28          2HD1      ILE  28  -2.223  -8.827  10.469
  235    H    PHE  29           H        PHE  29  -1.632  -3.972   6.819
  236    HA   PHE  29           HA       PHE  29  -1.944  -1.534   8.334
  237    HB2  PHE  29           1HB      PHE  29  -2.796  -2.217   5.513
  238    HB3  PHE  29           2HB      PHE  29  -2.868  -0.613   6.233
  239    HD1  PHE  29           HD2      PHE  29  -0.485   0.037   7.388
  240    HD2  PHE  29           HD1      PHE  29  -1.068  -2.555   4.065
  241    HE1  PHE  29           HE2      PHE  29   1.815   0.480   6.644
  242    HE2  PHE  29           HE1      PHE  29   1.235  -2.115   3.317
  243    HZ   PHE  29           HZ       PHE  29   2.681  -0.595   4.610
  244    H    ASN  30           H        ASN  30  -3.605  -1.155   9.598
  245    HA   ASN  30           HA       ASN  30  -6.079  -2.664   9.277
  246    HB2  ASN  30           1HB      ASN  30  -5.132  -0.723  11.397
  247    HB3  ASN  30           2HB      ASN  30  -6.726  -1.471  11.403
  248   HD21  ASN  30          2HD2      ASN  30  -4.413  -1.638  13.249
  249   HD22  ASN  30          1HD2      ASN  30  -4.099  -3.329  13.427
  250    H    GLY  31           H        GLY  31  -4.726   0.364   8.492
  251    HA2  GLY  31           1HA      GLY  31  -7.358   1.286   7.578
  252    HA3  GLY  31           2HA      GLY  31  -6.370   2.360   8.561
  253    H    VAL  32           H        VAL  32  -7.285   2.878   5.924
  254    HA   VAL  32           HA       VAL  32  -5.293   2.273   3.998
  255    HB   VAL  32           HB       VAL  32  -7.257   4.563   3.879
  256   HG11  VAL  32          1HG1      VAL  32  -5.567   4.648   2.160
  257   HG12  VAL  32          2HG1      VAL  32  -7.110   4.176   1.447
  258   HG13  VAL  32          3HG1      VAL  32  -5.865   2.961   1.739
  259   HG21  VAL  32          3HG2      VAL  32  -8.461   2.520   4.429
  260   HG22  VAL  32          1HG2      VAL  32  -7.685   1.686   3.081
  261   HG23  VAL  32          2HG2      VAL  32  -8.800   3.018   2.771
  262    H    TYR  33           H        TYR  33  -5.727   4.856   6.311
  263    HA   TYR  33           HA       TYR  33  -3.921   6.697   5.169
  264    HB2  TYR  33           1HB      TYR  33  -5.546   7.332   6.925
  265    HB3  TYR  33           2HB      TYR  33  -4.640   6.373   8.094
  266    HD1  TYR  33           HD1      TYR  33  -4.574   9.398   5.998
  267    HD2  TYR  33           HD2      TYR  33  -2.579   7.186   9.035
  268    HE1  TYR  33           HE1      TYR  33  -3.098  11.317   6.419
  269    HE2  TYR  33           HE2      TYR  33  -1.104   9.103   9.470
  270    HH   TYR  33           HH       TYR  33  -0.252  11.109   8.065
  271    H    GLU  34           H        GLU  34  -3.495   3.991   7.386
  272    HA   GLU  34           HA       GLU  34  -0.838   4.521   8.147
  273    HB2  GLU  34           1HB      GLU  34  -2.193   1.836   7.866
  274    HB3  GLU  34           2HB      GLU  34  -0.721   2.159   8.773
  275    HG2  GLU  34           1HG      GLU  34  -2.002   3.661  10.243
  276    HG3  GLU  34           2HG      GLU  34  -3.471   3.215   9.375
  277    H    ALA  35           H        ALA  35  -2.225   2.788   5.435
  278    HA   ALA  35           HA       ALA  35   0.182   1.781   4.364
  279    HB1  ALA  35           3HB      ALA  35  -1.094   1.375   2.348
  280    HB2  ALA  35           1HB      ALA  35  -2.363   2.474   2.894
  281    HB3  ALA  35           2HB      ALA  35  -2.076   0.963   3.758
  282    H    PHE  36           H        PHE  36  -1.716   4.686   3.637
  283    HA   PHE  36           HA       PHE  36  -0.049   5.833   1.718
  284    HB2  PHE  36           1HB      PHE  36  -2.327   6.628   2.242
  285    HB3  PHE  36           2HB      PHE  36  -1.762   7.213   3.802
  286    HD1  PHE  36           HD2      PHE  36  -1.530   7.709   0.158
  287    HD2  PHE  36           HD1      PHE  36  -0.684   9.307   4.008
  288    HE1  PHE  36           HE2      PHE  36  -0.991   9.881  -0.866
  289    HE2  PHE  36           HE1      PHE  36  -0.147  11.481   2.994
  290    HZ   PHE  36           HZ       PHE  36  -0.301  11.771   0.555
  291    H    ASP  37           H        ASP  37  -0.099   6.252   5.232
  292    HA   ASP  37           HA       ASP  37   1.969   8.103   5.488
  293    HB2  ASP  37           1HB      ASP  37   0.414   7.484   7.306
  294    HB3  ASP  37           2HB      ASP  37   1.176   5.901   7.410
  295    H    PHE  38           H        PHE  38   2.089   4.558   5.665
  296    HA   PHE  38           HA       PHE  38   4.811   4.299   6.224
  297    HB2  PHE  38           1HB      PHE  38   3.249   2.453   6.484
  298    HB3  PHE  38           2HB      PHE  38   2.967   2.412   4.748
  299    HD1  PHE  38           HD1      PHE  38   5.806   2.229   7.159
  300    HD2  PHE  38           HD2      PHE  38   4.089   0.825   3.523
  301    HE1  PHE  38           HE1      PHE  38   7.658   0.630   6.905
  302    HE2  PHE  38           HE2      PHE  38   5.938  -0.774   3.264
  303    HZ   PHE  38           HZ       PHE  38   7.725  -0.874   4.956
  304    H    LEU  39           H        LEU  39   3.122   4.420   3.121
  305    HA   LEU  39           HA       LEU  39   5.260   3.713   1.471
  306    HB2  LEU  39           1HB      LEU  39   2.919   5.525   0.900
  307    HB3  LEU  39           2HB      LEU  39   4.002   4.886  -0.322
  308    HG   LEU  39           HG       LEU  39   2.281   3.178   1.476
  309   HD11  LEU  39          1HD1      LEU  39   0.886   4.530   0.020
  310   HD12  LEU  39          2HD1      LEU  39   0.882   2.848  -0.513
  311   HD13  LEU  39          3HD1      LEU  39   1.844   4.046  -1.378
  312   HD21  LEU  39          3HD2      LEU  39   2.830   1.410  -0.111
  313   HD22  LEU  39          1HD2      LEU  39   4.285   2.062   0.640
  314   HD23  LEU  39          2HD2      LEU  39   3.861   2.523  -1.007
  315    H    GLN  40           H        GLN  40   4.364   6.852   2.815
  316    HA   GLN  40           HA       GLN  40   6.528   8.113   1.320
  317    HB2  GLN  40           1HB      GLN  40   4.285   9.216   2.990
  318    HB3  GLN  40           2HB      GLN  40   5.631  10.224   2.468
  319    HG2  GLN  40           1HG      GLN  40   5.118   9.678   0.133
  320    HG3  GLN  40           2HG      GLN  40   3.753   8.703   0.671
  321   HE21  GLN  40          2HE2      GLN  40   3.890  11.094  -1.055
  322   HE22  GLN  40          1HE2      GLN  40   2.811  12.240  -0.322
  323    H    HIS  41           H        HIS  41   6.035   6.677   4.331
  324    HA   HIS  41           HA       HIS  41   7.996   8.239   5.760
  325    HB2  HIS  41           1HB      HIS  41   6.307   5.872   6.360
  326    HB3  HIS  41           2HB      HIS  41   7.825   6.001   7.242
  327    HD1  HIS  41           HD1      HIS  41   6.828   6.549   9.494
  328    HD2  HIS  41           HD2      HIS  41   5.570   9.134   6.488
  329    HE1  HIS  41           HE1      HIS  41   5.656   8.440  10.670
  330    HE2  HIS  41           HE2      HIS  41   4.696   9.849   8.818
  331    H    GLU  42           H        GLU  42   7.870   4.831   4.764
  332    HA   GLU  42           HA       GLU  42  10.488   5.001   3.624
  333    HB2  GLU  42           1HB      GLU  42  11.125   4.671   5.961
  334    HB3  GLU  42           2HB      GLU  42  10.084   3.254   6.059
  335    HG2  GLU  42           1HG      GLU  42  11.443   2.067   4.490
  336    HG3  GLU  42           2HG      GLU  42  12.412   3.503   4.173
  337    H    TRP  43           H        TRP  43   9.647   4.298   1.778
  338    HA   TRP  43           HA       TRP  43   8.417   1.645   1.696
  339    HB2  TRP  43           1HB      TRP  43   7.258   3.305   0.412
  340    HB3  TRP  43           2HB      TRP  43   8.747   3.855  -0.338
  341    HD1  TRP  43           HD1      TRP  43   9.230   2.953  -2.653
  342    HE1  TRP  43           HE1      TRP  43   8.274   1.101  -4.148
  343    HE3  TRP  43           HE3      TRP  43   6.135   0.657   0.752
  344    HZ2  TRP  43           HZ2      TRP  43   6.468  -1.044  -3.928
  345    HZ3  TRP  43           HZ3      TRP  43   4.840  -1.289   0.003
  346    HH2  TRP  43           HH2      TRP  43   5.002  -2.122  -2.282
  347    HA   PRO  44           HA       PRO  44  12.782   0.611   0.978
  348    HB2  PRO  44           1HB      PRO  44  12.673  -1.918   1.895
  349    HB3  PRO  44           2HB      PRO  44  12.703  -0.526   2.983
  350    HG2  PRO  44           1HG      PRO  44  10.383  -2.197   2.107
  351    HG3  PRO  44           2HG      PRO  44  10.753  -1.550   3.715
  352    HD2  PRO  44           1HD      PRO  44   8.954  -0.414   1.989
  353    HD3  PRO  44           2HD      PRO  44   9.831   0.489   3.237
  354    H    ALA  45           H        ALA  45   9.931  -0.844  -0.269
  355    HA   ALA  45           HA       ALA  45  11.345  -2.624  -2.069
  356    HB1  ALA  45           3HB      ALA  45   9.228  -3.335  -1.051
  357    HB2  ALA  45           1HB      ALA  45   9.132  -3.308  -2.813
  358    HB3  ALA  45           2HB      ALA  45   8.397  -2.011  -1.869
  359    H    ARG  46           H        ARG  46   9.766  -2.401  -4.357
  360    HA   ARG  46           HA       ARG  46  10.283   0.330  -5.288
  361    HB2  ARG  46           1HB      ARG  46  11.130  -2.181  -6.753
  362    HB3  ARG  46           2HB      ARG  46  11.337  -0.528  -7.323
  363    HG2  ARG  46           1HG      ARG  46  12.851  -0.045  -5.503
  364    HG3  ARG  46           2HG      ARG  46  12.585  -1.650  -4.824
  365    HD2  ARG  46           1HD      ARG  46  13.495  -2.593  -6.964
  366    HD3  ARG  46           2HD      ARG  46  13.945  -0.947  -7.413
  367    HE   ARG  46           HE       ARG  46  14.949  -1.602  -4.841
  368   HH11  ARG  46          1HH1      ARG  46  15.540  -2.060  -8.263
  369   HH12  ARG  46          2HH1      ARG  46  17.223  -2.468  -8.051
  370   HH21  ARG  46          1HH2      ARG  46  17.156  -2.131  -4.547
  371   HH22  ARG  46          2HH2      ARG  46  18.134  -2.524  -5.932
  372    H    GLY  47           H        GLY  47   9.348   0.530  -7.645
  373    HA2  GLY  47           1HA      GLY  47   7.310  -0.953  -8.677
  374    HA3  GLY  47           2HA      GLY  47   6.545  -0.104  -7.342
  375    H    ASP  48           H        ASP  48   8.165   2.270  -7.591
  376    HA   ASP  48           HA       ASP  48   8.493   4.177  -8.769
  377    HB2  ASP  48           1HB      ASP  48   9.358   2.744 -10.584
  378    HB3  ASP  48           2HB      ASP  48   7.725   2.540 -11.202
  379    H    ARG  49           H        ARG  49   6.165   3.522 -11.232
  380    HA   ARG  49           HA       ARG  49   4.402   5.492 -10.136
  381    HB2  ARG  49           1HB      ARG  49   4.250   3.759 -12.592
  382    HB3  ARG  49           2HB      ARG  49   2.951   4.853 -12.130
  383    HG2  ARG  49           1HG      ARG  49   4.553   6.729 -12.200
  384    HG3  ARG  49           2HG      ARG  49   5.793   5.609 -12.766
  385    HD2  ARG  49           1HD      ARG  49   3.181   6.148 -14.172
  386    HD3  ARG  49           2HD      ARG  49   4.722   6.895 -14.588
  387    HE   ARG  49           HE       ARG  49   5.221   4.210 -14.688
  388   HH11  ARG  49          1HH1      ARG  49   2.864   6.324 -16.166
  389   HH12  ARG  49          2HH1      ARG  49   2.795   5.435 -17.659
  390   HH21  ARG  49          1HH2      ARG  49   5.106   2.993 -16.640
  391   HH22  ARG  49          2HH2      ARG  49   4.068   3.536 -17.918
  392    H    ALA  50           H        ALA  50   4.622   2.047 -10.028
  393    HA   ALA  50           HA       ALA  50   1.963   1.499  -9.203
  394    HB1  ALA  50           3HB      ALA  50   4.513   0.038  -8.500
  395    HB2  ALA  50           1HB      ALA  50   3.498  -0.273  -9.907
  396    HB3  ALA  50           2HB      ALA  50   2.875  -0.581  -8.286
  397    H    HIS  51           H        HIS  51   4.854   2.590  -7.587
  398    HA   HIS  51           HA       HIS  51   3.892   2.503  -4.929
  399    HB2  HIS  51           1HB      HIS  51   6.252   2.718  -5.266
  400    HB3  HIS  51           2HB      HIS  51   6.047   4.135  -6.285
  401    HD1  HIS  51           HD1      HIS  51   5.701   3.102  -2.656
  402    HD2  HIS  51           HD2      HIS  51   6.175   6.521  -4.969
  403    HE1  HIS  51           HE1      HIS  51   6.055   4.979  -1.022
  404    HE2  HIS  51           HE2      HIS  51   6.478   7.013  -2.444
  405    H    GLU  52           H        GLU  52   3.902   4.995  -7.439
  406    HA   GLU  52           HA       GLU  52   2.669   7.005  -5.879
  407    HB2  GLU  52           1HB      GLU  52   2.650   6.639  -8.875
  408    HB3  GLU  52           2HB      GLU  52   2.166   8.102  -8.026
  409    HG2  GLU  52           1HG      GLU  52   4.535   8.031  -7.018
  410    HG3  GLU  52           2HG      GLU  52   4.889   6.918  -8.339
  411    H    GLN  53           H        GLN  53   1.321   4.585  -8.102
  412    HA   GLN  53           HA       GLN  53  -1.346   5.361  -8.024
  413    HB2  GLN  53           1HB      GLN  53  -0.088   2.636  -8.279
  414    HB3  GLN  53           2HB      GLN  53  -1.822   2.893  -8.417
  415    HG2  GLN  53           1HG      GLN  53  -1.498   4.325 -10.325
  416    HG3  GLN  53           2HG      GLN  53   0.253   4.218 -10.146
  417   HE21  GLN  53          2HE2      GLN  53  -1.534   3.485 -12.362
  418   HE22  GLN  53          1HE2      GLN  53  -1.188   1.824 -12.711
  419    H    ALA  54           H        ALA  54   0.430   3.226  -5.827
  420    HA   ALA  54           HA       ALA  54  -1.682   2.511  -4.153
  421    HB1  ALA  54           3HB      ALA  54   1.217   2.917  -3.415
  422    HB2  ALA  54           1HB      ALA  54   0.514   1.438  -4.069
  423    HB3  ALA  54           2HB      ALA  54   0.026   2.016  -2.476
  424    H    LEU  55           H        LEU  55   0.606   5.224  -3.862
  425    HA   LEU  55           HA       LEU  55  -0.456   6.387  -1.551
  426    HB2  LEU  55           1HB      LEU  55   1.042   7.530  -3.894
  427    HB3  LEU  55           2HB      LEU  55   0.534   8.533  -2.548
  428    HG   LEU  55           HG       LEU  55   2.295   6.106  -2.224
  429   HD11  LEU  55          1HD1      LEU  55   4.147   7.706  -2.024
  430   HD12  LEU  55          2HD1      LEU  55   3.057   9.012  -2.488
  431   HD13  LEU  55          3HD1      LEU  55   3.430   7.726  -3.635
  432   HD21  LEU  55          3HD2      LEU  55   2.807   7.159  -0.067
  433   HD22  LEU  55          1HD2      LEU  55   1.091   6.780  -0.221
  434   HD23  LEU  55          2HD2      LEU  55   1.650   8.441  -0.427
  435    H    ARG  56           H        ARG  56  -1.107   7.122  -4.954
  436    HA   ARG  56           HA       ARG  56  -2.899   9.209  -4.608
  437    HB2  ARG  56           1HB      ARG  56  -1.893   8.583  -6.760
  438    HB3  ARG  56           2HB      ARG  56  -2.868   7.121  -6.793
  439    HG2  ARG  56           1HG      ARG  56  -4.892   8.442  -6.930
  440    HG3  ARG  56           2HG      ARG  56  -3.948   9.929  -6.819
  441    HD2  ARG  56           1HD      ARG  56  -2.803   9.345  -8.906
  442    HD3  ARG  56           2HD      ARG  56  -3.767   7.875  -9.020
  443    HE   ARG  56           HE       ARG  56  -5.671   9.740  -8.887
  444   HH11  ARG  56          1HH1      ARG  56  -2.750   9.575 -10.826
  445   HH12  ARG  56          2HH1      ARG  56  -3.427  10.493 -12.136
  446   HH21  ARG  56          1HH2      ARG  56  -6.557  10.931 -10.610
  447   HH22  ARG  56          2HH2      ARG  56  -5.593  11.257 -12.024
  448    H    LEU  57           H        LEU  57  -3.567   5.727  -4.881
  449    HA   LEU  57           HA       LEU  57  -6.383   6.017  -4.685
  450    HB2  LEU  57           1HB      LEU  57  -4.608   3.625  -4.215
  451    HB3  LEU  57           2HB      LEU  57  -6.360   3.561  -4.268
  452    HG   LEU  57           HG       LEU  57  -4.580   4.407  -6.556
  453   HD11  LEU  57          1HD1      LEU  57  -4.412   2.023  -6.067
  454   HD12  LEU  57          2HD1      LEU  57  -5.265   2.308  -7.584
  455   HD13  LEU  57          3HD1      LEU  57  -6.169   1.882  -6.131
  456   HD21  LEU  57          3HD2      LEU  57  -7.563   3.970  -6.443
  457   HD22  LEU  57          1HD2      LEU  57  -6.623   4.360  -7.884
  458   HD23  LEU  57          2HD2      LEU  57  -6.753   5.532  -6.572
  459    H    CYS  58           H        CYS  58  -3.841   5.402  -2.298
  460    HA   CYS  58           HA       CYS  58  -5.521   4.886  -0.110
  461    HB2  CYS  58           1HB      CYS  58  -2.770   6.128  -0.212
  462    HB3  CYS  58           2HB      CYS  58  -3.585   5.679   1.283
  463    HG   CYS  58           HG       CYS  58  -2.415   3.622  -1.167
  464    H    ARG  59           H        ARG  59  -4.209   7.957  -1.341
  465    HA   ARG  59           HA       ARG  59  -5.448   9.520   0.690
  466    HB2  ARG  59           1HB      ARG  59  -3.481  10.308  -0.579
  467    HB3  ARG  59           2HB      ARG  59  -4.468  10.396  -2.033
  468    HG2  ARG  59           1HG      ARG  59  -5.757  12.171  -1.174
  469    HG3  ARG  59           2HG      ARG  59  -5.138  11.929   0.460
  470    HD2  ARG  59           1HD      ARG  59  -4.107  13.877  -0.515
  471    HD3  ARG  59           2HD      ARG  59  -2.903  12.608  -0.313
  472    HE   ARG  59           HE       ARG  59  -2.936  12.257  -2.681
  473   HH11  ARG  59          1HH1      ARG  59  -4.761  15.048  -1.586
  474   HH12  ARG  59          2HH1      ARG  59  -4.647  15.883  -3.110
  475   HH21  ARG  59          1HH2      ARG  59  -2.799  13.359  -4.701
  476   HH22  ARG  59          2HH2      ARG  59  -3.529  14.925  -4.865
  477    H    ALA  60           H        ALA  60  -6.425   8.471  -2.525
  478    HA   ALA  60           HA       ALA  60  -8.757  10.084  -2.686
  479    HB1  ALA  60           3HB      ALA  60  -7.757   9.074  -4.663
  480    HB2  ALA  60           1HB      ALA  60  -9.440   8.578  -4.489
  481    HB3  ALA  60           2HB      ALA  60  -8.142   7.466  -4.051
  482    H    SER  61           H        SER  61  -8.058   6.995  -1.204
  483    HA   SER  61           HA       SER  61 -10.753   6.277  -0.641
  484    HB2  SER  61           1HB      SER  61  -8.224   5.497   0.831
  485    HB3  SER  61           2HB      SER  61  -9.785   4.687   0.952
  486    HG   SER  61           HG       SER  61  -8.083   4.853  -1.317
  487    H    LEU  62           H        LEU  62  -8.292   8.172   1.011
  488    HA   LEU  62           HA       LEU  62  -9.730   8.629   3.407
  489    HB2  LEU  62           1HB      LEU  62  -7.640  10.343   2.059
  490    HB3  LEU  62           2HB      LEU  62  -8.201  10.545   3.707
  491    HG   LEU  62           HG       LEU  62  -6.769   8.097   2.670
  492   HD11  LEU  62          1HD1      LEU  62  -5.753  10.368   4.372
  493   HD12  LEU  62          2HD1      LEU  62  -5.311  10.054   2.694
  494   HD13  LEU  62          3HD1      LEU  62  -4.860   8.906   3.955
  495   HD21  LEU  62          3HD2      LEU  62  -8.273   7.622   4.534
  496   HD22  LEU  62          1HD2      LEU  62  -7.534   8.923   5.468
  497   HD23  LEU  62          2HD2      LEU  62  -6.585   7.500   5.035
  498    H    MET  63           H        MET  63  -9.770  10.081   0.250
  499    HA   MET  63           HA       MET  63 -11.389  12.336   0.923
  500    HB2  MET  63           1HB      MET  63 -10.879  10.970  -1.728
  501    HB3  MET  63           2HB      MET  63 -11.753  12.485  -1.544
  502    HG2  MET  63           1HG      MET  63  -9.784  13.579  -0.711
  503    HG3  MET  63           2HG      MET  63  -8.896  12.057  -0.700
  504    HE1  MET  63           3HE      MET  63 -11.419  13.242  -3.472
  505    HE2  MET  63           1HE      MET  63 -10.348  14.103  -4.579
  506    HE3  MET  63           2HE      MET  63 -10.658  14.752  -2.970
  507    H    GLY  64           H        GLY  64 -11.999   9.030   0.613
  508    HA2  GLY  64           1HA      GLY  64 -14.009   7.966   1.136
  509    HA3  GLY  64           2HA      GLY  64 -14.851   9.492   0.909
  510    H    ASP  65           H        ASP  65 -12.713   8.738  -1.622
  511    HA   ASP  65           HA       ASP  65 -14.996   8.242  -3.363
  512    HB2  ASP  65           1HB      ASP  65 -12.196   9.164  -3.794
  513    HB3  ASP  65           2HB      ASP  65 -13.029   8.371  -5.128
  514    H    VAL  66           H        VAL  66 -11.844   6.760  -2.660
  515    HA   VAL  66           HA       VAL  66 -12.511   4.473  -4.305
  516    HB   VAL  66           HB       VAL  66 -10.084   5.035  -2.593
  517   HG11  VAL  66          1HG1      VAL  66 -10.382   2.644  -2.737
  518   HG12  VAL  66          2HG1      VAL  66  -9.051   3.125  -3.790
  519   HG13  VAL  66          3HG1      VAL  66 -10.629   2.746  -4.482
  520   HG21  VAL  66          3HG2      VAL  66  -8.952   5.340  -4.753
  521   HG22  VAL  66          1HG2      VAL  66 -10.261   6.499  -4.516
  522   HG23  VAL  66          2HG2      VAL  66 -10.494   5.112  -5.578
  523    H    ALA  67           H        ALA  67 -13.394   2.663  -3.622
  524    HA   ALA  67           HA       ALA  67 -14.208   2.351  -0.898
  525    HB1  ALA  67           3HB      ALA  67 -14.402   0.393  -3.185
  526    HB2  ALA  67           1HB      ALA  67 -15.610   1.610  -2.778
  527    HB3  ALA  67           2HB      ALA  67 -15.264   0.299  -1.651
  528    H    GLY  68           H        GLY  68 -13.729   0.476   0.405
  529    HA2  GLY  68           1HA      GLY  68 -11.014   0.230   0.908
  530    HA3  GLY  68           2HA      GLY  68 -12.246  -0.851   1.536
  531    H    GLU  69           H        GLU  69 -13.117  -1.980  -0.898
  532    HA   GLU  69           HA       GLU  69 -11.229  -4.060  -1.148
  533    HB2  GLU  69           1HB      GLU  69 -13.488  -3.390  -3.039
  534    HB3  GLU  69           2HB      GLU  69 -12.677  -4.943  -2.884
  535    HG2  GLU  69           1HG      GLU  69 -13.548  -5.166  -0.612
  536    HG3  GLU  69           2HG      GLU  69 -14.363  -3.611  -0.776
  537    H    ILE  70           H        ILE  70 -12.142  -1.435  -3.350
  538    HA   ILE  70           HA       ILE  70 -10.507  -2.088  -5.499
  539    HB   ILE  70           HB       ILE  70 -11.251   0.694  -4.579
  540   HG12  ILE  70          1HG1      ILE  70 -12.685  -1.159  -6.496
  541   HG13  ILE  70          2HG1      ILE  70 -13.209  -0.801  -4.855
  542   HG21  ILE  70          1HG2      ILE  70 -10.401  -0.338  -7.282
  543   HG22  ILE  70          2HG2      ILE  70  -9.482   0.737  -6.228
  544   HG23  ILE  70          3HG2      ILE  70 -10.992   1.290  -6.955
  545   HD11  ILE  70          3HD1      ILE  70 -13.006   1.159  -7.129
  546   HD12  ILE  70          1HD1      ILE  70 -13.487   1.555  -5.479
  547   HD13  ILE  70          2HD1      ILE  70 -14.487   0.477  -6.454
  548    H    ALA  71           H        ALA  71  -9.830   0.040  -2.739
  549    HA   ALA  71           HA       ALA  71  -7.220   0.759  -3.483
  550    HB1  ALA  71           3HB      ALA  71  -8.397   0.565  -0.714
  551    HB2  ALA  71           1HB      ALA  71  -8.496   1.962  -1.786
  552    HB3  ALA  71           2HB      ALA  71  -6.933   1.442  -1.157
  553    H    ARG  72           H        ARG  72  -8.444  -1.949  -1.571
  554    HA   ARG  72           HA       ARG  72  -5.898  -2.872  -0.738
  555    HB2  ARG  72           1HB      ARG  72  -7.722  -3.592   0.563
  556    HB3  ARG  72           2HB      ARG  72  -8.622  -4.139  -0.845
  557    HG2  ARG  72           1HG      ARG  72  -7.105  -5.988  -1.152
  558    HG3  ARG  72           2HG      ARG  72  -6.087  -5.406   0.168
  559    HD2  ARG  72           1HD      ARG  72  -7.620  -6.004   1.790
  560    HD3  ARG  72           2HD      ARG  72  -8.975  -5.980   0.661
  561    HE   ARG  72           HE       ARG  72  -8.032  -8.047  -0.306
  562   HH11  ARG  72          1HH1      ARG  72  -7.052  -7.136   2.940
  563   HH12  ARG  72          2HH1      ARG  72  -6.763  -8.772   3.439
  564   HH21  ARG  72          1HH2      ARG  72  -7.689 -10.176   0.349
  565   HH22  ARG  72          2HH2      ARG  72  -7.172 -10.522   1.978
  566    H    THR  73           H        THR  73  -8.101  -4.010  -3.313
  567    HA   THR  73           HA       THR  73  -6.479  -6.093  -4.232
  568    HB   THR  73           HB       THR  73  -8.370  -4.447  -5.921
  569    HG1  THR  73           HG1      THR  73  -9.920  -6.066  -5.219
  570   HG21  THR  73          3HG2      THR  73  -7.486  -7.330  -6.117
  571   HG22  THR  73          1HG2      THR  73  -6.971  -6.019  -7.181
  572   HG23  THR  73          2HG2      THR  73  -8.657  -6.535  -7.170
  573    H    ALA  74           H        ALA  74  -6.549  -2.671  -5.140
  574    HA   ALA  74           HA       ALA  74  -4.663  -2.909  -7.252
  575    HB1  ALA  74           3HB      ALA  74  -5.384  -0.484  -5.614
  576    HB2  ALA  74           1HB      ALA  74  -6.202  -1.020  -7.081
  577    HB3  ALA  74           2HB      ALA  74  -4.524  -0.482  -7.155
  578    H    PHE  75           H        PHE  75  -4.390  -2.412  -3.787
  579    HA   PHE  75           HA       PHE  75  -1.612  -1.754  -3.819
  580    HB2  PHE  75           1HB      PHE  75  -3.235  -1.239  -1.938
  581    HB3  PHE  75           2HB      PHE  75  -3.159  -2.944  -1.510
  582    HD1  PHE  75           HD2      PHE  75  -1.316   0.213  -1.627
  583    HD2  PHE  75           HD1      PHE  75  -1.208  -3.871  -0.443
  584    HE1  PHE  75           HE2      PHE  75   0.683   0.666  -0.269
  585    HE2  PHE  75           HE1      PHE  75   0.794  -3.427   0.920
  586    HZ   PHE  75           HZ       PHE  75   1.742  -1.155   1.007
  587    H    VAL  76           H        VAL  76  -3.478  -4.714  -3.674
  588    HA   VAL  76           HA       VAL  76  -1.405  -6.511  -3.070
  589    HB   VAL  76           HB       VAL  76  -3.867  -6.945  -4.780
  590   HG11  VAL  76          1HG1      VAL  76  -2.208  -8.653  -5.252
  591   HG12  VAL  76          2HG1      VAL  76  -3.537  -9.337  -4.316
  592   HG13  VAL  76          3HG1      VAL  76  -2.005  -8.962  -3.529
  593   HG21  VAL  76          3HG2      VAL  76  -3.348  -7.552  -1.871
  594   HG22  VAL  76          1HG2      VAL  76  -4.820  -7.936  -2.763
  595   HG23  VAL  76          2HG2      VAL  76  -4.367  -6.253  -2.492
  596    H    ALA  77           H        ALA  77  -2.556  -5.196  -6.152
  597    HA   ALA  77           HA       ALA  77  -0.720  -6.576  -7.802
  598    HB1  ALA  77           3HB      ALA  77  -1.296  -4.921  -9.506
  599    HB2  ALA  77           1HB      ALA  77  -2.080  -3.922  -8.282
  600    HB3  ALA  77           2HB      ALA  77  -2.740  -5.508  -8.681
  601    H    ALA  78           H        ALA  78  -0.576  -3.515  -6.071
  602    HA   ALA  78           HA       ALA  78   1.860  -2.603  -7.182
  603    HB1  ALA  78           3HB      ALA  78   0.615  -1.936  -4.517
  604    HB2  ALA  78           1HB      ALA  78   0.307  -1.106  -6.043
  605    HB3  ALA  78           2HB      ALA  78   1.910  -1.036  -5.307
  606    H    SER  79           H        SER  79   1.126  -4.387  -4.189
  607    HA   SER  79           HA       SER  79   3.842  -4.547  -3.352
  608    HB2  SER  79           1HB      SER  79   2.940  -6.316  -1.774
  609    HB3  SER  79           2HB      SER  79   2.167  -4.735  -1.665
  610    HG   SER  79           HG       SER  79   0.387  -5.514  -2.644
  611    H    ARG  80           H        ARG  80   1.869  -6.395  -5.499
  612    HA   ARG  80           HA       ARG  80   3.376  -8.757  -5.682
  613    HB2  ARG  80           1HB      ARG  80   1.181  -8.525  -6.734
  614    HB3  ARG  80           2HB      ARG  80   1.808  -7.289  -7.816
  615    HG2  ARG  80           1HG      ARG  80   3.347  -8.984  -8.775
  616    HG3  ARG  80           2HG      ARG  80   2.551 -10.204  -7.775
  617    HD2  ARG  80           1HD      ARG  80   1.625 -10.224 -10.011
  618    HD3  ARG  80           2HD      ARG  80   0.411  -9.674  -8.858
  619    HE   ARG  80           HE       ARG  80   1.829  -7.485 -10.027
  620   HH11  ARG  80          1HH1      ARG  80  -0.720  -9.799 -10.649
  621   HH12  ARG  80          2HH1      ARG  80  -1.553  -8.777 -11.782
  622   HH21  ARG  80          1HH2      ARG  80   0.743  -6.136 -11.501
  623   HH22  ARG  80          2HH2      ARG  80  -0.717  -6.689 -12.265
  624    H    GLN  81           H        GLN  81   3.647  -5.663  -7.382
  625    HA   GLN  81           HA       GLN  81   5.963  -6.471  -8.880
  626    HB2  GLN  81           1HB      GLN  81   4.265  -4.742  -9.619
  627    HB3  GLN  81           2HB      GLN  81   4.959  -3.658  -8.421
  628    HG2  GLN  81           1HG      GLN  81   7.136  -3.836  -9.560
  629    HG3  GLN  81           2HG      GLN  81   6.386  -4.860 -10.784
  630   HE21  GLN  81          2HE2      GLN  81   7.717  -2.318 -11.121
  631   HE22  GLN  81          1HE2      GLN  81   6.553  -1.246 -11.832
  632    H    ALA  82           H        ALA  82   5.313  -5.038  -5.822
  633    HA   ALA  82           HA       ALA  82   7.754  -3.734  -5.339
  634    HB1  ALA  82           3HB      ALA  82   5.737  -3.344  -4.018
  635    HB2  ALA  82           1HB      ALA  82   7.105  -3.783  -2.994
  636    HB3  ALA  82           2HB      ALA  82   5.855  -4.975  -3.355
  637    H    HIS  83           H        HIS  83   6.647  -6.930  -4.176
  638    HA   HIS  83           HA       HIS  83   9.112  -8.195  -4.638
  639    HB2  HIS  83           1HB      HIS  83   9.475  -6.586  -2.545
  640    HB3  HIS  83           2HB      HIS  83   8.734  -7.936  -1.688
  641    HD1  HIS  83           HD1      HIS  83  10.457  -9.486  -0.770
  642    HD2  HIS  83           HD2      HIS  83  11.641  -7.721  -4.344
  643    HE1  HIS  83           HE1      HIS  83  12.764 -10.376  -1.234
  644    HE2  HIS  83           HE2      HIS  83  13.543  -9.124  -3.281
  645    H    CYS  84           H        CYS  84   6.437  -8.180  -2.269
  646    HA   CYS  84           HA       CYS  84   5.662 -10.829  -3.063
  647    HB2  CYS  84           1HB      CYS  84   7.518 -11.279  -1.483
  648    HB3  CYS  84           2HB      CYS  84   6.659 -10.373  -0.242
  649    HG   CYS  84           HG       CYS  84   4.472 -12.162  -0.186
  650    H    LEU  85           H        LEU  85   3.675 -10.070  -3.474
  651    HA   LEU  85           HA       LEU  85   2.037  -8.587  -1.734
  652    HB2  LEU  85           1HB      LEU  85   0.178  -9.311  -3.096
  653    HB3  LEU  85           2HB      LEU  85   1.534  -8.911  -4.130
  654    HG   LEU  85           HG       LEU  85   0.862 -11.753  -3.360
  655   HD11  LEU  85          1HD1      LEU  85  -0.220 -11.939  -5.548
  656   HD12  LEU  85          2HD1      LEU  85  -0.010 -10.205  -5.795
  657   HD13  LEU  85          3HD1      LEU  85  -1.057 -10.792  -4.501
  658   HD21  LEU  85          3HD2      LEU  85   2.175 -12.298  -5.356
  659   HD22  LEU  85          1HD2      LEU  85   3.134 -11.399  -4.180
  660   HD23  LEU  85          2HD2      LEU  85   2.502 -10.582  -5.610
  661    H    MET  86           H        MET  86   0.532  -9.243  -0.186
  662    HA   MET  86           HA       MET  86   0.615 -12.084   0.560
  663    HB2  MET  86           1HB      MET  86   0.884  -9.719   2.416
  664    HB3  MET  86           2HB      MET  86   0.521 -11.348   2.965
  665    HG2  MET  86           1HG      MET  86   2.991 -10.519   1.468
  666    HG3  MET  86           2HG      MET  86   2.879 -10.786   3.207
  667    HE1  MET  86           3HE      MET  86   2.142 -14.632   3.389
  668    HE2  MET  86           1HE      MET  86   0.947 -13.336   3.341
  669    HE3  MET  86           2HE      MET  86   2.407 -13.153   4.313
  670    H    GLU  87           H        GLU  87  -1.129 -12.533   2.259
  671    HA   GLU  87           HA       GLU  87  -3.623 -11.319   1.269
  672    HB2  GLU  87           1HB      GLU  87  -3.302 -14.038   2.542
  673    HB3  GLU  87           2HB      GLU  87  -4.695 -13.425   1.662
  674    HG2  GLU  87           1HG      GLU  87  -3.486 -13.485  -0.410
  675    HG3  GLU  87           2HG      GLU  87  -1.996 -13.912   0.431
  676    H    ASP  88           H        ASP  88  -5.428 -12.037   3.038
  677    HA   ASP  88           HA       ASP  88  -4.496 -11.025   5.625
  678    HB2  ASP  88           1HB      ASP  88  -6.908 -10.701   6.134
  679    HB3  ASP  88           2HB      ASP  88  -6.388  -9.789   4.724
  680    H    LYS  89           H        LYS  89  -4.527 -12.299   7.389
  681    HA   LYS  89           HA       LYS  89  -4.606 -15.117   6.876
  682    HB2  LYS  89           1HB      LYS  89  -2.929 -13.894   8.352
  683    HB3  LYS  89           2HB      LYS  89  -4.209 -13.779   9.551
  684    HG2  LYS  89           1HG      LYS  89  -4.361 -16.216   9.627
  685    HG3  LYS  89           2HG      LYS  89  -3.080 -16.333   8.418
  686    HD2  LYS  89           1HD      LYS  89  -1.582 -15.104   9.990
  687    HD3  LYS  89           2HD      LYS  89  -2.858 -15.196  11.205
  688    HE2  LYS  89           1HE      LYS  89  -2.802 -17.662  11.011
  689    HE3  LYS  89           2HE      LYS  89  -1.451 -17.517   9.889
  690    HZ1  LYS  89           3HZ      LYS  89  -0.595 -17.964  12.049
  691    HZ2  LYS  89           1HZ      LYS  89  -1.498 -16.709  12.748
  692    HZ3  LYS  89           2HZ      LYS  89  -0.227 -16.347  11.683
  693    H    ALA  90           H        ALA  90  -6.157 -16.543   7.369
  694    HA   ALA  90           HA       ALA  90  -8.743 -15.687   8.153
  695    HB1  ALA  90           3HB      ALA  90  -8.353 -17.663   6.753
  696    HB2  ALA  90           1HB      ALA  90  -9.315 -18.056   8.177
  697    HB3  ALA  90           2HB      ALA  90  -7.605 -18.483   8.123
  698    H    GLU  91           H        GLU  91  -5.957 -16.603   9.918
  699    HA   GLU  91           HA       GLU  91  -7.335 -17.166  12.385
  700    HB2  GLU  91           1HB      GLU  91  -5.156 -18.203  11.836
  701    HB3  GLU  91           2HB      GLU  91  -4.409 -16.613  11.863
  702    HG2  GLU  91           1HG      GLU  91  -5.112 -16.421  14.255
  703    HG3  GLU  91           2HG      GLU  91  -5.610 -18.111  14.175
  704    H    ALA  92           H        ALA  92  -8.598 -15.215  12.347
  705    HA   ALA  92           HA       ALA  92  -7.134 -12.946  13.501
  706    HB1  ALA  92           3HB      ALA  92  -8.613 -11.387  12.381
  707    HB2  ALA  92           1HB      ALA  92  -9.484 -12.724  11.627
  708    HB3  ALA  92           2HB      ALA  92  -7.800 -12.415  11.201
  709    HA   PRO  93           HA       PRO  93 -11.537 -13.175  15.591
  710    HB2  PRO  93           1HB      PRO  93 -12.859 -15.547  15.195
  711    HB3  PRO  93           2HB      PRO  93 -13.191 -14.071  14.282
  712    HG2  PRO  93           1HG      PRO  93 -11.520 -16.434  13.522
  713    HG3  PRO  93           2HG      PRO  93 -12.668 -15.508  12.537
  714    HD2  PRO  93           1HD      PRO  93 -10.018 -15.132  12.336
  715    HD3  PRO  93           2HD      PRO  93 -11.164 -13.787  12.175
  716    H    ASN  94           H        ASN  94 -12.064 -14.341  17.576
  717    HA   ASN  94           HA       ASN  94  -9.713 -15.436  18.734
  718    HB2  ASN  94           1HB      ASN  94 -12.530 -15.430  19.847
  719    HB3  ASN  94           2HB      ASN  94 -11.055 -15.705  20.765
  720   HD21  ASN  94          2HD2      ASN  94 -13.110 -13.375  19.279
  721   HD22  ASN  94          1HD2      ASN  94 -12.295 -11.966  19.865
  722    H    THR  95           H        THR  95 -12.790 -16.826  17.689
  723    HA   THR  95           HA       THR  95 -11.517 -19.485  17.815
  724    HB   THR  95           HB       THR  95 -14.492 -19.168  17.702
  725    HG1  THR  95           HG1      THR  95 -14.006 -17.909  19.479
  726   HG21  THR  95          3HG2      THR  95 -12.669 -21.213  18.973
  727   HG22  THR  95          1HG2      THR  95 -13.522 -21.396  17.441
  728   HG23  THR  95          2HG2      THR  95 -14.431 -21.285  18.948
  729    H    ILE  96           H        ILE  96 -11.870 -20.879  16.052
  730    HA   ILE  96           HA       ILE  96 -12.601 -19.509  13.563
  731    HB   ILE  96           HB       ILE  96 -11.167 -22.144  13.964
  732   HG12  ILE  96          1HG1      ILE  96 -10.114 -19.445  13.077
  733   HG13  ILE  96          2HG1      ILE  96  -9.850 -20.168  14.660
  734   HG21  ILE  96          1HG2      ILE  96 -11.709 -20.572  11.449
  735   HG22  ILE  96          2HG2      ILE  96 -12.420 -22.124  11.887
  736   HG23  ILE  96          3HG2      ILE  96 -10.693 -22.011  11.557
  737   HD11  ILE  96          3HD1      ILE  96  -8.622 -22.002  13.606
  738   HD12  ILE  96          1HD1      ILE  96  -7.901 -20.429  13.254
  739   HD13  ILE  96          2HD1      ILE  96  -8.870 -21.250  12.030
  740    H    ALA  97           H        ALA  97 -14.558 -19.832  12.766
  741    HA   ALA  97           HA       ALA  97 -16.443 -21.526  13.989
  742    HB1  ALA  97           3HB      ALA  97 -16.578 -20.176  11.297
  743    HB2  ALA  97           1HB      ALA  97 -17.083 -19.483  12.836
  744    HB3  ALA  97           2HB      ALA  97 -17.942 -20.871  12.170
  745    H    SER  98           H        SER  98 -14.780 -21.809  10.863
  746    HA   SER  98           HA       SER  98 -15.857 -24.490  10.531
  747    HB2  SER  98           1HB      SER  98 -14.030 -22.904   8.708
  748    HB3  SER  98           2HB      SER  98 -14.867 -24.407   8.305
  749    HG   SER  98           HG       SER  98 -16.844 -23.121   8.935
  750    H    GLY  99           H        GLY  99 -14.839 -25.656  12.125
  751    HA2  GLY  99           1HA      GLY  99 -12.752 -27.184  11.879
  752    HA3  GLY  99           2HA      GLY  99 -11.903 -25.668  12.155
  753    H    SER 100           H        SER 100 -10.990 -26.554  14.068
  754    HA   SER 100           HA       SER 100 -12.717 -26.138  16.364
  755    HB2  SER 100           1HB      SER 100 -11.100 -28.690  16.092
  756    HB3  SER 100           2HB      SER 100 -12.130 -28.234  17.449
  757    HG   SER 100           HG       SER 100 -13.721 -28.076  15.442
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1 -15.189   6.449  22.746
    2    H2   MET   1           2H       MET   1 -14.136   5.307  22.064
    3    H3   MET   1           3H       MET   1 -15.616   4.807  22.724
    4    HA   MET   1           HA       MET   1 -15.695   4.827  20.321
    5    HB2  MET   1           1HB      MET   1 -17.735   5.307  21.642
    6    HB3  MET   1           2HB      MET   1 -17.360   7.024  21.581
    7    HG2  MET   1           1HG      MET   1 -17.650   7.053  19.194
    8    HG3  MET   1           2HG      MET   1 -17.872   5.304  19.164
    9    HE1  MET   1           3HE      MET   1 -19.352   8.736  20.316
   10    HE2  MET   1           1HE      MET   1 -19.332   7.838  21.833
   11    HE3  MET   1           2HE      MET   1 -20.869   8.254  21.073
   12    H    GLU   2           H        GLU   2 -14.707   5.581  18.596
   13    HA   GLU   2           HA       GLU   2 -13.108   7.946  18.760
   14    HB2  GLU   2           1HB      GLU   2 -13.695   6.134  16.412
   15    HB3  GLU   2           2HB      GLU   2 -12.474   7.400  16.425
   16    HG2  GLU   2           1HG      GLU   2 -11.313   6.239  18.249
   17    HG3  GLU   2           2HG      GLU   2 -12.525   4.961  18.187
   18    H    VAL   3           H        VAL   3 -14.334   9.752  18.944
   19    HA   VAL   3           HA       VAL   3 -15.976  10.445  16.597
   20    HB   VAL   3           HB       VAL   3 -17.114  12.115  18.033
   21   HG11  VAL   3          1HG1      VAL   3 -17.260   9.274  19.033
   22   HG12  VAL   3          2HG1      VAL   3 -18.152   9.956  17.672
   23   HG13  VAL   3          3HG1      VAL   3 -18.478  10.519  19.313
   24   HG21  VAL   3          3HG2      VAL   3 -16.887  11.969  20.476
   25   HG22  VAL   3          1HG2      VAL   3 -15.379  12.457  19.702
   26   HG23  VAL   3          2HG2      VAL   3 -15.580  10.801  20.274
   27    H    GLN   4           H        GLN   4 -15.813  12.630  15.834
   28    HA   GLN   4           HA       GLN   4 -14.704  14.479  15.146
   29    HB2  GLN   4           1HB      GLN   4 -13.247  14.270  17.791
   30    HB3  GLN   4           2HB      GLN   4 -13.231  15.665  16.720
   31    HG2  GLN   4           1HG      GLN   4 -15.616  15.968  17.041
   32    HG3  GLN   4           2HG      GLN   4 -15.676  14.535  18.065
   33   HE21  GLN   4          2HE2      GLN   4 -16.424  17.266  18.679
   34   HE22  GLN   4          1HE2      GLN   4 -15.443  17.746  20.026
   35    H    SER   5           H        SER   5 -13.652  13.820  13.406
   36    HA   SER   5           HA       SER   5 -11.641  11.872  13.332
   37    HB2  SER   5           1HB      SER   5 -12.268  14.012  11.289
   38    HB3  SER   5           2HB      SER   5 -11.382  12.516  10.988
   39    HG   SER   5           HG       SER   5 -13.198  11.348  11.263
   40    H    MET   6           H        MET   6  -9.483  11.915  13.389
   41    HA   MET   6           HA       MET   6  -8.094  14.344  14.093
   42    HB2  MET   6           1HB      MET   6  -7.100  11.562  13.442
   43    HB3  MET   6           2HB      MET   6  -6.051  12.887  13.929
   44    HG2  MET   6           1HG      MET   6  -7.294  13.035  16.056
   45    HG3  MET   6           2HG      MET   6  -8.240  11.630  15.567
   46    HE1  MET   6           3HE      MET   6  -4.623  12.957  16.359
   47    HE2  MET   6           1HE      MET   6  -4.435  12.190  14.784
   48    HE3  MET   6           2HE      MET   6  -3.670  11.480  16.205
   49    H    LEU   7           H        LEU   7  -8.708  12.453  11.262
   50    HA   LEU   7           HA       LEU   7  -7.057  14.219   9.608
   51    HB2  LEU   7           1HB      LEU   7  -8.658  11.754   8.886
   52    HB3  LEU   7           2HB      LEU   7  -7.623  12.648   7.791
   53    HG   LEU   7           HG       LEU   7  -6.689  11.141  10.236
   54   HD11  LEU   7          1HD1      LEU   7  -5.685   9.598   8.619
   55   HD12  LEU   7          2HD1      LEU   7  -6.444  10.494   7.302
   56   HD13  LEU   7          3HD1      LEU   7  -7.444   9.641   8.479
   57   HD21  LEU   7          3HD2      LEU   7  -5.135  12.569   8.082
   58   HD22  LEU   7          1HD2      LEU   7  -4.441  11.579   9.365
   59   HD23  LEU   7          2HD2      LEU   7  -5.286  13.073   9.765
   60    H    LEU   8           H        LEU   8  -8.732  13.998   7.271
   61    HA   LEU   8           HA       LEU   8 -10.849  15.860   8.022
   62    HB2  LEU   8           1HB      LEU   8  -9.948  14.889   5.302
   63    HB3  LEU   8           2HB      LEU   8 -11.188  16.098   5.579
   64    HG   LEU   8           HG       LEU   8  -8.270  16.379   6.315
   65   HD11  LEU   8          1HD1      LEU   8  -8.224  18.054   4.529
   66   HD12  LEU   8          2HD1      LEU   8  -9.894  17.663   4.122
   67   HD13  LEU   8          3HD1      LEU   8  -8.630  16.454   3.909
   68   HD21  LEU   8          3HD2      LEU   8 -10.548  18.349   6.506
   69   HD22  LEU   8          1HD2      LEU   8  -8.850  18.703   6.821
   70   HD23  LEU   8          2HD2      LEU   8  -9.724  17.579   7.860
   71    H    ASN   9           H        ASN   9 -10.571  12.949   6.015
   72    HA   ASN   9           HA       ASN   9 -13.138  12.023   7.115
   73    HB2  ASN   9           1HB      ASN   9 -12.175  11.769   4.253
   74    HB3  ASN   9           2HB      ASN   9 -13.535  10.869   4.909
   75   HD21  ASN   9          2HD2      ASN   9 -15.092  11.719   3.640
   76   HD22  ASN   9          1HD2      ASN   9 -15.580  13.377   3.682
   77    H    ASP  10           H        ASP  10 -13.081  10.010   7.938
   78    HA   ASP  10           HA       ASP  10 -10.472   8.713   8.007
   79    HB2  ASP  10           1HB      ASP  10 -12.992   8.046   9.550
   80    HB3  ASP  10           2HB      ASP  10 -11.400   7.348   9.818
   81    H    VAL  11           H        VAL  11 -10.001   7.046   6.743
   82    HA   VAL  11           HA       VAL  11 -12.185   5.235   5.999
   83    HB   VAL  11           HB       VAL  11 -11.563   6.496   4.013
   84   HG11  VAL  11          1HG1      VAL  11  -8.773   5.436   4.439
   85   HG12  VAL  11          2HG1      VAL  11  -9.290   7.112   4.612
   86   HG13  VAL  11          3HG1      VAL  11  -9.333   6.337   3.028
   87   HG21  VAL  11          3HG2      VAL  11 -11.033   4.627   2.519
   88   HG22  VAL  11          1HG2      VAL  11 -12.243   4.183   3.723
   89   HG23  VAL  11          2HG2      VAL  11 -10.572   3.649   3.913
   90    H    LYS  12           H        LYS  12 -11.919   3.294   6.792
   91    HA   LYS  12           HA       LYS  12  -9.192   2.309   7.287
   92    HB2  LYS  12           1HB      LYS  12 -11.617   1.917   9.062
   93    HB3  LYS  12           2HB      LYS  12 -10.030   1.201   9.328
   94    HG2  LYS  12           1HG      LYS  12  -9.052   3.394   9.630
   95    HG3  LYS  12           2HG      LYS  12 -10.599   4.160   9.272
   96    HD2  LYS  12           1HD      LYS  12 -11.571   3.071  11.256
   97    HD3  LYS  12           2HD      LYS  12  -9.992   2.367  11.622
   98    HE2  LYS  12           1HE      LYS  12  -9.037   4.608  11.834
   99    HE3  LYS  12           2HE      LYS  12 -10.604   5.319  11.455
  100    HZ1  LYS  12           3HZ      LYS  12  -9.983   3.638  13.826
  101    HZ2  LYS  12           1HZ      LYS  12 -11.504   4.296  13.463
  102    HZ3  LYS  12           2HZ      LYS  12 -10.197   5.317  13.828
  103    H    TRP  13           H        TRP  13  -9.233  -0.172   7.543
  104    HA   TRP  13           HA       TRP  13 -10.689  -1.056   5.173
  105    HB2  TRP  13           1HB      TRP  13  -8.061  -1.637   6.294
  106    HB3  TRP  13           2HB      TRP  13  -8.934  -3.083   5.790
  107    HD1  TRP  13           HD1      TRP  13 -10.214  -2.530   3.195
  108    HE1  TRP  13           HE1      TRP  13  -8.965  -1.732   1.106
  109    HE3  TRP  13           HE3      TRP  13  -6.055  -0.592   5.448
  110    HZ2  TRP  13           HZ2      TRP  13  -6.509  -0.460   0.485
  111    HZ3  TRP  13           HZ3      TRP  13  -4.298   0.388   4.032
  112    HH2  TRP  13           HH2      TRP  13  -4.522   0.452   1.603
  113    H    GLU  14           H        GLU  14 -11.962  -2.770   5.059
  114    HA   GLU  14           HA       GLU  14 -12.997  -3.936   7.491
  115    HB2  GLU  14           1HB      GLU  14 -13.540  -4.532   4.575
  116    HB3  GLU  14           2HB      GLU  14 -14.392  -5.288   5.915
  117    HG2  GLU  14           1HG      GLU  14 -15.249  -3.118   6.603
  118    HG3  GLU  14           2HG      GLU  14 -14.374  -2.348   5.278
  119    H    LYS  15           H        LYS  15 -10.681  -4.642   5.057
  120    HA   LYS  15           HA       LYS  15 -10.002  -7.144   6.434
  121    HB2  LYS  15           1HB      LYS  15  -9.776  -6.581   3.465
  122    HB3  LYS  15           2HB      LYS  15  -9.134  -8.004   4.264
  123    HG2  LYS  15           1HG      LYS  15 -11.100  -8.778   3.347
  124    HG3  LYS  15           2HG      LYS  15 -11.577  -8.407   5.004
  125    HD2  LYS  15           1HD      LYS  15 -12.553  -6.314   4.300
  126    HD3  LYS  15           2HD      LYS  15 -11.959  -6.552   2.655
  127    HE2  LYS  15           1HE      LYS  15 -14.310  -7.103   2.771
  128    HE3  LYS  15           2HE      LYS  15 -13.365  -8.557   2.455
  129    HZ1  LYS  15           3HZ      LYS  15 -14.902  -9.179   4.072
  130    HZ2  LYS  15           1HZ      LYS  15 -14.706  -7.750   4.968
  131    HZ3  LYS  15           2HZ      LYS  15 -13.480  -8.920   4.952
  132    HA   PRO  16           HA       PRO  16  -6.473  -4.441   7.238
  133    HB2  PRO  16           1HB      PRO  16  -5.501  -6.976   8.449
  134    HB3  PRO  16           2HB      PRO  16  -5.572  -5.352   9.141
  135    HG2  PRO  16           1HG      PRO  16  -7.310  -7.215   9.891
  136    HG3  PRO  16           2HG      PRO  16  -7.825  -5.532   9.665
  137    HD2  PRO  16           1HD      PRO  16  -8.223  -7.897   7.873
  138    HD3  PRO  16           2HD      PRO  16  -9.338  -6.566   8.245
  139    H    VAL  17           H        VAL  17  -4.549  -4.151   6.208
  140    HA   VAL  17           HA       VAL  17  -3.906  -6.133   4.148
  141    HB   VAL  17           HB       VAL  17  -3.014  -3.254   4.410
  142   HG11  VAL  17          1HG1      VAL  17  -2.581  -5.222   2.163
  143   HG12  VAL  17          2HG1      VAL  17  -1.342  -4.596   3.249
  144   HG13  VAL  17          3HG1      VAL  17  -2.160  -3.509   2.125
  145   HG21  VAL  17          3HG2      VAL  17  -5.375  -3.420   3.903
  146   HG22  VAL  17          1HG2      VAL  17  -5.043  -4.557   2.595
  147   HG23  VAL  17          2HG2      VAL  17  -4.497  -2.884   2.471
  148    H    THR  18           H        THR  18  -2.292  -7.469   4.467
  149    HA   THR  18           HA       THR  18  -0.268  -6.853   6.484
  150    HB   THR  18           HB       THR  18  -0.840  -9.464   5.066
  151    HG1  THR  18           HG1      THR  18  -2.366  -9.701   6.508
  152   HG21  THR  18          3HG2      THR  18   0.500 -10.466   6.851
  153   HG22  THR  18          1HG2      THR  18   0.824  -8.863   7.515
  154   HG23  THR  18          2HG2      THR  18   1.452  -9.304   5.925
  155    H    ILE  19           H        ILE  19   1.424  -5.779   5.683
  156    HA   ILE  19           HA       ILE  19   2.442  -6.471   3.024
  157    HB   ILE  19           HB       ILE  19   2.936  -4.123   4.848
  158   HG12  ILE  19          1HG1      ILE  19   0.934  -4.100   3.381
  159   HG13  ILE  19          2HG1      ILE  19   2.082  -2.828   2.973
  160   HG21  ILE  19          1HG2      ILE  19   4.434  -4.783   2.313
  161   HG22  ILE  19          2HG2      ILE  19   5.102  -4.773   3.945
  162   HG23  ILE  19          3HG2      ILE  19   4.548  -3.268   3.210
  163   HD11  ILE  19          3HD1      ILE  19   2.881  -4.100   1.099
  164   HD12  ILE  19          1HD1      ILE  19   1.129  -3.915   1.002
  165   HD13  ILE  19          2HD1      ILE  19   1.826  -5.448   1.528
  166    H    SER  20           H        SER  20   3.911  -8.012   2.981
  167    HA   SER  20           HA       SER  20   5.552  -8.608   5.263
  168    HB2  SER  20           1HB      SER  20   6.574 -10.239   3.472
  169    HB3  SER  20           2HB      SER  20   4.963 -10.546   4.124
  170    HG   SER  20           HG       SER  20   5.567  -9.224   1.674
  171    H    LEU  21           H        LEU  21   7.153  -7.241   5.706
  172    HA   LEU  21           HA       LEU  21   8.438  -5.628   3.744
  173    HB2  LEU  21           1HB      LEU  21   9.400  -6.255   6.536
  174    HB3  LEU  21           2HB      LEU  21   9.890  -4.900   5.534
  175    HG   LEU  21           HG       LEU  21   7.130  -5.325   6.682
  176   HD11  LEU  21          1HD1      LEU  21   7.675  -3.353   8.042
  177   HD12  LEU  21          2HD1      LEU  21   9.318  -3.379   7.400
  178   HD13  LEU  21          3HD1      LEU  21   8.736  -4.717   8.391
  179   HD21  LEU  21          3HD2      LEU  21   7.074  -4.203   4.518
  180   HD22  LEU  21          1HD2      LEU  21   8.270  -3.036   5.085
  181   HD23  LEU  21          2HD2      LEU  21   6.668  -3.087   5.824
  182    H    GLN  22           H        GLN  22  10.873  -5.613   3.527
  183    HA   GLN  22           HA       GLN  22  11.704  -8.061   2.399
  184    HB2  GLN  22           1HB      GLN  22  13.249  -5.554   3.056
  185    HB3  GLN  22           2HB      GLN  22  13.922  -6.911   2.161
  186    HG2  GLN  22           1HG      GLN  22  12.197  -6.622   0.445
  187    HG3  GLN  22           2HG      GLN  22  11.562  -5.238   1.334
  188   HE21  GLN  22          2HE2      GLN  22  12.690  -5.437  -1.367
  189   HE22  GLN  22          1HE2      GLN  22  13.990  -4.300  -1.419
  190    H    ASN  23           H        ASN  23  11.759  -6.963   5.596
  191    HA   ASN  23           HA       ASN  23  13.993  -8.588   6.447
  192    HB2  ASN  23           1HB      ASN  23  11.899  -7.084   8.036
  193    HB3  ASN  23           2HB      ASN  23  13.264  -7.934   8.746
  194   HD21  ASN  23          2HD2      ASN  23  14.215  -6.186   9.649
  195   HD22  ASN  23          1HD2      ASN  23  14.921  -4.896   8.738
  196    H    GLY  24           H        GLY  24  11.146  -9.461   5.294
  197    HA2  GLY  24           1HA      GLY  24   9.925 -11.407   5.437
  198    HA3  GLY  24           2HA      GLY  24  11.108 -11.996   6.599
  199    H    ALA  25           H        ALA  25   9.261  -9.043   6.931
  200    HA   ALA  25           HA       ALA  25   7.932 -10.226   9.277
  201    HB1  ALA  25           3HB      ALA  25   8.073  -8.050  10.363
  202    HB2  ALA  25           1HB      ALA  25   8.893  -7.383   8.951
  203    HB3  ALA  25           2HB      ALA  25   9.678  -8.633   9.918
  204    HA   PRO  26           HA       PRO  26   4.259  -8.920   7.025
  205    HB2  PRO  26           1HB      PRO  26   2.792 -10.203   9.184
  206    HB3  PRO  26           2HB      PRO  26   2.901 -10.674   7.488
  207    HG2  PRO  26           1HG      PRO  26   4.015 -12.122   9.497
  208    HG3  PRO  26           2HG      PRO  26   4.675 -12.078   7.853
  209    HD2  PRO  26           1HD      PRO  26   5.572 -10.594  10.297
  210    HD3  PRO  26           2HD      PRO  26   6.544 -11.389   9.039
  211    H    ARG  27           H        ARG  27   3.982  -6.772   7.311
  212    HA   ARG  27           HA       ARG  27   3.288  -5.792   9.992
  213    HB2  ARG  27           1HB      ARG  27   5.183  -4.790   8.538
  214    HB3  ARG  27           2HB      ARG  27   3.883  -4.072   7.598
  215    HG2  ARG  27           1HG      ARG  27   3.117  -2.819   9.469
  216    HG3  ARG  27           2HG      ARG  27   4.216  -3.670  10.558
  217    HD2  ARG  27           1HD      ARG  27   6.110  -2.761   9.166
  218    HD3  ARG  27           2HD      ARG  27   4.920  -1.743   8.356
  219    HE   ARG  27           HE       ARG  27   4.436  -0.927  10.744
  220   HH11  ARG  27          1HH1      ARG  27   7.571  -1.991   9.615
  221   HH12  ARG  27          2HH1      ARG  27   8.465  -0.947  10.674
  222   HH21  ARG  27          1HH2      ARG  27   5.595   0.485  12.133
  223   HH22  ARG  27          2HH2      ARG  27   7.339   0.474  12.095
  224    H    ILE  28           H        ILE  28   1.187  -5.643  10.385
  225    HA   ILE  28           HA       ILE  28  -0.675  -5.649   8.135
  226    HB   ILE  28           HB       ILE  28  -1.210  -6.120  11.073
  227   HG12  ILE  28          1HG1      ILE  28  -0.929  -8.097   8.797
  228   HG13  ILE  28          2HG1      ILE  28   0.268  -7.829  10.060
  229   HG21  ILE  28          1HG2      ILE  28  -3.354  -7.026  10.317
  230   HG22  ILE  28          2HG2      ILE  28  -2.952  -6.594   8.655
  231   HG23  ILE  28          3HG2      ILE  28  -3.175  -5.332   9.864
  232   HD11  ILE  28          3HD1      ILE  28  -1.339  -8.606  11.731
  233   HD12  ILE  28          1HD1      ILE  28  -1.024  -9.824  10.497
  234   HD13  ILE  28          2HD1      ILE  28  -2.520  -8.891  10.451
  235    H    PHE  29           H        PHE  29  -1.826  -3.939   7.570
  236    HA   PHE  29           HA       PHE  29  -2.009  -1.660   9.431
  237    HB2  PHE  29           1HB      PHE  29  -2.580  -1.641   6.461
  238    HB3  PHE  29           2HB      PHE  29  -2.361  -0.251   7.518
  239    HD1  PHE  29           HD2      PHE  29  -0.056   0.055   8.600
  240    HD2  PHE  29           HD1      PHE  29  -0.789  -2.538   5.308
  241    HE1  PHE  29           HE2      PHE  29   2.347   0.065   8.059
  242    HE2  PHE  29           HE1      PHE  29   1.603  -2.534   4.768
  243    HZ   PHE  29           HZ       PHE  29   3.176  -1.237   6.130
  244    H    ASN  30           H        ASN  30  -4.002  -0.780   9.942
  245    HA   ASN  30           HA       ASN  30  -6.297  -2.526   9.310
  246    HB2  ASN  30           1HB      ASN  30  -5.654  -0.813  11.704
  247    HB3  ASN  30           2HB      ASN  30  -7.299  -1.345  11.380
  248   HD21  ASN  30          2HD2      ASN  30  -4.567  -3.346  10.591
  249   HD22  ASN  30          1HD2      ASN  30  -4.829  -4.522  11.829
  250    H    GLY  31           H        GLY  31  -5.012   0.629   8.990
  251    HA2  GLY  31           1HA      GLY  31  -7.577   1.537   7.841
  252    HA3  GLY  31           2HA      GLY  31  -6.579   2.596   8.830
  253    H    VAL  32           H        VAL  32  -7.376   3.157   6.175
  254    HA   VAL  32           HA       VAL  32  -5.366   2.414   4.316
  255    HB   VAL  32           HB       VAL  32  -7.287   4.745   4.171
  256   HG11  VAL  32          1HG1      VAL  32  -6.927   4.608   1.752
  257   HG12  VAL  32          2HG1      VAL  32  -5.730   3.337   2.004
  258   HG13  VAL  32          3HG1      VAL  32  -5.425   4.967   2.607
  259   HG21  VAL  32          3HG2      VAL  32  -8.449   2.619   4.458
  260   HG22  VAL  32          1HG2      VAL  32  -7.543   1.932   3.109
  261   HG23  VAL  32          2HG2      VAL  32  -8.683   3.248   2.827
  262    H    TYR  33           H        TYR  33  -5.699   5.062   6.583
  263    HA   TYR  33           HA       TYR  33  -3.727   6.750   5.507
  264    HB2  TYR  33           1HB      TYR  33  -5.256   7.548   7.243
  265    HB3  TYR  33           2HB      TYR  33  -4.537   6.434   8.407
  266    HD1  TYR  33           HD1      TYR  33  -3.758   9.352   6.242
  267    HD2  TYR  33           HD2      TYR  33  -2.637   7.059   9.644
  268    HE1  TYR  33           HE1      TYR  33  -2.068  11.040   6.811
  269    HE2  TYR  33           HE2      TYR  33  -0.942   8.745  10.226
  270    HH   TYR  33           HH       TYR  33   0.403  10.486   9.005
  271    H    GLU  34           H        GLU  34  -3.502   4.039   7.779
  272    HA   GLU  34           HA       GLU  34  -0.796   4.313   8.470
  273    HB2  GLU  34           1HB      GLU  34  -2.429   1.779   8.188
  274    HB3  GLU  34           2HB      GLU  34  -0.877   1.894   9.001
  275    HG2  GLU  34           1HG      GLU  34  -1.843   3.389  10.660
  276    HG3  GLU  34           2HG      GLU  34  -3.399   3.308   9.830
  277    H    ALA  35           H        ALA  35  -2.381   2.643   5.813
  278    HA   ALA  35           HA       ALA  35  -0.066   1.485   4.689
  279    HB1  ALA  35           3HB      ALA  35  -1.453   1.082   2.738
  280    HB2  ALA  35           1HB      ALA  35  -2.651   2.234   3.327
  281    HB3  ALA  35           2HB      ALA  35  -2.361   0.736   4.210
  282    H    PHE  36           H        PHE  36  -1.838   4.474   3.926
  283    HA   PHE  36           HA       PHE  36  -0.185   5.364   1.846
  284    HB2  PHE  36           1HB      PHE  36  -2.381   6.344   2.262
  285    HB3  PHE  36           2HB      PHE  36  -1.834   6.967   3.815
  286    HD1  PHE  36           HD2      PHE  36  -1.380   7.260   0.160
  287    HD2  PHE  36           HD1      PHE  36  -0.710   9.023   3.975
  288    HE1  PHE  36           HE2      PHE  36  -0.650   9.338  -0.936
  289    HE2  PHE  36           HE1      PHE  36   0.022  11.105   2.889
  290    HZ   PHE  36           HZ       PHE  36   0.058  11.264   0.429
  291    H    ASP  37           H        ASP  37  -0.093   6.091   5.321
  292    HA   ASP  37           HA       ASP  37   2.081   7.847   5.303
  293    HB2  ASP  37           1HB      ASP  37   0.615   7.536   7.255
  294    HB3  ASP  37           2HB      ASP  37   1.242   5.905   7.475
  295    H    PHE  38           H        PHE  38   1.981   4.340   5.743
  296    HA   PHE  38           HA       PHE  38   4.689   3.847   6.105
  297    HB2  PHE  38           1HB      PHE  38   3.104   2.109   6.492
  298    HB3  PHE  38           2HB      PHE  38   2.494   2.203   4.845
  299    HD1  PHE  38           HD1      PHE  38   5.632   1.458   6.715
  300    HD2  PHE  38           HD2      PHE  38   3.217   0.681   3.300
  301    HE1  PHE  38           HE1      PHE  38   7.168  -0.343   6.041
  302    HE2  PHE  38           HE2      PHE  38   4.748  -1.116   2.621
  303    HZ   PHE  38           HZ       PHE  38   6.721  -1.632   3.988
  304    H    LEU  39           H        LEU  39   2.831   3.995   3.074
  305    HA   LEU  39           HA       LEU  39   4.910   3.312   1.323
  306    HB2  LEU  39           1HB      LEU  39   2.528   5.102   0.834
  307    HB3  LEU  39           2HB      LEU  39   3.557   4.437  -0.418
  308    HG   LEU  39           HG       LEU  39   1.853   2.813   1.466
  309   HD11  LEU  39          1HD1      LEU  39   1.460   3.499  -1.443
  310   HD12  LEU  39          2HD1      LEU  39   0.514   4.122  -0.091
  311   HD13  LEU  39          3HD1      LEU  39   0.455   2.405  -0.492
  312   HD21  LEU  39          3HD2      LEU  39   3.442   1.988  -0.963
  313   HD22  LEU  39          1HD2      LEU  39   2.401   0.943   0.005
  314   HD23  LEU  39          2HD2      LEU  39   3.863   1.633   0.713
  315    H    GLN  40           H        GLN  40   3.909   6.444   2.607
  316    HA   GLN  40           HA       GLN  40   5.740   7.880   0.918
  317    HB2  GLN  40           1HB      GLN  40   3.554   8.812   1.664
  318    HB3  GLN  40           2HB      GLN  40   4.171   8.866   3.309
  319    HG2  GLN  40           1HG      GLN  40   5.928  10.424   2.568
  320    HG3  GLN  40           2HG      GLN  40   5.233  10.402   0.949
  321   HE21  GLN  40          2HE2      GLN  40   5.591  12.638   2.804
  322   HE22  GLN  40          1HE2      GLN  40   4.006  13.301   3.047
  323    H    HIS  41           H        HIS  41   5.806   6.527   4.114
  324    HA   HIS  41           HA       HIS  41   8.098   8.062   4.948
  325    HB2  HIS  41           1HB      HIS  41   6.560   5.788   6.156
  326    HB3  HIS  41           2HB      HIS  41   8.128   6.244   6.811
  327    HD1  HIS  41           HD1      HIS  41   7.796   7.613   8.820
  328    HD2  HIS  41           HD2      HIS  41   4.969   8.464   5.898
  329    HE1  HIS  41           HE1      HIS  41   6.333   9.417   9.791
  330    HE2  HIS  41           HE2      HIS  41   4.439   9.626   8.138
  331    H    GLU  42           H        GLU  42   7.644   4.542   4.403
  332    HA   GLU  42           HA       GLU  42  10.250   4.447   3.149
  333    HB2  GLU  42           1HB      GLU  42  10.713   4.306   5.598
  334    HB3  GLU  42           2HB      GLU  42   9.747   2.839   5.658
  335    HG2  GLU  42           1HG      GLU  42  11.293   1.682   4.251
  336    HG3  GLU  42           2HG      GLU  42  12.192   3.166   3.939
  337    H    TRP  43           H        TRP  43   8.762   3.863   1.434
  338    HA   TRP  43           HA       TRP  43   7.828   1.099   1.512
  339    HB2  TRP  43           1HB      TRP  43   6.398   2.780   0.447
  340    HB3  TRP  43           2HB      TRP  43   7.698   3.211  -0.656
  341    HD1  TRP  43           HD1      TRP  43   7.070   2.386  -2.970
  342    HE1  TRP  43           HE1      TRP  43   6.065   0.241  -3.970
  343    HE3  TRP  43           HE3      TRP  43   6.202  -0.206   1.353
  344    HZ2  TRP  43           HZ2      TRP  43   5.045  -2.222  -3.055
  345    HZ3  TRP  43           HZ3      TRP  43   5.209  -2.451   1.198
  346    HH2  TRP  43           HH2      TRP  43   4.643  -3.436  -0.961
  347    HA   PRO  44           HA       PRO  44  11.979  -0.014   0.191
  348    HB2  PRO  44           1HB      PRO  44  10.900  -2.746   0.143
  349    HB3  PRO  44           2HB      PRO  44  12.202  -2.070   1.123
  350    HG2  PRO  44           1HG      PRO  44   9.835  -2.723   2.195
  351    HG3  PRO  44           2HG      PRO  44  10.759  -1.318   2.759
  352    HD2  PRO  44           1HD      PRO  44   8.399  -1.417   0.918
  353    HD3  PRO  44           2HD      PRO  44   8.740  -0.297   2.255
  354    H    ALA  45           H        ALA  45   9.650   0.445  -1.822
  355    HA   ALA  45           HA       ALA  45  11.060  -0.873  -4.032
  356    HB1  ALA  45           3HB      ALA  45   8.053  -0.666  -3.846
  357    HB2  ALA  45           1HB      ALA  45   8.989  -2.144  -3.613
  358    HB3  ALA  45           2HB      ALA  45   8.976  -1.347  -5.186
  359    H    ARG  46           H        ARG  46  11.838   0.671  -5.315
  360    HA   ARG  46           HA       ARG  46  10.534   3.299  -5.202
  361    HB2  ARG  46           1HB      ARG  46  13.384   2.675  -5.969
  362    HB3  ARG  46           2HB      ARG  46  12.676   4.274  -5.796
  363    HG2  ARG  46           1HG      ARG  46  12.301   3.802  -3.398
  364    HG3  ARG  46           2HG      ARG  46  13.138   2.261  -3.606
  365    HD2  ARG  46           1HD      ARG  46  14.247   5.041  -3.894
  366    HD3  ARG  46           2HD      ARG  46  14.751   3.776  -2.773
  367    HE   ARG  46           HE       ARG  46  15.266   3.801  -5.680
  368   HH11  ARG  46          1HH1      ARG  46  15.994   2.657  -2.446
  369   HH12  ARG  46          2HH1      ARG  46  17.424   1.789  -2.937
  370   HH21  ARG  46          1HH2      ARG  46  17.138   2.671  -6.331
  371   HH22  ARG  46          2HH2      ARG  46  18.064   1.781  -5.159
  372    H    GLY  47           H        GLY  47  10.465   4.591  -7.058
  373    HA2  GLY  47           1HA      GLY  47  11.369   4.003  -9.596
  374    HA3  GLY  47           2HA      GLY  47   9.777   3.258  -9.474
  375    H    ASP  48           H        ASP  48   7.997   4.496  -9.592
  376    HA   ASP  48           HA       ASP  48   7.671   7.087  -8.715
  377    HB2  ASP  48           1HB      ASP  48   7.716   8.490 -10.663
  378    HB3  ASP  48           2HB      ASP  48   9.276   7.690 -10.548
  379    H    ARG  49           H        ARG  49   6.814   5.023 -11.472
  380    HA   ARG  49           HA       ARG  49   4.153   5.861 -11.682
  381    HB2  ARG  49           1HB      ARG  49   5.555   3.338 -12.533
  382    HB3  ARG  49           2HB      ARG  49   3.848   3.614 -12.863
  383    HG2  ARG  49           1HG      ARG  49   4.333   5.531 -14.190
  384    HG3  ARG  49           2HG      ARG  49   6.027   5.507 -13.709
  385    HD2  ARG  49           1HD      ARG  49   4.694   3.282 -15.240
  386    HD3  ARG  49           2HD      ARG  49   5.542   4.621 -16.012
  387    HE   ARG  49           HE       ARG  49   6.708   2.347 -14.680
  388   HH11  ARG  49          1HH1      ARG  49   7.228   5.652 -15.743
  389   HH12  ARG  49          2HH1      ARG  49   8.963   5.502 -15.771
  390   HH21  ARG  49          1HH2      ARG  49   8.968   2.144 -14.730
  391   HH22  ARG  49          2HH2      ARG  49   9.953   3.495 -15.194
  392    H    ALA  50           H        ALA  50   5.230   2.705 -10.347
  393    HA   ALA  50           HA       ALA  50   2.712   2.077  -9.267
  394    HB1  ALA  50           3HB      ALA  50   5.422   1.087  -8.395
  395    HB2  ALA  50           1HB      ALA  50   4.425   0.394  -9.674
  396    HB3  ALA  50           2HB      ALA  50   3.873   0.341  -7.999
  397    H    HIS  51           H        HIS  51   5.429   3.843  -7.950
  398    HA   HIS  51           HA       HIS  51   4.610   3.858  -5.245
  399    HB2  HIS  51           1HB      HIS  51   6.905   4.472  -6.215
  400    HB3  HIS  51           2HB      HIS  51   6.206   6.043  -6.586
  401    HD1  HIS  51           HD1      HIS  51   7.667   4.058  -3.848
  402    HD2  HIS  51           HD2      HIS  51   5.534   7.604  -4.258
  403    HE1  HIS  51           HE1      HIS  51   7.943   5.269  -1.662
  404    HE2  HIS  51           HE2      HIS  51   6.760   7.472  -1.978
  405    H    GLU  52           H        GLU  52   4.100   6.133  -7.925
  406    HA   GLU  52           HA       GLU  52   2.578   8.007  -6.457
  407    HB2  GLU  52           1HB      GLU  52   3.606   8.630  -8.555
  408    HB3  GLU  52           2HB      GLU  52   2.682   7.405  -9.415
  409    HG2  GLU  52           1HG      GLU  52   0.608   8.619  -8.779
  410    HG3  GLU  52           2HG      GLU  52   1.620   9.896  -8.106
  411    H    GLN  53           H        GLN  53   1.654   5.294  -8.557
  412    HA   GLN  53           HA       GLN  53  -1.101   5.651  -8.546
  413    HB2  GLN  53           1HB      GLN  53   0.439   3.047  -8.584
  414    HB3  GLN  53           2HB      GLN  53  -1.253   3.226  -9.027
  415    HG2  GLN  53           1HG      GLN  53  -0.654   4.636 -10.892
  416    HG3  GLN  53           2HG      GLN  53   1.041   4.588 -10.417
  417   HE21  GLN  53          2HE2      GLN  53  -0.155   3.794 -12.923
  418   HE22  GLN  53          1HE2      GLN  53   0.247   2.127 -13.148
  419    H    ALA  54           H        ALA  54   0.868   3.682  -6.331
  420    HA   ALA  54           HA       ALA  54  -1.213   2.766  -4.710
  421    HB1  ALA  54           3HB      ALA  54   1.641   3.296  -3.905
  422    HB2  ALA  54           1HB      ALA  54   1.052   1.832  -4.692
  423    HB3  ALA  54           2HB      ALA  54   0.496   2.245  -3.070
  424    H    LEU  55           H        LEU  55   0.747   5.708  -4.456
  425    HA   LEU  55           HA       LEU  55  -0.307   6.560  -1.973
  426    HB2  LEU  55           1HB      LEU  55   0.971   8.108  -4.222
  427    HB3  LEU  55           2HB      LEU  55   0.544   8.813  -2.676
  428    HG   LEU  55           HG       LEU  55   2.542   6.586  -3.087
  429   HD11  LEU  55          1HD1      LEU  55   4.200   8.275  -2.468
  430   HD12  LEU  55          2HD1      LEU  55   2.932   9.499  -2.410
  431   HD13  LEU  55          3HD1      LEU  55   3.341   8.724  -3.940
  432   HD21  LEU  55          3HD2      LEU  55   1.765   8.121  -0.609
  433   HD22  LEU  55          1HD2      LEU  55   3.085   6.957  -0.724
  434   HD23  LEU  55          2HD2      LEU  55   1.417   6.422  -0.932
  435    H    ARG  56           H        ARG  56  -1.204   7.306  -5.334
  436    HA   ARG  56           HA       ARG  56  -3.147   9.246  -4.651
  437    HB2  ARG  56           1HB      ARG  56  -2.100   8.961  -6.923
  438    HB3  ARG  56           2HB      ARG  56  -3.121   7.547  -7.148
  439    HG2  ARG  56           1HG      ARG  56  -5.111   8.897  -6.992
  440    HG3  ARG  56           2HG      ARG  56  -4.150  10.326  -6.612
  441    HD2  ARG  56           1HD      ARG  56  -4.710  10.504  -8.892
  442    HD3  ARG  56           2HD      ARG  56  -3.022  10.004  -8.848
  443    HE   ARG  56           HE       ARG  56  -4.647   7.715  -9.028
  444   HH11  ARG  56          1HH1      ARG  56  -3.651  10.473 -10.946
  445   HH12  ARG  56          2HH1      ARG  56  -3.919   9.674 -12.462
  446   HH21  ARG  56          1HH2      ARG  56  -4.986   6.661 -11.039
  447   HH22  ARG  56          2HH2      ARG  56  -4.680   7.528 -12.519
  448    H    LEU  57           H        LEU  57  -3.294   5.761  -5.098
  449    HA   LEU  57           HA       LEU  57  -6.075   5.436  -5.052
  450    HB2  LEU  57           1HB      LEU  57  -3.887   3.620  -4.047
  451    HB3  LEU  57           2HB      LEU  57  -5.565   3.139  -4.205
  452    HG   LEU  57           HG       LEU  57  -3.850   4.060  -6.511
  453   HD11  LEU  57          1HD1      LEU  57  -4.586   1.266  -5.656
  454   HD12  LEU  57          2HD1      LEU  57  -2.977   1.985  -5.592
  455   HD13  LEU  57          3HD1      LEU  57  -3.756   1.702  -7.149
  456   HD21  LEU  57          3HD2      LEU  57  -5.635   3.132  -7.882
  457   HD22  LEU  57          1HD2      LEU  57  -6.255   4.396  -6.819
  458   HD23  LEU  57          2HD2      LEU  57  -6.540   2.699  -6.431
  459    H    CYS  58           H        CYS  58  -3.724   5.384  -2.385
  460    HA   CYS  58           HA       CYS  58  -5.645   4.989  -0.345
  461    HB2  CYS  58           1HB      CYS  58  -2.917   6.268  -0.092
  462    HB3  CYS  58           2HB      CYS  58  -3.855   5.523   1.198
  463    HG   CYS  58           HG       CYS  58  -2.248   3.971  -1.384
  464    H    ARG  59           H        ARG  59  -4.379   7.819  -1.936
  465    HA   ARG  59           HA       ARG  59  -5.449   9.742  -0.133
  466    HB2  ARG  59           1HB      ARG  59  -3.653  10.399  -1.561
  467    HB3  ARG  59           2HB      ARG  59  -4.514   9.874  -2.997
  468    HG2  ARG  59           1HG      ARG  59  -6.034  11.704  -2.846
  469    HG3  ARG  59           2HG      ARG  59  -5.402  12.164  -1.262
  470    HD2  ARG  59           1HD      ARG  59  -3.351  12.868  -2.165
  471    HD3  ARG  59           2HD      ARG  59  -3.650  12.051  -3.698
  472    HE   ARG  59           HE       ARG  59  -5.247  13.761  -4.237
  473   HH11  ARG  59          1HH1      ARG  59  -3.399  14.407  -1.327
  474   HH12  ARG  59          2HH1      ARG  59  -3.549  16.134  -1.475
  475   HH21  ARG  59          1HH2      ARG  59  -5.378  16.029  -4.454
  476   HH22  ARG  59          2HH2      ARG  59  -4.644  17.051  -3.255
  477    H    ALA  60           H        ALA  60  -6.625   8.189  -3.074
  478    HA   ALA  60           HA       ALA  60  -8.964   9.739  -3.379
  479    HB1  ALA  60           3HB      ALA  60  -9.725   7.963  -4.868
  480    HB2  ALA  60           1HB      ALA  60  -8.440   6.909  -4.277
  481    HB3  ALA  60           2HB      ALA  60  -8.037   8.370  -5.179
  482    H    SER  61           H        SER  61  -8.312   6.734  -1.609
  483    HA   SER  61           HA       SER  61 -10.977   6.256  -0.819
  484    HB2  SER  61           1HB      SER  61  -9.617   5.112   1.189
  485    HB3  SER  61           2HB      SER  61  -9.717   4.394  -0.418
  486    HG   SER  61           HG       SER  61  -7.610   5.937   0.682
  487    H    LEU  62           H        LEU  62  -8.430   8.272   0.562
  488    HA   LEU  62           HA       LEU  62  -9.811   8.944   2.952
  489    HB2  LEU  62           1HB      LEU  62  -7.591  10.259   1.412
  490    HB3  LEU  62           2HB      LEU  62  -8.278  11.011   2.836
  491    HG   LEU  62           HG       LEU  62  -7.053   8.253   2.844
  492   HD11  LEU  62          1HD1      LEU  62  -5.823  10.887   3.654
  493   HD12  LEU  62          2HD1      LEU  62  -5.369   9.923   2.248
  494   HD13  LEU  62          3HD1      LEU  62  -5.101   9.293   3.873
  495   HD21  LEU  62          3HD2      LEU  62  -8.643   8.651   4.644
  496   HD22  LEU  62          1HD2      LEU  62  -7.826  10.160   5.056
  497   HD23  LEU  62          2HD2      LEU  62  -6.997   8.619   5.279
  498    H    MET  63           H        MET  63 -10.197   9.880  -0.306
  499    HA   MET  63           HA       MET  63 -11.752  12.258   0.387
  500    HB2  MET  63           1HB      MET  63 -11.018  11.104  -2.313
  501    HB3  MET  63           2HB      MET  63 -11.884  12.612  -2.054
  502    HG2  MET  63           1HG      MET  63  -9.943  13.537  -0.907
  503    HG3  MET  63           2HG      MET  63  -9.075  12.024  -1.150
  504    HE1  MET  63           3HE      MET  63 -10.657  15.164  -2.847
  505    HE2  MET  63           1HE      MET  63 -11.499  13.851  -3.670
  506    HE3  MET  63           2HE      MET  63 -10.353  14.860  -4.557
  507    H    GLY  64           H        GLY  64 -12.309   9.083   0.417
  508    HA2  GLY  64           1HA      GLY  64 -14.276   7.889   0.528
  509    HA3  GLY  64           2HA      GLY  64 -15.147   9.381   0.212
  510    H    ASP  65           H        ASP  65 -12.647   8.239  -1.930
  511    HA   ASP  65           HA       ASP  65 -14.681   7.893  -4.016
  512    HB2  ASP  65           1HB      ASP  65 -12.543   9.386  -4.207
  513    HB3  ASP  65           2HB      ASP  65 -11.718   7.861  -4.512
  514    H    VAL  66           H        VAL  66 -11.653   6.337  -2.995
  515    HA   VAL  66           HA       VAL  66 -12.478   3.816  -4.177
  516    HB   VAL  66           HB       VAL  66  -9.948   4.577  -2.699
  517   HG11  VAL  66          1HG1      VAL  66  -9.023   2.476  -3.516
  518   HG12  VAL  66          2HG1      VAL  66 -10.583   2.054  -4.222
  519   HG13  VAL  66          3HG1      VAL  66 -10.415   2.192  -2.472
  520   HG21  VAL  66          3HG2      VAL  66  -8.915   4.485  -4.927
  521   HG22  VAL  66          1HG2      VAL  66 -10.175   5.713  -4.831
  522   HG23  VAL  66          2HG2      VAL  66 -10.499   4.180  -5.638
  523    H    ALA  67           H        ALA  67 -13.294   2.113  -3.065
  524    HA   ALA  67           HA       ALA  67 -13.599   2.481  -0.159
  525    HB1  ALA  67           3HB      ALA  67 -15.749   1.371  -0.331
  526    HB2  ALA  67           1HB      ALA  67 -15.508   1.134  -2.063
  527    HB3  ALA  67           2HB      ALA  67 -15.686   2.764  -1.411
  528    H    GLY  68           H        GLY  68 -12.360   1.132   0.917
  529    HA2  GLY  68           1HA      GLY  68 -11.548  -0.821   1.789
  530    HA3  GLY  68           2HA      GLY  68 -13.095  -1.475   1.294
  531    H    GLU  69           H        GLU  69 -13.196  -2.884  -0.346
  532    HA   GLU  69           HA       GLU  69 -10.962  -4.478  -0.821
  533    HB2  GLU  69           1HB      GLU  69 -13.689  -4.320  -2.055
  534    HB3  GLU  69           2HB      GLU  69 -12.490  -5.441  -2.688
  535    HG2  GLU  69           1HG      GLU  69 -13.273  -5.372   0.207
  536    HG3  GLU  69           2HG      GLU  69 -14.115  -6.355  -0.991
  537    H    ILE  70           H        ILE  70 -12.272  -1.832  -2.722
  538    HA   ILE  70           HA       ILE  70 -10.898  -2.327  -5.123
  539    HB   ILE  70           HB       ILE  70 -11.575   0.377  -3.949
  540   HG12  ILE  70          1HG1      ILE  70 -13.203  -1.392  -5.794
  541   HG13  ILE  70          2HG1      ILE  70 -13.544  -1.119  -4.087
  542   HG21  ILE  70          1HG2      ILE  70 -11.596   1.099  -6.311
  543   HG22  ILE  70          2HG2      ILE  70 -11.019  -0.501  -6.779
  544   HG23  ILE  70          3HG2      ILE  70 -10.009   0.542  -5.778
  545   HD11  ILE  70          3HD1      ILE  70 -13.568   0.981  -6.242
  546   HD12  ILE  70          1HD1      ILE  70 -13.932   1.240  -4.536
  547   HD13  ILE  70          2HD1      ILE  70 -14.984   0.219  -5.516
  548    H    ALA  71           H        ALA  71  -9.989  -0.434  -2.267
  549    HA   ALA  71           HA       ALA  71  -7.417   0.288  -3.256
  550    HB1  ALA  71           3HB      ALA  71  -6.977   1.069  -0.986
  551    HB2  ALA  71           1HB      ALA  71  -8.440   0.269  -0.417
  552    HB3  ALA  71           2HB      ALA  71  -8.556   1.618  -1.545
  553    H    ARG  72           H        ARG  72  -8.681  -2.302  -1.254
  554    HA   ARG  72           HA       ARG  72  -6.275  -3.411  -0.352
  555    HB2  ARG  72           1HB      ARG  72  -8.087  -4.313   0.736
  556    HB3  ARG  72           2HB      ARG  72  -9.064  -4.390  -0.720
  557    HG2  ARG  72           1HG      ARG  72  -8.608  -6.611   0.036
  558    HG3  ARG  72           2HG      ARG  72  -7.739  -6.334  -1.470
  559    HD2  ARG  72           1HD      ARG  72  -6.166  -7.418  -0.168
  560    HD3  ARG  72           2HD      ARG  72  -5.753  -5.723   0.068
  561    HE   ARG  72           HE       ARG  72  -6.460  -5.868   2.271
  562   HH11  ARG  72          1HH1      ARG  72  -7.392  -8.778   0.572
  563   HH12  ARG  72          2HH1      ARG  72  -7.512  -9.732   2.015
  564   HH21  ARG  72          1HH2      ARG  72  -6.602  -7.148   4.184
  565   HH22  ARG  72          2HH2      ARG  72  -7.056  -8.828   4.058
  566    H    THR  73           H        THR  73  -8.206  -4.298  -3.219
  567    HA   THR  73           HA       THR  73  -6.385  -6.281  -4.095
  568    HB   THR  73           HB       THR  73  -8.377  -4.828  -5.840
  569    HG1  THR  73           HG1      THR  73  -9.678  -5.489  -4.229
  570   HG21  THR  73          3HG2      THR  73  -7.328  -7.661  -5.860
  571   HG22  THR  73          1HG2      THR  73  -6.867  -6.384  -6.985
  572   HG23  THR  73          2HG2      THR  73  -8.521  -6.996  -6.976
  573    H    ALA  74           H        ALA  74  -6.755  -2.854  -4.809
  574    HA   ALA  74           HA       ALA  74  -4.911  -2.818  -6.985
  575    HB1  ALA  74           3HB      ALA  74  -5.054  -0.386  -6.798
  576    HB2  ALA  74           1HB      ALA  74  -5.917  -0.553  -5.268
  577    HB3  ALA  74           2HB      ALA  74  -6.654  -1.130  -6.763
  578    H    PHE  75           H        PHE  75  -4.653  -2.316  -3.514
  579    HA   PHE  75           HA       PHE  75  -2.059  -1.229  -3.443
  580    HB2  PHE  75           1HB      PHE  75  -3.854  -1.511  -1.556
  581    HB3  PHE  75           2HB      PHE  75  -3.083  -3.072  -1.301
  582    HD1  PHE  75           HD2      PHE  75  -0.794  -3.206  -0.459
  583    HD2  PHE  75           HD1      PHE  75  -2.759   0.532  -0.981
  584    HE1  PHE  75           HE2      PHE  75   0.910  -2.116   0.941
  585    HE2  PHE  75           HE1      PHE  75  -1.058   1.624   0.419
  586    HZ   PHE  75           HZ       PHE  75   0.778   0.300   1.381
  587    H    VAL  76           H        VAL  76  -3.240  -4.557  -3.391
  588    HA   VAL  76           HA       VAL  76  -0.722  -5.814  -3.131
  589    HB   VAL  76           HB       VAL  76  -3.268  -6.860  -4.391
  590   HG11  VAL  76          1HG1      VAL  76  -1.356  -8.153  -5.143
  591   HG12  VAL  76          2HG1      VAL  76  -2.320  -9.093  -4.006
  592   HG13  VAL  76          3HG1      VAL  76  -0.809  -8.352  -3.479
  593   HG21  VAL  76          3HG2      VAL  76  -2.147  -7.195  -1.608
  594   HG22  VAL  76          1HG2      VAL  76  -3.595  -7.985  -2.236
  595   HG23  VAL  76          2HG2      VAL  76  -3.555  -6.231  -2.059
  596    H    ALA  77           H        ALA  77  -2.590  -4.730  -5.916
  597    HA   ALA  77           HA       ALA  77  -0.976  -5.858  -7.933
  598    HB1  ALA  77           3HB      ALA  77  -2.029  -4.236  -9.433
  599    HB2  ALA  77           1HB      ALA  77  -2.668  -3.360  -8.041
  600    HB3  ALA  77           2HB      ALA  77  -3.218  -5.002  -8.379
  601    H    ALA  78           H        ALA  78  -0.775  -2.796  -6.184
  602    HA   ALA  78           HA       ALA  78   1.370  -1.742  -7.746
  603    HB1  ALA  78           3HB      ALA  78   0.499  -1.007  -4.952
  604    HB2  ALA  78           1HB      ALA  78  -0.126  -0.304  -6.444
  605    HB3  ALA  78           2HB      ALA  78   1.562  -0.059  -5.993
  606    H    SER  79           H        SER  79   1.162  -3.576  -4.749
  607    HA   SER  79           HA       SER  79   3.962  -3.424  -4.179
  608    HB2  SER  79           1HB      SER  79   1.900  -5.345  -3.072
  609    HB3  SER  79           2HB      SER  79   3.463  -4.947  -2.357
  610    HG   SER  79           HG       SER  79   1.167  -3.310  -2.615
  611    H    ARG  80           H        ARG  80   2.161  -5.168  -6.389
  612    HA   ARG  80           HA       ARG  80   3.394  -7.695  -6.358
  613    HB2  ARG  80           1HB      ARG  80   1.275  -7.192  -7.506
  614    HB3  ARG  80           2HB      ARG  80   2.142  -6.201  -8.668
  615    HG2  ARG  80           1HG      ARG  80   3.328  -8.154  -9.484
  616    HG3  ARG  80           2HG      ARG  80   2.517  -9.163  -8.281
  617    HD2  ARG  80           1HD      ARG  80   0.362  -8.654  -9.277
  618    HD3  ARG  80           2HD      ARG  80   1.135  -7.584 -10.445
  619    HE   ARG  80           HE       ARG  80   2.394  -9.876 -10.959
  620   HH11  ARG  80          1HH1      ARG  80  -1.015  -9.204 -10.477
  621   HH12  ARG  80          2HH1      ARG  80  -1.545 -10.505 -11.505
  622   HH21  ARG  80          1HH2      ARG  80   1.705 -11.548 -12.340
  623   HH22  ARG  80          2HH2      ARG  80   0.005 -11.826 -12.591
  624    H    GLN  81           H        GLN  81   4.427  -4.623  -7.600
  625    HA   GLN  81           HA       GLN  81   6.335  -5.534  -9.477
  626    HB2  GLN  81           1HB      GLN  81   5.485  -3.213  -9.395
  627    HB3  GLN  81           2HB      GLN  81   6.334  -2.967  -7.876
  628    HG2  GLN  81           1HG      GLN  81   8.466  -3.288  -8.989
  629    HG3  GLN  81           2HG      GLN  81   7.641  -3.612 -10.512
  630   HE21  GLN  81          2HE2      GLN  81   9.594  -1.544  -9.833
  631   HE22  GLN  81          1HE2      GLN  81   8.819  -0.038 -10.186
  632    H    ALA  82           H        ALA  82   6.365  -5.282  -6.016
  633    HA   ALA  82           HA       ALA  82   9.249  -5.579  -5.837
  634    HB1  ALA  82           3HB      ALA  82   8.096  -4.162  -4.219
  635    HB2  ALA  82           1HB      ALA  82   8.896  -5.514  -3.418
  636    HB3  ALA  82           2HB      ALA  82   7.151  -5.546  -3.670
  637    H    HIS  83           H        HIS  83   6.429  -7.535  -5.859
  638    HA   HIS  83           HA       HIS  83   6.073  -9.770  -5.850
  639    HB2  HIS  83           1HB      HIS  83   9.063  -9.859  -6.274
  640    HB3  HIS  83           2HB      HIS  83   8.019 -11.273  -6.355
  641    HD1  HIS  83           HD1      HIS  83   5.935 -10.907  -8.184
  642    HD2  HIS  83           HD2      HIS  83   9.421  -8.693  -8.693
  643    HE1  HIS  83           HE1      HIS  83   5.914 -10.150 -10.581
  644    HE2  HIS  83           HE2      HIS  83   8.076  -8.899 -10.900
  645    H    CYS  84           H        CYS  84   6.735  -8.325  -3.333
  646    HA   CYS  84           HA       CYS  84   7.403 -10.686  -1.713
  647    HB2  CYS  84           1HB      CYS  84   9.104  -8.846  -1.575
  648    HB3  CYS  84           2HB      CYS  84   7.849  -7.789  -0.942
  649    HG   CYS  84           HG       CYS  84   7.959  -8.554   1.519
  650    H    LEU  85           H        LEU  85   5.137 -11.158  -1.953
  651    HA   LEU  85           HA       LEU  85   3.321  -9.357  -0.506
  652    HB2  LEU  85           1HB      LEU  85   2.709 -11.509  -2.536
  653    HB3  LEU  85           2HB      LEU  85   1.515 -10.501  -1.741
  654    HG   LEU  85           HG       LEU  85   3.685  -9.462  -3.565
  655   HD11  LEU  85          1HD1      LEU  85   2.071 -10.857  -4.767
  656   HD12  LEU  85          2HD1      LEU  85   1.926  -9.156  -5.207
  657   HD13  LEU  85          3HD1      LEU  85   0.753  -9.887  -4.113
  658   HD21  LEU  85          3HD2      LEU  85   1.265  -8.129  -2.358
  659   HD22  LEU  85          1HD2      LEU  85   2.375  -7.395  -3.517
  660   HD23  LEU  85          2HD2      LEU  85   2.946  -7.840  -1.907
  661    H    MET  86           H        MET  86   1.527 -10.418   0.658
  662    HA   MET  86           HA       MET  86   2.214 -13.063   1.725
  663    HB2  MET  86           1HB      MET  86   2.059 -10.541   3.188
  664    HB3  MET  86           2HB      MET  86   0.992 -11.772   3.851
  665    HG2  MET  86           1HG      MET  86   3.935 -12.141   3.351
  666    HG3  MET  86           2HG      MET  86   3.219 -11.726   4.906
  667    HE1  MET  86           3HE      MET  86   0.566 -13.451   4.943
  668    HE2  MET  86           1HE      MET  86   1.673 -13.343   6.311
  669    HE3  MET  86           2HE      MET  86   1.126 -14.921   5.742
  670    H    GLU  87           H        GLU  87   0.326 -14.042   2.889
  671    HA   GLU  87           HA       GLU  87  -2.046 -13.622   1.254
  672    HB2  GLU  87           1HB      GLU  87  -0.966 -15.875   2.862
  673    HB3  GLU  87           2HB      GLU  87  -2.712 -15.770   2.687
  674    HG2  GLU  87           1HG      GLU  87  -0.738 -15.854   0.416
  675    HG3  GLU  87           2HG      GLU  87  -1.685 -17.221   1.003
  676    H    ASP  88           H        ASP  88  -3.937 -12.929   1.970
  677    HA   ASP  88           HA       ASP  88  -4.319 -11.977   4.656
  678    HB2  ASP  88           1HB      ASP  88  -5.423 -10.834   2.829
  679    HB3  ASP  88           2HB      ASP  88  -6.165 -12.330   2.278
  680    H    LYS  89           H        LYS  89  -4.760 -14.832   2.892
  681    HA   LYS  89           HA       LYS  89  -6.861 -16.111   4.221
  682    HB2  LYS  89           1HB      LYS  89  -6.154 -16.862   2.079
  683    HB3  LYS  89           2HB      LYS  89  -4.507 -17.109   2.631
  684    HG2  LYS  89           1HG      LYS  89  -5.475 -18.894   4.174
  685    HG3  LYS  89           2HG      LYS  89  -6.934 -18.770   3.184
  686    HD2  LYS  89           1HD      LYS  89  -5.642 -19.276   1.186
  687    HD3  LYS  89           2HD      LYS  89  -4.163 -19.345   2.145
  688    HE2  LYS  89           1HE      LYS  89  -5.180 -21.214   3.442
  689    HE3  LYS  89           2HE      LYS  89  -6.533 -21.193   2.309
  690    HZ1  LYS  89           3HZ      LYS  89  -3.687 -21.725   1.651
  691    HZ2  LYS  89           1HZ      LYS  89  -4.934 -21.607   0.508
  692    HZ3  LYS  89           2HZ      LYS  89  -4.948 -22.855   1.653
  693    H    ALA  90           H        ALA  90  -3.338 -16.240   4.817
  694    HA   ALA  90           HA       ALA  90  -3.924 -17.975   7.122
  695    HB1  ALA  90           3HB      ALA  90  -1.864 -19.180   6.705
  696    HB2  ALA  90           1HB      ALA  90  -1.514 -18.140   5.323
  697    HB3  ALA  90           2HB      ALA  90  -2.905 -19.225   5.279
  698    H    GLU  91           H        GLU  91  -3.361 -17.199   8.988
  699    HA   GLU  91           HA       GLU  91  -1.284 -15.164   9.240
  700    HB2  GLU  91           1HB      GLU  91  -3.445 -14.893  10.447
  701    HB3  GLU  91           2HB      GLU  91  -3.128 -16.388  11.315
  702    HG2  GLU  91           1HG      GLU  91  -1.134 -15.364  12.311
  703    HG3  GLU  91           2HG      GLU  91  -1.514 -13.855  11.480
  704    H    ALA  92           H        ALA  92   0.715 -15.625  10.233
  705    HA   ALA  92           HA       ALA  92   1.082 -18.394  11.117
  706    HB1  ALA  92           3HB      ALA  92   2.873 -17.064   9.092
  707    HB2  ALA  92           1HB      ALA  92   1.679 -18.317   8.752
  708    HB3  ALA  92           2HB      ALA  92   3.072 -18.681   9.769
  709    HA   PRO  93           HA       PRO  93   3.761 -16.068  13.944
  710    HB2  PRO  93           1HB      PRO  93   2.015 -16.007  16.108
  711    HB3  PRO  93           2HB      PRO  93   2.330 -14.653  15.023
  712    HG2  PRO  93           1HG      PRO  93  -0.104 -16.100  15.321
  713    HG3  PRO  93           2HG      PRO  93   0.249 -14.824  14.146
  714    HD2  PRO  93           1HD      PRO  93   0.293 -17.776  13.809
  715    HD3  PRO  93           2HD      PRO  93  -0.032 -16.506  12.610
  716    H    ASN  94           H        ASN  94   1.377 -17.848  15.802
  717    HA   ASN  94           HA       ASN  94   2.600 -20.411  15.492
  718    HB2  ASN  94           1HB      ASN  94   4.110 -19.474  17.210
  719    HB3  ASN  94           2HB      ASN  94   2.719 -19.110  18.228
  720   HD21  ASN  94          2HD2      ASN  94   1.669 -20.777  19.299
  721   HD22  ASN  94          1HD2      ASN  94   2.324 -22.376  19.421
  722    H    THR  95           H        THR  95   0.574 -18.432  17.621
  723    HA   THR  95           HA       THR  95  -1.576 -20.428  17.373
  724    HB   THR  95           HB       THR  95  -1.686 -18.027  19.177
  725    HG1  THR  95           HG1      THR  95  -0.095 -18.828  20.317
  726   HG21  THR  95          3HG2      THR  95  -2.852 -20.805  19.352
  727   HG22  THR  95          1HG2      THR  95  -3.719 -19.335  18.907
  728   HG23  THR  95          2HG2      THR  95  -3.085 -19.525  20.541
  729    H    ILE  96           H        ILE  96  -3.665 -19.674  16.720
  730    HA   ILE  96           HA       ILE  96  -3.386 -17.538  14.738
  731    HB   ILE  96           HB       ILE  96  -5.570 -19.615  14.978
  732   HG12  ILE  96          1HG1      ILE  96  -3.438 -20.690  14.511
  733   HG13  ILE  96          2HG1      ILE  96  -4.444 -20.717  13.068
  734   HG21  ILE  96          1HG2      ILE  96  -6.299 -17.618  13.795
  735   HG22  ILE  96          2HG2      ILE  96  -6.123 -18.969  12.674
  736   HG23  ILE  96          3HG2      ILE  96  -4.890 -17.712  12.739
  737   HD11  ILE  96          3HD1      ILE  96  -2.114 -20.208  12.559
  738   HD12  ILE  96          1HD1      ILE  96  -2.197 -18.786  13.595
  739   HD13  ILE  96          2HD1      ILE  96  -3.179 -18.869  12.132
  740    H    ALA  97           H        ALA  97  -4.475 -15.673  14.843
  741    HA   ALA  97           HA       ALA  97  -6.162 -15.121  17.116
  742    HB1  ALA  97           3HB      ALA  97  -6.325 -12.867  16.190
  743    HB2  ALA  97           1HB      ALA  97  -5.509 -13.406  14.721
  744    HB3  ALA  97           2HB      ALA  97  -4.648 -13.409  16.261
  745    H    SER  98           H        SER  98  -7.909 -16.530  16.848
  746    HA   SER  98           HA       SER  98  -9.512 -16.384  14.443
  747    HB2  SER  98           1HB      SER  98 -10.975 -18.003  15.826
  748    HB3  SER  98           2HB      SER  98  -9.374 -18.558  15.332
  749    HG   SER  98           HG       SER  98  -9.937 -17.366  17.851
  750    H    GLY  99           H        GLY  99 -10.908 -14.783  14.155
  751    HA2  GLY  99           1HA      GLY  99 -12.911 -14.181  16.091
  752    HA3  GLY  99           2HA      GLY  99 -11.702 -12.905  16.023
  753    H    SER 100           H        SER 100 -14.258 -14.542  14.309
  754    HA   SER 100           HA       SER 100 -14.226 -12.364  12.323
  755    HB2  SER 100           1HB      SER 100 -13.583 -14.590  11.372
  756    HB3  SER 100           2HB      SER 100 -15.164 -15.207  11.847
  757    HG   SER 100           HG       SER 100 -16.133 -13.877  10.384
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1 -14.355  11.983  16.755
    2    H2   MET   1           2H       MET   1 -14.266  13.060  15.450
    3    H3   MET   1           3H       MET   1 -15.412  11.806  15.439
    4    HA   MET   1           HA       MET   1 -16.536  13.811  15.954
    5    HB2  MET   1           1HB      MET   1 -16.075  12.110  18.412
    6    HB3  MET   1           2HB      MET   1 -17.347  13.315  18.273
    7    HG2  MET   1           1HG      MET   1 -18.343  12.081  16.438
    8    HG3  MET   1           2HG      MET   1 -17.045  10.893  16.515
    9    HE1  MET   1           3HE      MET   1 -20.190  10.229  16.620
   10    HE2  MET   1           1HE      MET   1 -20.203   8.969  17.855
   11    HE3  MET   1           2HE      MET   1 -18.927   8.996  16.637
   12    H    GLU   2           H        GLU   2 -15.525  15.737  15.867
   13    HA   GLU   2           HA       GLU   2 -13.986  16.553  18.247
   14    HB2  GLU   2           1HB      GLU   2 -13.719  17.764  15.491
   15    HB3  GLU   2           2HB      GLU   2 -12.662  17.997  16.872
   16    HG2  GLU   2           1HG      GLU   2 -11.426  16.592  15.537
   17    HG3  GLU   2           2HG      GLU   2 -12.200  15.462  16.644
   18    H    VAL   3           H        VAL   3 -14.021  19.111  18.361
   19    HA   VAL   3           HA       VAL   3 -16.715  20.015  18.517
   20    HB   VAL   3           HB       VAL   3 -14.124  21.589  18.548
   21   HG11  VAL   3          1HG1      VAL   3 -15.439  23.427  19.499
   22   HG12  VAL   3          2HG1      VAL   3 -16.914  22.490  19.266
   23   HG13  VAL   3          3HG1      VAL   3 -15.977  23.022  17.869
   24   HG21  VAL   3          3HG2      VAL   3 -14.346  20.026  20.404
   25   HG22  VAL   3          1HG2      VAL   3 -15.932  20.692  20.790
   26   HG23  VAL   3          2HG2      VAL   3 -14.490  21.691  20.966
   27    H    GLN   4           H        GLN   4 -14.024  20.710  16.317
   28    HA   GLN   4           HA       GLN   4 -15.930  21.645  14.297
   29    HB2  GLN   4           1HB      GLN   4 -12.902  21.646  14.358
   30    HB3  GLN   4           2HB      GLN   4 -13.862  22.211  12.995
   31    HG2  GLN   4           1HG      GLN   4 -14.876  23.920  14.423
   32    HG3  GLN   4           2HG      GLN   4 -13.901  23.359  15.779
   33   HE21  GLN   4          2HE2      GLN   4 -14.024  25.967  14.467
   34   HE22  GLN   4          1HE2      GLN   4 -12.401  26.319  13.960
   35    H    SER   5           H        SER   5 -14.618  20.795  11.976
   36    HA   SER   5           HA       SER   5 -14.740  17.870  12.266
   37    HB2  SER   5           1HB      SER   5 -15.763  17.894   9.926
   38    HB3  SER   5           2HB      SER   5 -16.795  18.445  11.245
   39    HG   SER   5           HG       SER   5 -16.217  19.740   9.050
   40    H    MET   6           H        MET   6 -12.887  16.948  11.755
   41    HA   MET   6           HA       MET   6 -10.896  18.263  10.162
   42    HB2  MET   6           1HB      MET   6 -11.052  15.395  11.114
   43    HB3  MET   6           2HB      MET   6  -9.639  16.147  10.388
   44    HG2  MET   6           1HG      MET   6  -9.572  17.748  12.262
   45    HG3  MET   6           2HG      MET   6 -10.927  16.897  13.000
   46    HE1  MET   6           3HE      MET   6 -10.789  14.333  13.811
   47    HE2  MET   6           1HE      MET   6  -9.328  13.353  13.668
   48    HE3  MET   6           2HE      MET   6 -10.194  13.861  12.217
   49    H    LEU   7           H        LEU   7 -10.079  17.529   8.130
   50    HA   LEU   7           HA       LEU   7 -12.210  16.544   6.400
   51    HB2  LEU   7           1HB      LEU   7  -9.464  17.602   5.714
   52    HB3  LEU   7           2HB      LEU   7 -10.726  17.214   4.560
   53    HG   LEU   7           HG       LEU   7 -10.863  19.400   6.640
   54   HD11  LEU   7          1HD1      LEU   7 -10.755  20.911   4.718
   55   HD12  LEU   7          2HD1      LEU   7 -10.523  19.529   3.648
   56   HD13  LEU   7          3HD1      LEU   7  -9.301  19.925   4.856
   57   HD21  LEU   7          3HD2      LEU   7 -12.800  18.627   4.461
   58   HD22  LEU   7          1HD2      LEU   7 -12.920  20.064   5.477
   59   HD23  LEU   7          2HD2      LEU   7 -13.059  18.460   6.197
   60    H    LEU   8           H        LEU   8  -9.343  15.463   7.910
   61    HA   LEU   8           HA       LEU   8  -8.777  13.312   6.105
   62    HB2  LEU   8           1HB      LEU   8  -7.889  13.757   8.957
   63    HB3  LEU   8           2HB      LEU   8  -7.251  12.529   7.881
   64    HG   LEU   8           HG       LEU   8  -7.002  15.512   7.478
   65   HD11  LEU   8          1HD1      LEU   8  -5.640  14.711   9.327
   66   HD12  LEU   8          2HD1      LEU   8  -4.627  15.141   7.948
   67   HD13  LEU   8          3HD1      LEU   8  -4.965  13.446   8.300
   68   HD21  LEU   8          3HD2      LEU   8  -5.847  13.209   5.907
   69   HD22  LEU   8          1HD2      LEU   8  -5.484  14.915   5.652
   70   HD23  LEU   8          2HD2      LEU   8  -7.113  14.307   5.361
   71    H    ASN   9           H        ASN   9 -10.311  11.812   5.840
   72    HA   ASN   9           HA       ASN   9 -11.992  10.982   8.043
   73    HB2  ASN   9           1HB      ASN   9 -12.872  11.202   5.716
   74    HB3  ASN   9           2HB      ASN   9 -11.840   9.857   5.236
   75   HD21  ASN   9          2HD2      ASN   9 -13.600   8.616   4.617
   76   HD22  ASN   9          1HD2      ASN   9 -14.659   7.869   5.765
   77    H    ASP  10           H        ASP  10 -11.590   9.346   9.366
   78    HA   ASP  10           HA       ASP  10  -9.292   7.677   9.027
   79    HB2  ASP  10           1HB      ASP  10  -9.885   8.239  11.272
   80    HB3  ASP  10           2HB      ASP  10 -11.535   7.667  11.051
   81    H    VAL  11           H        VAL  11  -9.540   6.533   7.162
   82    HA   VAL  11           HA       VAL  11 -11.803   4.688   6.996
   83    HB   VAL  11           HB       VAL  11  -9.666   5.209   4.919
   84   HG11  VAL  11          1HG1      VAL  11 -12.315   3.781   4.737
   85   HG12  VAL  11          2HG1      VAL  11 -10.719   3.032   4.678
   86   HG13  VAL  11          3HG1      VAL  11 -11.236   4.114   3.384
   87   HG21  VAL  11          3HG2      VAL  11 -10.978   7.223   5.328
   88   HG22  VAL  11          1HG2      VAL  11 -12.469   6.309   5.103
   89   HG23  VAL  11          2HG2      VAL  11 -11.360   6.535   3.751
   90    H    LYS  12           H        LYS  12 -11.281   3.162   8.491
   91    HA   LYS  12           HA       LYS  12  -8.698   1.877   8.447
   92    HB2  LYS  12           1HB      LYS  12 -11.192   1.473  10.079
   93    HB3  LYS  12           2HB      LYS  12  -9.837   0.354  10.167
   94    HG2  LYS  12           1HG      LYS  12  -8.368   2.196  10.842
   95    HG3  LYS  12           2HG      LYS  12  -9.741   3.302  10.777
   96    HD2  LYS  12           1HD      LYS  12 -10.830   2.196  12.571
   97    HD3  LYS  12           2HD      LYS  12  -9.700   0.842  12.509
   98    HE2  LYS  12           1HE      LYS  12  -9.189   2.290  14.389
   99    HE3  LYS  12           2HE      LYS  12  -7.885   2.327  13.206
  100    HZ1  LYS  12           3HZ      LYS  12  -8.375   4.534  14.015
  101    HZ2  LYS  12           1HZ      LYS  12  -9.991   4.394  13.538
  102    HZ3  LYS  12           2HZ      LYS  12  -8.773   4.438  12.369
  103    H    TRP  13           H        TRP  13  -8.521  -0.488   8.259
  104    HA   TRP  13           HA       TRP  13 -10.079  -1.308   5.923
  105    HB2  TRP  13           1HB      TRP  13  -7.293  -1.496   6.608
  106    HB3  TRP  13           2HB      TRP  13  -7.947  -3.103   6.294
  107    HD1  TRP  13           HD1      TRP  13 -10.072  -2.090   4.063
  108    HE1  TRP  13           HE1      TRP  13  -9.199  -1.524   1.721
  109    HE3  TRP  13           HE3      TRP  13  -5.152  -1.334   5.218
  110    HZ2  TRP  13           HZ2      TRP  13  -6.723  -0.848   0.511
  111    HZ3  TRP  13           HZ3      TRP  13  -3.595  -0.733   3.412
  112    HH2  TRP  13           HH2      TRP  13  -4.366  -0.496   1.106
  113    H    GLU  14           H        GLU  14 -11.493  -2.841   6.048
  114    HA   GLU  14           HA       GLU  14 -11.697  -4.436   8.476
  115    HB2  GLU  14           1HB      GLU  14 -13.499  -4.325   6.048
  116    HB3  GLU  14           2HB      GLU  14 -13.854  -5.162   7.556
  117    HG2  GLU  14           1HG      GLU  14 -13.855  -3.054   8.754
  118    HG3  GLU  14           2HG      GLU  14 -13.432  -2.195   7.276
  119    H    LYS  15           H        LYS  15 -10.577  -4.620   5.279
  120    HA   LYS  15           HA       LYS  15  -9.803  -7.418   5.713
  121    HB2  LYS  15           1HB      LYS  15 -10.509  -6.160   3.046
  122    HB3  LYS  15           2HB      LYS  15  -9.932  -7.803   3.286
  123    HG2  LYS  15           1HG      LYS  15 -12.531  -6.682   4.315
  124    HG3  LYS  15           2HG      LYS  15 -12.338  -7.740   2.916
  125    HD2  LYS  15           1HD      LYS  15 -11.528  -9.524   4.323
  126    HD3  LYS  15           2HD      LYS  15 -11.547  -8.465   5.735
  127    HE2  LYS  15           1HE      LYS  15 -13.989  -8.229   5.484
  128    HE3  LYS  15           2HE      LYS  15 -13.938  -9.356   4.131
  129    HZ1  LYS  15           3HZ      LYS  15 -14.582 -10.422   6.220
  130    HZ2  LYS  15           1HZ      LYS  15 -13.093  -9.986   6.908
  131    HZ3  LYS  15           2HZ      LYS  15 -13.139 -11.071   5.606
  132    HA   PRO  16           HA       PRO  16  -6.195  -4.630   5.609
  133    HB2  PRO  16           1HB      PRO  16  -4.889  -6.846   7.030
  134    HB3  PRO  16           2HB      PRO  16  -5.121  -5.170   7.532
  135    HG2  PRO  16           1HG      PRO  16  -6.480  -7.183   8.673
  136    HG3  PRO  16           2HG      PRO  16  -7.211  -5.586   8.420
  137    HD2  PRO  16           1HD      PRO  16  -7.540  -8.097   6.814
  138    HD3  PRO  16           2HD      PRO  16  -8.770  -6.920   7.328
  139    H    VAL  17           H        VAL  17  -3.900  -4.900   4.997
  140    HA   VAL  17           HA       VAL  17  -3.494  -7.108   3.091
  141    HB   VAL  17           HB       VAL  17  -2.439  -4.283   2.813
  142   HG11  VAL  17          1HG1      VAL  17  -2.257  -6.647   0.949
  143   HG12  VAL  17          2HG1      VAL  17  -0.930  -5.946   1.873
  144   HG13  VAL  17          3HG1      VAL  17  -1.702  -5.012   0.592
  145   HG21  VAL  17          3HG2      VAL  17  -4.612  -5.687   1.259
  146   HG22  VAL  17          1HG2      VAL  17  -3.963  -4.084   0.908
  147   HG23  VAL  17          2HG2      VAL  17  -4.845  -4.371   2.410
  148    H    THR  18           H        THR  18  -1.577  -8.187   3.237
  149    HA   THR  18           HA       THR  18   0.091  -7.536   5.544
  150    HB   THR  18           HB       THR  18   0.228 -10.036   3.858
  151    HG1  THR  18           HG1      THR  18  -1.366 -10.897   5.075
  152   HG21  THR  18          3HG2      THR  18   1.153 -11.021   5.900
  153   HG22  THR  18          1HG2      THR  18   0.997  -9.470   6.724
  154   HG23  THR  18          2HG2      THR  18   2.115  -9.641   5.370
  155    H    ILE  19           H        ILE  19   1.638  -6.084   4.964
  156    HA   ILE  19           HA       ILE  19   3.231  -6.630   2.555
  157    HB   ILE  19           HB       ILE  19   3.098  -4.204   4.353
  158   HG12  ILE  19          1HG1      ILE  19   1.286  -4.458   2.687
  159   HG13  ILE  19          2HG1      ILE  19   2.303  -3.057   2.359
  160   HG21  ILE  19          1HG2      ILE  19   5.420  -4.552   3.714
  161   HG22  ILE  19          2HG2      ILE  19   4.747  -3.150   2.878
  162   HG23  ILE  19          3HG2      ILE  19   4.948  -4.678   2.018
  163   HD11  ILE  19          3HD1      ILE  19   2.467  -5.714   0.956
  164   HD12  ILE  19          1HD1      ILE  19   3.466  -4.300   0.623
  165   HD13  ILE  19          2HD1      ILE  19   1.732  -4.243   0.320
  166    H    SER  20           H        SER  20   4.998  -7.827   2.814
  167    HA   SER  20           HA       SER  20   6.165  -8.126   5.460
  168    HB2  SER  20           1HB      SER  20   5.731 -10.078   3.865
  169    HB3  SER  20           2HB      SER  20   7.088  -9.472   2.916
  170    HG   SER  20           HG       SER  20   7.209 -11.077   4.961
  171    H    LEU  21           H        LEU  21   7.851  -6.961   6.112
  172    HA   LEU  21           HA       LEU  21   9.154  -5.212   4.202
  173    HB2  LEU  21           1HB      LEU  21   9.524  -5.405   7.191
  174    HB3  LEU  21           2HB      LEU  21  10.144  -4.136   6.149
  175    HG   LEU  21           HG       LEU  21   7.240  -4.699   6.739
  176   HD11  LEU  21          1HD1      LEU  21   9.019  -2.375   7.458
  177   HD12  LEU  21          2HD1      LEU  21   8.406  -3.602   8.568
  178   HD13  LEU  21          3HD1      LEU  21   7.288  -2.488   7.780
  179   HD21  LEU  21          3HD2      LEU  21   7.530  -3.990   4.429
  180   HD22  LEU  21          1HD2      LEU  21   8.486  -2.607   4.961
  181   HD23  LEU  21          2HD2      LEU  21   6.778  -2.714   5.388
  182    H    GLN  22           H        GLN  22  11.595  -4.847   4.642
  183    HA   GLN  22           HA       GLN  22  12.846  -7.031   3.453
  184    HB2  GLN  22           1HB      GLN  22  13.619  -4.737   3.182
  185    HB3  GLN  22           2HB      GLN  22  14.079  -4.669   4.876
  186    HG2  GLN  22           1HG      GLN  22  15.783  -6.351   4.511
  187    HG3  GLN  22           2HG      GLN  22  15.295  -6.505   2.823
  188   HE21  GLN  22          2HE2      GLN  22  16.899  -4.517   5.183
  189   HE22  GLN  22          1HE2      GLN  22  17.645  -3.439   4.052
  190    H    ASN  23           H        ASN  23  12.838  -6.033   6.845
  191    HA   ASN  23           HA       ASN  23  14.835  -7.889   7.664
  192    HB2  ASN  23           1HB      ASN  23  14.447  -5.951   9.014
  193    HB3  ASN  23           2HB      ASN  23  12.740  -6.339   9.192
  194   HD21  ASN  23          2HD2      ASN  23  12.106  -7.712  10.769
  195   HD22  ASN  23          1HD2      ASN  23  13.174  -8.414  11.933
  196    H    GLY  24           H        GLY  24  11.565  -8.291   6.829
  197    HA2  GLY  24           1HA      GLY  24  10.579 -10.455   6.646
  198    HA3  GLY  24           2HA      GLY  24  11.591 -10.996   7.980
  199    H    ALA  25           H        ALA  25   9.640  -8.078   7.824
  200    HA   ALA  25           HA       ALA  25   8.057  -9.111  10.081
  201    HB1  ALA  25           3HB      ALA  25   8.831  -6.250   9.514
  202    HB2  ALA  25           1HB      ALA  25   9.550  -7.288  10.744
  203    HB3  ALA  25           2HB      ALA  25   7.858  -6.810  10.873
  204    HA   PRO  26           HA       PRO  26   4.746  -8.485   7.102
  205    HB2  PRO  26           1HB      PRO  26   3.065  -9.825   9.064
  206    HB3  PRO  26           2HB      PRO  26   3.552 -10.377   7.459
  207    HG2  PRO  26           1HG      PRO  26   4.438 -11.536   9.752
  208    HG3  PRO  26           2HG      PRO  26   5.386 -11.499   8.255
  209    HD2  PRO  26           1HD      PRO  26   5.612  -9.757  10.686
  210    HD3  PRO  26           2HD      PRO  26   6.899 -10.488   9.698
  211    H    ARG  27           H        ARG  27   4.271  -6.349   7.200
  212    HA   ARG  27           HA       ARG  27   3.078  -5.220   9.600
  213    HB2  ARG  27           1HB      ARG  27   4.740  -3.888   8.418
  214    HB3  ARG  27           2HB      ARG  27   3.799  -3.977   6.937
  215    HG2  ARG  27           1HG      ARG  27   3.627  -1.804   8.102
  216    HG3  ARG  27           2HG      ARG  27   2.074  -2.605   7.870
  217    HD2  ARG  27           1HD      ARG  27   1.913  -3.190  10.133
  218    HD3  ARG  27           2HD      ARG  27   3.628  -2.901  10.420
  219    HE   ARG  27           HE       ARG  27   3.219  -0.574  10.439
  220   HH11  ARG  27          1HH1      ARG  27   0.240  -2.429  10.101
  221   HH12  ARG  27          2HH1      ARG  27  -0.766  -1.119  10.632
  222   HH21  ARG  27          1HH2      ARG  27   1.874   1.116  11.150
  223   HH22  ARG  27          2HH2      ARG  27   0.152   0.875  11.260
  224    H    ILE  28           H        ILE  28   1.043  -5.801   9.886
  225    HA   ILE  28           HA       ILE  28  -0.802  -6.034   7.658
  226    HB   ILE  28           HB       ILE  28  -1.324  -6.305  10.628
  227   HG12  ILE  28          1HG1      ILE  28  -0.868  -8.466   8.556
  228   HG13  ILE  28          2HG1      ILE  28   0.317  -7.959   9.756
  229   HG21  ILE  28          1HG2      ILE  28  -3.342  -5.814   9.372
  230   HG22  ILE  28          2HG2      ILE  28  -3.361  -7.489   9.924
  231   HG23  ILE  28          3HG2      ILE  28  -2.981  -7.119   8.242
  232   HD11  ILE  28          3HD1      ILE  28  -0.800 -10.007  10.424
  233   HD12  ILE  28          1HD1      ILE  28  -2.364  -9.196  10.335
  234   HD13  ILE  28          2HD1      ILE  28  -1.178  -8.691  11.539
  235    H    PHE  29           H        PHE  29  -1.743  -4.259   6.877
  236    HA   PHE  29           HA       PHE  29  -1.812  -1.849   8.473
  237    HB2  PHE  29           1HB      PHE  29  -2.647  -2.395   5.624
  238    HB3  PHE  29           2HB      PHE  29  -2.738  -0.809   6.392
  239    HD1  PHE  29           HD2      PHE  29  -0.604   0.192   7.310
  240    HD2  PHE  29           HD1      PHE  29  -0.654  -3.140   4.667
  241    HE1  PHE  29           HE2      PHE  29   1.757   0.599   6.760
  242    HE2  PHE  29           HE1      PHE  29   1.709  -2.743   4.119
  243    HZ   PHE  29           HZ       PHE  29   2.918  -0.874   5.166
  244    H    ASN  30           H        ASN  30  -3.370  -1.299   9.737
  245    HA   ASN  30           HA       ASN  30  -5.870  -2.787   9.717
  246    HB2  ASN  30           1HB      ASN  30  -5.019  -0.602  11.628
  247    HB3  ASN  30           2HB      ASN  30  -6.256  -1.828  11.886
  248   HD21  ASN  30          2HD2      ASN  30  -2.856  -1.153  11.779
  249   HD22  ASN  30          1HD2      ASN  30  -2.336  -2.615  12.548
  250    H    GLY  31           H        GLY  31  -4.709  -0.061   8.277
  251    HA2  GLY  31           1HA      GLY  31  -7.342   0.814   7.531
  252    HA3  GLY  31           2HA      GLY  31  -6.494   1.967   8.554
  253    H    VAL  32           H        VAL  32  -7.310   2.476   5.898
  254    HA   VAL  32           HA       VAL  32  -5.176   2.133   4.056
  255    HB   VAL  32           HB       VAL  32  -7.291   4.295   4.001
  256   HG11  VAL  32          1HG1      VAL  32  -6.951   4.209   1.574
  257   HG12  VAL  32          2HG1      VAL  32  -5.675   3.013   1.799
  258   HG13  VAL  32          3HG1      VAL  32  -5.472   4.649   2.426
  259   HG21  VAL  32          3HG2      VAL  32  -8.361   2.131   4.264
  260   HG22  VAL  32          1HG2      VAL  32  -7.419   1.480   2.922
  261   HG23  VAL  32          2HG2      VAL  32  -8.614   2.744   2.629
  262    H    TYR  33           H        TYR  33  -5.906   4.446   6.530
  263    HA   TYR  33           HA       TYR  33  -4.237   6.559   5.780
  264    HB2  TYR  33           1HB      TYR  33  -5.940   6.600   7.625
  265    HB3  TYR  33           2HB      TYR  33  -4.829   5.652   8.606
  266    HD1  TYR  33           HD2      TYR  33  -5.433   8.933   7.067
  267    HD2  TYR  33           HD1      TYR  33  -2.892   6.674   9.625
  268    HE1  TYR  33           HE2      TYR  33  -4.370  11.011   7.835
  269    HE2  TYR  33           HE1      TYR  33  -1.822   8.746  10.403
  270    HH   TYR  33           HH       TYR  33  -3.118  11.818   9.811
  271    H    GLU  34           H        GLU  34  -3.557   3.585   7.578
  272    HA   GLU  34           HA       GLU  34  -0.894   4.232   8.277
  273    HB2  GLU  34           1HB      GLU  34  -2.139   1.504   7.882
  274    HB3  GLU  34           2HB      GLU  34  -0.597   1.815   8.663
  275    HG2  GLU  34           1HG      GLU  34  -1.917   3.242  10.312
  276    HG3  GLU  34           2HG      GLU  34  -3.354   2.470   9.636
  277    H    ALA  35           H        ALA  35  -2.341   2.630   5.496
  278    HA   ALA  35           HA       ALA  35   0.065   1.778   4.291
  279    HB1  ALA  35           3HB      ALA  35  -1.262   1.470   2.273
  280    HB2  ALA  35           1HB      ALA  35  -2.578   2.405   2.980
  281    HB3  ALA  35           2HB      ALA  35  -2.118   0.856   3.685
  282    H    PHE  36           H        PHE  36  -1.959   4.652   3.744
  283    HA   PHE  36           HA       PHE  36  -0.395   5.825   1.744
  284    HB2  PHE  36           1HB      PHE  36  -2.682   6.566   2.332
  285    HB3  PHE  36           2HB      PHE  36  -2.069   7.224   3.845
  286    HD1  PHE  36           HD2      PHE  36  -1.444   7.458   0.172
  287    HD2  PHE  36           HD1      PHE  36  -1.557   9.462   3.926
  288    HE1  PHE  36           HE2      PHE  36  -0.970   9.592  -0.956
  289    HE2  PHE  36           HE1      PHE  36  -1.083  11.598   2.804
  290    HZ   PHE  36           HZ       PHE  36  -0.789  11.665   0.359
  291    H    ASP  37           H        ASP  37  -0.237   6.126   5.262
  292    HA   ASP  37           HA       ASP  37   1.896   7.944   5.418
  293    HB2  ASP  37           1HB      ASP  37   0.668   7.498   7.406
  294    HB3  ASP  37           2HB      ASP  37   0.924   5.764   7.264
  295    H    PHE  38           H        PHE  38   1.901   4.402   5.570
  296    HA   PHE  38           HA       PHE  38   4.597   3.948   5.927
  297    HB2  PHE  38           1HB      PHE  38   3.031   2.171   6.184
  298    HB3  PHE  38           2HB      PHE  38   2.481   2.327   4.522
  299    HD1  PHE  38           HD1      PHE  38   5.462   1.440   6.551
  300    HD2  PHE  38           HD2      PHE  38   3.388   0.995   2.861
  301    HE1  PHE  38           HE1      PHE  38   7.056  -0.305   5.867
  302    HE2  PHE  38           HE2      PHE  38   4.980  -0.744   2.169
  303    HZ   PHE  38           HZ       PHE  38   6.814  -1.397   3.671
  304    H    LEU  39           H        LEU  39   2.833   4.166   2.865
  305    HA   LEU  39           HA       LEU  39   4.888   3.397   1.154
  306    HB2  LEU  39           1HB      LEU  39   2.626   5.319   0.614
  307    HB3  LEU  39           2HB      LEU  39   3.597   4.523  -0.609
  308    HG   LEU  39           HG       LEU  39   1.875   3.041   1.375
  309   HD11  LEU  39          1HD1      LEU  39   1.282   3.821  -1.475
  310   HD12  LEU  39          2HD1      LEU  39   0.480   4.446  -0.032
  311   HD13  LEU  39          3HD1      LEU  39   0.301   2.748  -0.476
  312   HD21  LEU  39          3HD2      LEU  39   2.166   1.181  -0.193
  313   HD22  LEU  39          1HD2      LEU  39   3.711   1.733   0.454
  314   HD23  LEU  39          2HD2      LEU  39   3.228   2.184  -1.181
  315    H    GLN  40           H        GLN  40   4.404   6.427   2.766
  316    HA   GLN  40           HA       GLN  40   6.005   7.906   0.876
  317    HB2  GLN  40           1HB      GLN  40   4.774   8.674   3.521
  318    HB3  GLN  40           2HB      GLN  40   5.698   9.783   2.515
  319    HG2  GLN  40           1HG      GLN  40   4.092   9.594   0.738
  320    HG3  GLN  40           2HG      GLN  40   3.213   8.345   1.619
  321   HE21  GLN  40          2HE2      GLN  40   1.941   8.907   3.355
  322   HE22  GLN  40          1HE2      GLN  40   1.474  10.543   3.676
  323    H    HIS  41           H        HIS  41   6.383   7.092   4.350
  324    HA   HIS  41           HA       HIS  41   9.034   8.185   4.311
  325    HB2  HIS  41           1HB      HIS  41   9.229   7.386   6.652
  326    HB3  HIS  41           2HB      HIS  41   7.848   8.439   6.373
  327    HD1  HIS  41           HD1      HIS  41   8.791   5.018   7.476
  328    HD2  HIS  41           HD2      HIS  41   5.340   7.165   6.595
  329    HE1  HIS  41           HE1      HIS  41   6.887   3.661   8.404
  330    HE2  HIS  41           HE2      HIS  41   4.841   5.101   8.055
  331    H    GLU  42           H        GLU  42   7.705   4.908   4.156
  332    HA   GLU  42           HA       GLU  42  10.395   4.017   3.525
  333    HB2  GLU  42           1HB      GLU  42   9.926   3.814   6.064
  334    HB3  GLU  42           2HB      GLU  42   8.911   2.452   5.604
  335    HG2  GLU  42           1HG      GLU  42  10.854   1.443   4.464
  336    HG3  GLU  42           2HG      GLU  42  11.845   2.773   5.059
  337    H    TRP  43           H        TRP  43   9.056   3.948   1.482
  338    HA   TRP  43           HA       TRP  43   7.869   1.279   1.233
  339    HB2  TRP  43           1HB      TRP  43   6.738   3.109   0.038
  340    HB3  TRP  43           2HB      TRP  43   8.226   3.477  -0.825
  341    HD1  TRP  43           HD1      TRP  43   8.278   2.537  -3.187
  342    HE1  TRP  43           HE1      TRP  43   7.190   0.563  -4.428
  343    HE3  TRP  43           HE3      TRP  43   5.737   0.412   0.715
  344    HZ2  TRP  43           HZ2      TRP  43   5.488  -1.600  -3.838
  345    HZ3  TRP  43           HZ3      TRP  43   4.404  -1.609   0.287
  346    HH2  TRP  43           HH2      TRP  43   4.282  -2.593  -1.945
  347    HA   PRO  44           HA       PRO  44  12.242   0.270   0.687
  348    HB2  PRO  44           1HB      PRO  44  11.256  -2.502   0.801
  349    HB3  PRO  44           2HB      PRO  44  12.427  -1.680   1.837
  350    HG2  PRO  44           1HG      PRO  44   9.977  -2.308   2.723
  351    HG3  PRO  44           2HG      PRO  44  10.793  -0.816   3.224
  352    HD2  PRO  44           1HD      PRO  44   8.645  -1.200   1.173
  353    HD3  PRO  44           2HD      PRO  44   8.816   0.074   2.399
  354    H    ALA  45           H        ALA  45   9.583  -0.661  -1.283
  355    HA   ALA  45           HA       ALA  45  11.273  -2.045  -3.207
  356    HB1  ALA  45           3HB      ALA  45   9.084  -2.993  -2.701
  357    HB2  ALA  45           1HB      ALA  45   9.198  -2.524  -4.397
  358    HB3  ALA  45           2HB      ALA  45   8.307  -1.512  -3.260
  359    H    ARG  46           H        ARG  46  10.696  -1.471  -5.581
  360    HA   ARG  46           HA       ARG  46  10.615   1.442  -5.924
  361    HB2  ARG  46           1HB      ARG  46  12.590  -0.515  -7.089
  362    HB3  ARG  46           2HB      ARG  46  12.281   1.045  -7.841
  363    HG2  ARG  46           1HG      ARG  46  13.007   2.195  -5.845
  364    HG3  ARG  46           2HG      ARG  46  13.213   0.660  -5.004
  365    HD2  ARG  46           1HD      ARG  46  14.708   1.385  -7.512
  366    HD3  ARG  46           2HD      ARG  46  15.317   1.718  -5.891
  367    HE   ARG  46           HE       ARG  46  14.591  -1.040  -6.566
  368   HH11  ARG  46          1HH1      ARG  46  17.085   1.356  -5.998
  369   HH12  ARG  46          2HH1      ARG  46  18.321   0.178  -5.681
  370   HH21  ARG  46          1HH2      ARG  46  16.232  -2.589  -6.161
  371   HH22  ARG  46          2HH2      ARG  46  17.838  -2.054  -5.763
  372    H    GLY  47           H        GLY  47  10.619   1.664  -8.608
  373    HA2  GLY  47           1HA      GLY  47   9.527   0.290 -10.472
  374    HA3  GLY  47           2HA      GLY  47   8.191   0.145  -9.337
  375    H    ASP  48           H        ASP  48   8.912   2.967  -8.421
  376    HA   ASP  48           HA       ASP  48   8.453   5.138  -8.867
  377    HB2  ASP  48           1HB      ASP  48   8.561   4.264 -11.763
  378    HB3  ASP  48           2HB      ASP  48   8.453   5.937 -11.224
  379    H    ARG  49           H        ARG  49   6.693   3.690 -11.572
  380    HA   ARG  49           HA       ARG  49   4.319   5.125 -11.063
  381    HB2  ARG  49           1HB      ARG  49   4.889   2.672 -12.725
  382    HB3  ARG  49           2HB      ARG  49   3.322   3.474 -12.699
  383    HG2  ARG  49           1HG      ARG  49   4.100   5.336 -13.796
  384    HG3  ARG  49           2HG      ARG  49   5.769   5.066 -13.289
  385    HD2  ARG  49           1HD      ARG  49   4.276   3.325 -15.244
  386    HD3  ARG  49           2HD      ARG  49   5.358   4.639 -15.705
  387    HE   ARG  49           HE       ARG  49   6.135   2.096 -14.450
  388   HH11  ARG  49          1HH1      ARG  49   7.055   5.161 -15.884
  389   HH12  ARG  49          2HH1      ARG  49   8.707   4.692 -16.140
  390   HH21  ARG  49          1HH2      ARG  49   8.338   1.490 -14.787
  391   HH22  ARG  49          2HH2      ARG  49   9.426   2.631 -15.530
  392    H    ALA  50           H        ALA  50   5.496   2.030  -9.971
  393    HA   ALA  50           HA       ALA  50   3.083   1.007  -8.922
  394    HB1  ALA  50           3HB      ALA  50   4.493  -0.469  -7.594
  395    HB2  ALA  50           1HB      ALA  50   5.904   0.523  -7.963
  396    HB3  ALA  50           2HB      ALA  50   5.090  -0.367  -9.250
  397    H    HIS  51           H        HIS  51   5.581   3.107  -7.597
  398    HA   HIS  51           HA       HIS  51   4.397   3.311  -4.994
  399    HB2  HIS  51           1HB      HIS  51   6.816   3.672  -5.394
  400    HB3  HIS  51           2HB      HIS  51   6.435   5.091  -6.360
  401    HD1  HIS  51           HD1      HIS  51   6.573   7.233  -5.130
  402    HD2  HIS  51           HD2      HIS  51   5.834   4.027  -2.586
  403    HE1  HIS  51           HE1      HIS  51   6.616   8.187  -2.806
  404    HE2  HIS  51           HE2      HIS  51   6.370   6.196  -1.282
  405    H    GLU  52           H        GLU  52   4.406   5.171  -7.962
  406    HA   GLU  52           HA       GLU  52   2.941   7.411  -7.223
  407    HB2  GLU  52           1HB      GLU  52   3.976   7.262  -9.381
  408    HB3  GLU  52           2HB      GLU  52   3.028   5.845  -9.803
  409    HG2  GLU  52           1HG      GLU  52   0.989   7.271  -9.719
  410    HG3  GLU  52           2HG      GLU  52   2.044   8.668  -9.491
  411    H    GLN  53           H        GLN  53   1.676   4.407  -8.675
  412    HA   GLN  53           HA       GLN  53  -1.032   5.086  -8.462
  413    HB2  GLN  53           1HB      GLN  53  -0.194   3.317  -9.937
  414    HB3  GLN  53           2HB      GLN  53   0.255   2.351  -8.540
  415    HG2  GLN  53           1HG      GLN  53  -2.028   2.035  -7.933
  416    HG3  GLN  53           2HG      GLN  53  -2.564   3.196  -9.148
  417   HE21  GLN  53          2HE2      GLN  53  -1.272   0.007  -8.607
  418   HE22  GLN  53          1HE2      GLN  53  -1.646  -0.630 -10.170
  419    H    ALA  54           H        ALA  54   1.101   3.329  -6.264
  420    HA   ALA  54           HA       ALA  54  -0.776   2.433  -4.421
  421    HB1  ALA  54           3HB      ALA  54   1.573   1.742  -4.416
  422    HB2  ALA  54           1HB      ALA  54   1.060   2.310  -2.827
  423    HB3  ALA  54           2HB      ALA  54   2.042   3.350  -3.861
  424    H    LEU  55           H        LEU  55   1.024   5.510  -4.424
  425    HA   LEU  55           HA       LEU  55  -0.170   6.548  -2.084
  426    HB2  LEU  55           1HB      LEU  55   1.099   7.939  -4.439
  427    HB3  LEU  55           2HB      LEU  55   0.584   8.767  -2.983
  428    HG   LEU  55           HG       LEU  55   2.706   6.624  -3.116
  429   HD11  LEU  55          1HD1      LEU  55   3.412   8.709  -4.159
  430   HD12  LEU  55          2HD1      LEU  55   4.251   8.455  -2.627
  431   HD13  LEU  55          3HD1      LEU  55   2.917   9.605  -2.723
  432   HD21  LEU  55          3HD2      LEU  55   1.769   8.349  -0.825
  433   HD22  LEU  55          1HD2      LEU  55   3.146   7.248  -0.788
  434   HD23  LEU  55          2HD2      LEU  55   1.514   6.611  -0.990
  435    H    ARG  56           H        ARG  56  -0.937   6.914  -5.510
  436    HA   ARG  56           HA       ARG  56  -2.942   8.828  -5.336
  437    HB2  ARG  56           1HB      ARG  56  -1.906   8.049  -7.433
  438    HB3  ARG  56           2HB      ARG  56  -2.738   6.510  -7.265
  439    HG2  ARG  56           1HG      ARG  56  -4.890   7.664  -7.450
  440    HG3  ARG  56           2HG      ARG  56  -4.036   9.197  -7.659
  441    HD2  ARG  56           1HD      ARG  56  -2.936   8.278  -9.663
  442    HD3  ARG  56           2HD      ARG  56  -3.856   6.787  -9.464
  443    HE   ARG  56           HE       ARG  56  -5.619   8.990  -9.563
  444   HH11  ARG  56          1HH1      ARG  56  -3.516   7.069 -11.608
  445   HH12  ARG  56          2HH1      ARG  56  -4.409   7.402 -13.063
  446   HH21  ARG  56          1HH2      ARG  56  -6.800   9.433 -11.465
  447   HH22  ARG  56          2HH2      ARG  56  -6.290   8.746 -12.983
  448    H    LEU  57           H        LEU  57  -3.204   5.298  -5.198
  449    HA   LEU  57           HA       LEU  57  -6.006   5.147  -5.019
  450    HB2  LEU  57           1HB      LEU  57  -3.926   3.244  -3.942
  451    HB3  LEU  57           2HB      LEU  57  -5.622   2.870  -4.180
  452    HG   LEU  57           HG       LEU  57  -3.761   3.650  -6.420
  453   HD11  LEU  57          1HD1      LEU  57  -4.626   0.904  -5.532
  454   HD12  LEU  57          2HD1      LEU  57  -3.002   1.576  -5.396
  455   HD13  LEU  57          3HD1      LEU  57  -3.702   1.277  -6.986
  456   HD21  LEU  57          3HD2      LEU  57  -5.530   2.709  -7.832
  457   HD22  LEU  57          1HD2      LEU  57  -6.116   4.064  -6.870
  458   HD23  LEU  57          2HD2      LEU  57  -6.512   2.410  -6.399
  459    H    CYS  58           H        CYS  58  -3.526   5.052  -2.471
  460    HA   CYS  58           HA       CYS  58  -5.328   4.794  -0.321
  461    HB2  CYS  58           1HB      CYS  58  -2.543   5.974  -0.300
  462    HB3  CYS  58           2HB      CYS  58  -3.430   5.379   1.100
  463    HG   CYS  58           HG       CYS  58  -1.936   3.618  -1.386
  464    H    ARG  59           H        ARG  59  -3.974   7.592  -1.960
  465    HA   ARG  59           HA       ARG  59  -4.810   9.564  -0.138
  466    HB2  ARG  59           1HB      ARG  59  -3.192   9.946  -1.979
  467    HB3  ARG  59           2HB      ARG  59  -4.510   9.815  -3.136
  468    HG2  ARG  59           1HG      ARG  59  -5.596  11.745  -1.918
  469    HG3  ARG  59           2HG      ARG  59  -4.062  11.946  -1.070
  470    HD2  ARG  59           1HD      ARG  59  -4.454  12.034  -4.058
  471    HD3  ARG  59           2HD      ARG  59  -4.235  13.431  -3.009
  472    HE   ARG  59           HE       ARG  59  -2.004  12.228  -2.465
  473   HH11  ARG  59          1HH1      ARG  59  -3.604  12.269  -5.580
  474   HH12  ARG  59          2HH1      ARG  59  -2.117  12.250  -6.487
  475   HH21  ARG  59          1HH2      ARG  59  -0.052  12.191  -3.637
  476   HH22  ARG  59          2HH2      ARG  59  -0.090  12.192  -5.383
  477    H    ALA  60           H        ALA  60  -6.363   8.347  -3.105
  478    HA   ALA  60           HA       ALA  60  -8.644   9.987  -2.951
  479    HB1  ALA  60           3HB      ALA  60  -9.660   8.438  -4.548
  480    HB2  ALA  60           1HB      ALA  60  -8.354   7.289  -4.262
  481    HB3  ALA  60           2HB      ALA  60  -8.007   8.849  -5.007
  482    H    SER  61           H        SER  61  -7.897   6.876  -1.518
  483    HA   SER  61           HA       SER  61 -10.510   6.138  -0.789
  484    HB2  SER  61           1HB      SER  61  -8.557   4.598  -0.797
  485    HB3  SER  61           2HB      SER  61  -7.928   5.432   0.624
  486    HG   SER  61           HG       SER  61 -10.382   4.825   1.234
  487    H    LEU  62           H        LEU  62  -8.165   8.253   0.717
  488    HA   LEU  62           HA       LEU  62  -9.800   8.452   3.126
  489    HB2  LEU  62           1HB      LEU  62  -7.097   9.636   2.491
  490    HB3  LEU  62           2HB      LEU  62  -7.908   9.736   4.041
  491    HG   LEU  62           HG       LEU  62  -7.064   7.133   2.767
  492   HD11  LEU  62          1HD1      LEU  62  -5.664   8.767   4.878
  493   HD12  LEU  62          2HD1      LEU  62  -5.106   8.513   3.225
  494   HD13  LEU  62          3HD1      LEU  62  -5.199   7.153   4.342
  495   HD21  LEU  62          3HD2      LEU  62  -8.879   6.947   4.394
  496   HD22  LEU  62          1HD2      LEU  62  -7.913   7.826   5.579
  497   HD23  LEU  62          2HD2      LEU  62  -7.389   6.239   5.017
  498    H    MET  63           H        MET  63  -9.967   9.839   0.227
  499    HA   MET  63           HA       MET  63 -10.601  12.489   1.338
  500    HB2  MET  63           1HB      MET  63  -9.075  11.881  -1.181
  501    HB3  MET  63           2HB      MET  63  -9.763  13.458  -0.829
  502    HG2  MET  63           1HG      MET  63  -8.382  13.587   1.202
  503    HG3  MET  63           2HG      MET  63  -7.659  12.033   0.785
  504    HE1  MET  63           3HE      MET  63  -8.098  15.793  -0.286
  505    HE2  MET  63           1HE      MET  63  -8.694  14.908  -1.690
  506    HE3  MET  63           2HE      MET  63  -7.196  15.831  -1.801
  507    H    GLY  64           H        GLY  64 -11.120  10.277  -1.418
  508    HA2  GLY  64           1HA      GLY  64 -13.701  11.550  -1.860
  509    HA3  GLY  64           2HA      GLY  64 -12.509  11.802  -3.119
  510    H    ASP  65           H        ASP  65 -13.848   9.149  -1.217
  511    HA   ASP  65           HA       ASP  65 -15.235   7.475  -1.841
  512    HB2  ASP  65           1HB      ASP  65 -16.347   8.967  -3.369
  513    HB3  ASP  65           2HB      ASP  65 -15.089   8.735  -4.579
  514    H    VAL  66           H        VAL  66 -13.479   6.125  -1.285
  515    HA   VAL  66           HA       VAL  66 -13.100   4.285  -3.534
  516    HB   VAL  66           HB       VAL  66 -10.955   5.076  -1.563
  517   HG11  VAL  66          1HG1      VAL  66 -11.091   2.643  -1.482
  518   HG12  VAL  66          2HG1      VAL  66  -9.638   3.149  -2.343
  519   HG13  VAL  66          3HG1      VAL  66 -11.038   2.568  -3.244
  520   HG21  VAL  66          3HG2      VAL  66  -9.583   5.245  -3.574
  521   HG22  VAL  66          1HG2      VAL  66 -11.017   6.265  -3.697
  522   HG23  VAL  66          2HG2      VAL  66 -10.951   4.726  -4.556
  523    H    ALA  67           H        ALA  67 -13.967   2.382  -3.108
  524    HA   ALA  67           HA       ALA  67 -15.065   1.747  -0.566
  525    HB1  ALA  67           3HB      ALA  67 -15.659  -0.393  -1.568
  526    HB2  ALA  67           1HB      ALA  67 -14.613  -0.052  -2.947
  527    HB3  ALA  67           2HB      ALA  67 -16.046   0.937  -2.660
  528    H    GLY  68           H        GLY  68 -14.344   0.424   1.022
  529    HA2  GLY  68           1HA      GLY  68 -11.618   0.312   1.528
  530    HA3  GLY  68           2HA      GLY  68 -12.829  -0.643   2.367
  531    H    GLU  69           H        GLU  69 -13.723  -2.288   0.310
  532    HA   GLU  69           HA       GLU  69 -11.624  -4.220   0.340
  533    HB2  GLU  69           1HB      GLU  69 -14.071  -4.762   0.435
  534    HB3  GLU  69           2HB      GLU  69 -14.178  -4.329  -1.267
  535    HG2  GLU  69           1HG      GLU  69 -12.509  -6.076  -1.776
  536    HG3  GLU  69           2HG      GLU  69 -12.535  -6.548  -0.077
  537    H    ILE  70           H        ILE  70 -12.876  -1.985  -2.067
  538    HA   ILE  70           HA       ILE  70 -11.485  -3.075  -4.284
  539    HB   ILE  70           HB       ILE  70 -12.519  -0.272  -3.825
  540   HG12  ILE  70          1HG1      ILE  70 -13.612  -2.613  -5.404
  541   HG13  ILE  70          2HG1      ILE  70 -14.257  -1.997  -3.887
  542   HG21  ILE  70          1HG2      ILE  70 -10.714  -0.231  -5.461
  543   HG22  ILE  70          2HG2      ILE  70 -12.270   0.050  -6.243
  544   HG23  ILE  70          3HG2      ILE  70 -11.493  -1.528  -6.370
  545   HD11  ILE  70          3HD1      ILE  70 -14.188  -0.523  -6.508
  546   HD12  ILE  70          1HD1      ILE  70 -14.817   0.113  -4.988
  547   HD13  ILE  70          2HD1      ILE  70 -15.602  -1.266  -5.760
  548    H    ALA  71           H        ALA  71 -10.728  -0.412  -2.040
  549    HA   ALA  71           HA       ALA  71  -8.232   0.319  -2.970
  550    HB1  ALA  71           3HB      ALA  71  -7.739   1.052  -0.698
  551    HB2  ALA  71           1HB      ALA  71  -9.074   0.081  -0.083
  552    HB3  ALA  71           2HB      ALA  71  -9.398   1.456  -1.136
  553    H    ARG  72           H        ARG  72  -9.095  -2.415  -0.905
  554    HA   ARG  72           HA       ARG  72  -6.542  -3.346  -0.281
  555    HB2  ARG  72           1HB      ARG  72  -8.363  -4.312   0.868
  556    HB3  ARG  72           2HB      ARG  72  -9.194  -4.726  -0.623
  557    HG2  ARG  72           1HG      ARG  72  -7.456  -6.403  -1.099
  558    HG3  ARG  72           2HG      ARG  72  -6.691  -6.016   0.444
  559    HD2  ARG  72           1HD      ARG  72  -8.563  -6.798   1.668
  560    HD3  ARG  72           2HD      ARG  72  -9.558  -6.897   0.217
  561    HE   ARG  72           HE       ARG  72  -8.135  -8.760  -0.494
  562   HH11  ARG  72          1HH1      ARG  72  -8.005  -7.836   2.873
  563   HH12  ARG  72          2HH1      ARG  72  -7.577  -9.424   3.435
  564   HH21  ARG  72          1HH2      ARG  72  -7.559 -10.842   0.216
  565   HH22  ARG  72          2HH2      ARG  72  -7.287 -11.132   1.914
  566    H    THR  73           H        THR  73  -8.667  -4.384  -2.955
  567    HA   THR  73           HA       THR  73  -6.834  -6.120  -4.172
  568    HB   THR  73           HB       THR  73  -9.015  -4.554  -5.567
  569    HG1  THR  73           HG1      THR  73  -9.549  -7.135  -4.714
  570   HG21  THR  73          3HG2      THR  73  -7.779  -7.249  -6.158
  571   HG22  THR  73          1HG2      THR  73  -7.517  -5.766  -7.076
  572   HG23  THR  73          2HG2      THR  73  -9.113  -6.513  -7.044
  573    H    ALA  74           H        ALA  74  -7.489  -2.685  -4.673
  574    HA   ALA  74           HA       ALA  74  -5.794  -2.343  -6.906
  575    HB1  ALA  74           3HB      ALA  74  -6.682  -0.295  -4.877
  576    HB2  ALA  74           1HB      ALA  74  -7.583  -0.774  -6.316
  577    HB3  ALA  74           2HB      ALA  74  -6.027   0.038  -6.481
  578    H    PHE  75           H        PHE  75  -5.251  -2.074  -3.428
  579    HA   PHE  75           HA       PHE  75  -2.658  -0.967  -3.567
  580    HB2  PHE  75           1HB      PHE  75  -4.093  -1.023  -1.515
  581    HB3  PHE  75           2HB      PHE  75  -3.771  -2.748  -1.387
  582    HD1  PHE  75           HD2      PHE  75  -2.247   0.602  -1.237
  583    HD2  PHE  75           HD1      PHE  75  -1.737  -3.553  -0.472
  584    HE1  PHE  75           HE2      PHE  75  -0.206   1.092   0.043
  585    HE2  PHE  75           HE1      PHE  75   0.304  -3.068   0.811
  586    HZ   PHE  75           HZ       PHE  75   1.074  -0.745   1.070
  587    H    VAL  76           H        VAL  76  -3.845  -4.293  -3.565
  588    HA   VAL  76           HA       VAL  76  -1.309  -5.549  -3.462
  589    HB   VAL  76           HB       VAL  76  -3.935  -6.550  -4.588
  590   HG11  VAL  76          1HG1      VAL  76  -2.958  -8.798  -4.451
  591   HG12  VAL  76          2HG1      VAL  76  -1.407  -8.091  -3.998
  592   HG13  VAL  76          3HG1      VAL  76  -2.085  -7.778  -5.595
  593   HG21  VAL  76          3HG2      VAL  76  -3.976  -6.068  -2.193
  594   HG22  VAL  76          1HG2      VAL  76  -2.556  -7.088  -1.957
  595   HG23  VAL  76          2HG2      VAL  76  -4.076  -7.802  -2.493
  596    H    ALA  77           H        ALA  77  -3.249  -4.244  -6.076
  597    HA   ALA  77           HA       ALA  77  -1.658  -5.269  -8.200
  598    HB1  ALA  77           3HB      ALA  77  -3.960  -4.507  -8.542
  599    HB2  ALA  77           1HB      ALA  77  -2.835  -3.665  -9.606
  600    HB3  ALA  77           2HB      ALA  77  -3.467  -2.854  -8.172
  601    H    ALA  78           H        ALA  78  -1.387  -2.543  -6.070
  602    HA   ALA  78           HA       ALA  78   0.617  -1.205  -7.666
  603    HB1  ALA  78           3HB      ALA  78  -0.909   0.090  -6.258
  604    HB2  ALA  78           1HB      ALA  78   0.772   0.358  -5.799
  605    HB3  ALA  78           2HB      ALA  78  -0.252  -0.694  -4.823
  606    H    SER  79           H        SER  79   0.520  -3.114  -4.678
  607    HA   SER  79           HA       SER  79   3.369  -3.061  -4.325
  608    HB2  SER  79           1HB      SER  79   2.838  -4.830  -2.568
  609    HB3  SER  79           2HB      SER  79   2.081  -3.255  -2.336
  610    HG   SER  79           HG       SER  79   0.154  -4.072  -2.925
  611    H    ARG  80           H        ARG  80   1.433  -4.591  -6.464
  612    HA   ARG  80           HA       ARG  80   2.309  -7.212  -6.677
  613    HB2  ARG  80           1HB      ARG  80   0.468  -6.047  -7.957
  614    HB3  ARG  80           2HB      ARG  80   1.713  -5.349  -8.979
  615    HG2  ARG  80           1HG      ARG  80   2.391  -7.597  -9.673
  616    HG3  ARG  80           2HG      ARG  80   1.115  -8.281  -8.662
  617    HD2  ARG  80           1HD      ARG  80  -0.542  -6.955  -9.956
  618    HD3  ARG  80           2HD      ARG  80   0.763  -6.442 -11.023
  619    HE   ARG  80           HE       ARG  80   0.238  -9.306 -10.697
  620   HH11  ARG  80          1HH1      ARG  80   0.179  -6.434 -12.699
  621   HH12  ARG  80          2HH1      ARG  80  -0.089  -7.313 -14.178
  622   HH21  ARG  80          1HH2      ARG  80  -0.119 -10.460 -12.623
  623   HH22  ARG  80          2HH2      ARG  80  -0.274  -9.609 -14.128
  624    H    GLN  81           H        GLN  81   3.901  -4.236  -7.508
  625    HA   GLN  81           HA       GLN  81   5.974  -5.573  -9.047
  626    HB2  GLN  81           1HB      GLN  81   5.495  -2.670  -8.367
  627    HB3  GLN  81           2HB      GLN  81   6.867  -3.241  -9.310
  628    HG2  GLN  81           1HG      GLN  81   3.982  -3.654 -10.061
  629    HG3  GLN  81           2HG      GLN  81   5.017  -2.371 -10.691
  630   HE21  GLN  81          2HE2      GLN  81   3.661  -4.590 -12.074
  631   HE22  GLN  81          1HE2      GLN  81   4.916  -5.442 -12.906
  632    H    ALA  82           H        ALA  82   5.402  -5.240  -5.851
  633    HA   ALA  82           HA       ALA  82   8.083  -4.496  -5.025
  634    HB1  ALA  82           3HB      ALA  82   6.159  -3.797  -3.682
  635    HB2  ALA  82           1HB      ALA  82   7.266  -4.812  -2.754
  636    HB3  ALA  82           2HB      ALA  82   5.761  -5.489  -3.377
  637    H    HIS  83           H        HIS  83   6.386  -7.317  -5.876
  638    HA   HIS  83           HA       HIS  83   7.013  -9.486  -6.099
  639    HB2  HIS  83           1HB      HIS  83   9.697  -8.511  -5.103
  640    HB3  HIS  83           2HB      HIS  83   9.383 -10.161  -5.628
  641    HD1  HIS  83           HD1      HIS  83   9.511 -10.628  -8.095
  642    HD2  HIS  83           HD2      HIS  83   9.521  -6.562  -7.222
  643    HE1  HIS  83           HE1      HIS  83  10.024  -9.467 -10.268
  644    HE2  HIS  83           HE2      HIS  83   9.828  -7.005  -9.751
  645    H    CYS  84           H        CYS  84   6.449  -7.981  -3.340
  646    HA   CYS  84           HA       CYS  84   6.741 -10.427  -1.741
  647    HB2  CYS  84           1HB      CYS  84   6.919  -7.571  -0.753
  648    HB3  CYS  84           2HB      CYS  84   6.980  -9.008   0.262
  649    HG   CYS  84           HG       CYS  84   9.408  -9.903  -0.619
  650    H    LEU  85           H        LEU  85   4.645 -10.927  -2.631
  651    HA   LEU  85           HA       LEU  85   2.443  -9.386  -1.431
  652    HB2  LEU  85           1HB      LEU  85   2.453 -11.335  -3.737
  653    HB3  LEU  85           2HB      LEU  85   1.001 -10.623  -3.056
  654    HG   LEU  85           HG       LEU  85   3.242  -9.055  -4.330
  655   HD11  LEU  85          1HD1      LEU  85   2.064 -10.453  -5.960
  656   HD12  LEU  85          2HD1      LEU  85   1.715  -8.742  -6.201
  657   HD13  LEU  85          3HD1      LEU  85   0.525  -9.782  -5.419
  658   HD21  LEU  85          3HD2      LEU  85   2.014  -7.800  -2.639
  659   HD22  LEU  85          1HD2      LEU  85   0.488  -8.228  -3.416
  660   HD23  LEU  85          2HD2      LEU  85   1.649  -7.200  -4.258
  661    H    MET  86           H        MET  86   1.268 -10.269   0.132
  662    HA   MET  86           HA       MET  86   1.635 -13.138   0.691
  663    HB2  MET  86           1HB      MET  86   1.739 -10.863   2.680
  664    HB3  MET  86           2HB      MET  86   1.639 -12.558   3.130
  665    HG2  MET  86           1HG      MET  86   3.876 -11.328   1.534
  666    HG3  MET  86           2HG      MET  86   3.917 -11.633   3.270
  667    HE1  MET  86           3HE      MET  86   2.383 -14.420   3.480
  668    HE2  MET  86           1HE      MET  86   3.869 -14.051   4.352
  669    HE3  MET  86           2HE      MET  86   3.742 -15.540   3.419
  670    H    GLU  87           H        GLU  87  -0.072 -14.160   1.780
  671    HA   GLU  87           HA       GLU  87  -2.693 -13.173   1.286
  672    HB2  GLU  87           1HB      GLU  87  -1.481 -15.612   2.112
  673    HB3  GLU  87           2HB      GLU  87  -2.691 -15.195   3.315
  674    HG2  GLU  87           1HG      GLU  87  -3.174 -15.436   0.354
  675    HG3  GLU  87           2HG      GLU  87  -3.588 -16.645   1.570
  676    H    ASP  88           H        ASP  88  -4.259 -12.444   2.808
  677    HA   ASP  88           HA       ASP  88  -3.055 -10.999   5.023
  678    HB2  ASP  88           1HB      ASP  88  -5.124  -9.804   5.207
  679    HB3  ASP  88           2HB      ASP  88  -4.716  -9.909   3.500
  680    H    LYS  89           H        LYS  89  -4.925 -13.842   4.468
  681    HA   LYS  89           HA       LYS  89  -5.638 -14.098   7.277
  682    HB2  LYS  89           1HB      LYS  89  -5.971 -16.111   5.045
  683    HB3  LYS  89           2HB      LYS  89  -6.713 -16.180   6.637
  684    HG2  LYS  89           1HG      LYS  89  -7.925 -14.074   6.089
  685    HG3  LYS  89           2HG      LYS  89  -7.278 -14.189   4.452
  686    HD2  LYS  89           1HD      LYS  89  -9.089 -16.167   5.833
  687    HD3  LYS  89           2HD      LYS  89  -9.507 -15.106   4.488
  688    HE2  LYS  89           1HE      LYS  89  -7.457 -17.317   4.405
  689    HE3  LYS  89           2HE      LYS  89  -9.095 -17.423   3.765
  690    HZ1  LYS  89           3HZ      LYS  89  -7.001 -15.525   2.832
  691    HZ2  LYS  89           1HZ      LYS  89  -8.573 -15.666   2.203
  692    HZ3  LYS  89           2HZ      LYS  89  -7.473 -16.945   2.038
  693    H    ALA  90           H        ALA  90  -2.838 -14.321   5.773
  694    HA   ALA  90           HA       ALA  90  -1.876 -16.892   6.582
  695    HB1  ALA  90           3HB      ALA  90   0.322 -16.054   5.936
  696    HB2  ALA  90           1HB      ALA  90  -0.331 -14.420   5.801
  697    HB3  ALA  90           2HB      ALA  90  -0.880 -15.684   4.698
  698    H    GLU  91           H        GLU  91  -1.991 -13.702   7.984
  699    HA   GLU  91           HA       GLU  91  -0.416 -14.605  10.282
  700    HB2  GLU  91           1HB      GLU  91  -1.209 -11.866   9.310
  701    HB3  GLU  91           2HB      GLU  91  -0.515 -12.136  10.902
  702    HG2  GLU  91           1HG      GLU  91   0.804 -12.869   8.299
  703    HG3  GLU  91           2HG      GLU  91   1.142 -11.413   9.235
  704    H    ALA  92           H        ALA  92  -1.476 -15.323  11.976
  705    HA   ALA  92           HA       ALA  92  -4.171 -14.255  12.507
  706    HB1  ALA  92           3HB      ALA  92  -3.120 -17.000  13.186
  707    HB2  ALA  92           1HB      ALA  92  -4.217 -16.619  11.860
  708    HB3  ALA  92           2HB      ALA  92  -4.739 -16.390  13.528
  709    HA   PRO  93           HA       PRO  93  -1.844 -12.996  16.188
  710    HB2  PRO  93           1HB      PRO  93  -3.139 -10.691  16.603
  711    HB3  PRO  93           2HB      PRO  93  -1.931 -10.852  15.323
  712    HG2  PRO  93           1HG      PRO  93  -4.910 -10.860  15.134
  713    HG3  PRO  93           2HG      PRO  93  -3.718 -10.142  14.037
  714    HD2  PRO  93           1HD      PRO  93  -4.994 -12.580  13.653
  715    HD3  PRO  93           2HD      PRO  93  -3.492 -12.075  12.858
  716    H    ASN  94           H        ASN  94  -2.748 -12.095  18.365
  717    HA   ASN  94           HA       ASN  94  -4.615 -14.001  19.370
  718    HB2  ASN  94           1HB      ASN  94  -3.597 -11.496  20.735
  719    HB3  ASN  94           2HB      ASN  94  -4.313 -12.901  21.518
  720   HD21  ASN  94          2HD2      ASN  94  -3.092 -14.779  21.744
  721   HD22  ASN  94          1HD2      ASN  94  -1.377 -14.797  21.500
  722    H    THR  95           H        THR  95  -4.726 -10.465  19.045
  723    HA   THR  95           HA       THR  95  -7.648 -10.657  18.754
  724    HB   THR  95           HB       THR  95  -7.822  -8.415  19.856
  725    HG1  THR  95           HG1      THR  95  -5.074  -8.740  19.943
  726   HG21  THR  95          3HG2      THR  95  -6.631 -10.608  21.558
  727   HG22  THR  95          1HG2      THR  95  -8.333 -10.432  21.126
  728   HG23  THR  95          2HG2      THR  95  -7.556  -9.232  22.160
  729    H    ILE  96           H        ILE  96  -8.474  -8.489  17.735
  730    HA   ILE  96           HA       ILE  96  -7.157  -8.232  15.221
  731    HB   ILE  96           HB       ILE  96  -9.391  -6.543  16.366
  732   HG12  ILE  96          1HG1      ILE  96  -9.502  -8.990  14.584
  733   HG13  ILE  96          2HG1      ILE  96  -9.945  -8.950  16.287
  734   HG21  ILE  96          1HG2      ILE  96  -9.893  -6.002  14.030
  735   HG22  ILE  96          2HG2      ILE  96  -8.486  -6.929  13.514
  736   HG23  ILE  96          3HG2      ILE  96  -8.273  -5.471  14.483
  737   HD11  ILE  96          3HD1      ILE  96 -11.757  -7.394  15.770
  738   HD12  ILE  96          1HD1      ILE  96 -11.908  -8.904  14.872
  739   HD13  ILE  96          2HD1      ILE  96 -11.314  -7.453  14.065
  740    H    ALA  97           H        ALA  97  -7.317  -6.303  18.146
  741    HA   ALA  97           HA       ALA  97  -5.984  -4.029  16.987
  742    HB1  ALA  97           3HB      ALA  97  -6.083  -3.085  19.222
  743    HB2  ALA  97           1HB      ALA  97  -6.588  -4.644  19.875
  744    HB3  ALA  97           2HB      ALA  97  -7.645  -3.767  18.768
  745    H    SER  98           H        SER  98  -4.735  -6.898  17.451
  746    HA   SER  98           HA       SER  98  -2.192  -5.853  18.507
  747    HB2  SER  98           1HB      SER  98  -1.740  -8.183  19.331
  748    HB3  SER  98           2HB      SER  98  -3.071  -7.373  20.155
  749    HG   SER  98           HG       SER  98  -3.805  -8.820  17.918
  750    H    GLY  99           H        GLY  99  -0.356  -6.321  17.369
  751    HA2  GLY  99           1HA      GLY  99   0.419  -8.307  15.809
  752    HA3  GLY  99           2HA      GLY  99  -0.760  -7.556  14.744
  753    H    SER 100           H        SER 100  -0.433  -5.046  14.664
  754    HA   SER 100           HA       SER 100   2.448  -4.529  14.352
  755    HB2  SER 100           1HB      SER 100   0.203  -3.588  12.548
  756    HB3  SER 100           2HB      SER 100   1.908  -3.166  12.370
  757    HG   SER 100           HG       SER 100   1.577  -5.846  12.545
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1 -12.967  17.592  17.183
    2    H2   MET   1           2H       MET   1 -14.191  18.147  16.150
    3    H3   MET   1           3H       MET   1 -13.250  16.808  15.709
    4    HA   MET   1           HA       MET   1 -14.121  15.552  17.575
    5    HB2  MET   1           1HB      MET   1 -15.964  16.396  18.889
    6    HB3  MET   1           2HB      MET   1 -14.622  17.527  18.995
    7    HG2  MET   1           1HG      MET   1 -15.700  19.014  17.430
    8    HG3  MET   1           2HG      MET   1 -17.007  17.856  17.188
    9    HE1  MET   1           3HE      MET   1 -17.429  16.786  20.166
   10    HE2  MET   1           1HE      MET   1 -18.758  17.190  19.079
   11    HE3  MET   1           2HE      MET   1 -18.723  17.849  20.714
   12    H    GLU   2           H        GLU   2 -14.540  16.359  14.635
   13    HA   GLU   2           HA       GLU   2 -17.239  15.806  13.980
   14    HB2  GLU   2           1HB      GLU   2 -14.739  15.250  12.368
   15    HB3  GLU   2           2HB      GLU   2 -16.377  15.329  11.736
   16    HG2  GLU   2           1HG      GLU   2 -16.513  17.654  12.118
   17    HG3  GLU   2           2HG      GLU   2 -15.041  17.648  13.092
   18    H    VAL   3           H        VAL   3 -17.993  13.789  12.908
   19    HA   VAL   3           HA       VAL   3 -17.537  11.493  14.475
   20    HB   VAL   3           HB       VAL   3 -18.672  11.573  11.669
   21   HG11  VAL   3          1HG1      VAL   3 -19.876   9.549  12.351
   22   HG12  VAL   3          2HG1      VAL   3 -19.052   9.586  13.908
   23   HG13  VAL   3          3HG1      VAL   3 -18.128   9.323  12.428
   24   HG21  VAL   3          3HG2      VAL   3 -19.846  13.158  13.091
   25   HG22  VAL   3          1HG2      VAL   3 -20.084  11.911  14.315
   26   HG23  VAL   3          2HG2      VAL   3 -20.870  11.766  12.742
   27    H    GLN   4           H        GLN   4 -16.149  12.673  11.502
   28    HA   GLN   4           HA       GLN   4 -14.725  10.377  10.712
   29    HB2  GLN   4           1HB      GLN   4 -15.151  12.350   9.284
   30    HB3  GLN   4           2HB      GLN   4 -14.043  13.290  10.271
   31    HG2  GLN   4           1HG      GLN   4 -12.188  11.929   9.567
   32    HG3  GLN   4           2HG      GLN   4 -13.271  10.853   8.682
   33   HE21  GLN   4          2HE2      GLN   4 -11.005  12.461   7.728
   34   HE22  GLN   4          1HE2      GLN   4 -11.656  13.474   6.481
   35    H    SER   5           H        SER   5 -14.081  12.789  13.149
   36    HA   SER   5           HA       SER   5 -11.325  11.857  13.448
   37    HB2  SER   5           1HB      SER   5 -11.084  13.768  15.016
   38    HB3  SER   5           2HB      SER   5 -11.621  14.272  13.415
   39    HG   SER   5           HG       SER   5 -13.772  13.735  14.901
   40    H    MET   6           H        MET   6 -14.016  10.546  14.344
   41    HA   MET   6           HA       MET   6 -13.386  10.201  17.184
   42    HB2  MET   6           1HB      MET   6 -15.724   9.230  15.528
   43    HB3  MET   6           2HB      MET   6 -15.503   8.864  17.233
   44    HG2  MET   6           1HG      MET   6 -15.613  11.241  17.764
   45    HG3  MET   6           2HG      MET   6 -15.820  11.617  16.055
   46    HE1  MET   6           3HE      MET   6 -17.987  13.005  16.492
   47    HE2  MET   6           1HE      MET   6 -17.796  12.730  18.223
   48    HE3  MET   6           2HE      MET   6 -19.354  12.433  17.450
   49    H    LEU   7           H        LEU   7 -12.214   9.023  14.476
   50    HA   LEU   7           HA       LEU   7 -11.927   6.282  15.511
   51    HB2  LEU   7           1HB      LEU   7 -11.803   7.243  12.648
   52    HB3  LEU   7           2HB      LEU   7 -11.515   5.596  13.173
   53    HG   LEU   7           HG       LEU   7 -14.139   7.068  13.446
   54   HD11  LEU   7          1HD1      LEU   7 -14.916   5.563  11.684
   55   HD12  LEU   7          2HD1      LEU   7 -13.291   4.899  11.530
   56   HD13  LEU   7          3HD1      LEU   7 -13.597   6.585  11.120
   57   HD21  LEU   7          3HD2      LEU   7 -15.040   4.887  14.065
   58   HD22  LEU   7          1HD2      LEU   7 -13.785   5.396  15.196
   59   HD23  LEU   7          2HD2      LEU   7 -13.425   4.184  13.967
   60    H    LEU   8           H        LEU   8  -9.823   5.291  14.413
   61    HA   LEU   8           HA       LEU   8  -7.638   7.130  15.066
   62    HB2  LEU   8           1HB      LEU   8  -7.616   4.144  14.598
   63    HB3  LEU   8           2HB      LEU   8  -6.231   5.104  15.085
   64    HG   LEU   8           HG       LEU   8  -8.737   4.701  16.724
   65   HD11  LEU   8          1HD1      LEU   8  -5.968   3.552  17.039
   66   HD12  LEU   8          2HD1      LEU   8  -7.414   2.667  16.555
   67   HD13  LEU   8          3HD1      LEU   8  -7.302   3.354  18.176
   68   HD21  LEU   8          3HD2      LEU   8  -6.140   6.084  17.389
   69   HD22  LEU   8          1HD2      LEU   8  -7.463   5.781  18.514
   70   HD23  LEU   8          2HD2      LEU   8  -7.702   6.864  17.143
   71    H    ASN   9           H        ASN   9  -9.322   5.915  12.476
   72    HA   ASN   9           HA       ASN   9  -7.295   6.863  10.583
   73    HB2  ASN   9           1HB      ASN   9  -8.835   4.263  10.429
   74    HB3  ASN   9           2HB      ASN   9  -8.134   5.021   9.006
   75   HD21  ASN   9          2HD2      ASN   9  -7.481   3.365  11.990
   76   HD22  ASN   9          1HD2      ASN   9  -5.824   3.004  11.654
   77    H    ASP  10           H        ASP  10  -8.161   8.173   9.015
   78    HA   ASP  10           HA       ASP  10 -10.735   9.197   9.155
   79    HB2  ASP  10           1HB      ASP  10  -8.883   9.012   6.769
   80    HB3  ASP  10           2HB      ASP  10 -10.371   9.951   6.782
   81    H    VAL  11           H        VAL  11  -9.469   6.624   7.120
   82    HA   VAL  11           HA       VAL  11 -12.221   5.662   6.744
   83    HB   VAL  11           HB       VAL  11  -9.958   5.440   4.745
   84   HG11  VAL  11          1HG1      VAL  11 -12.823   4.512   4.570
   85   HG12  VAL  11          2HG1      VAL  11 -11.400   3.480   4.699
   86   HG13  VAL  11          3HG1      VAL  11 -11.649   4.465   3.256
   87   HG21  VAL  11          3HG2      VAL  11 -10.858   7.697   4.836
   88   HG22  VAL  11          1HG2      VAL  11 -12.498   7.069   4.663
   89   HG23  VAL  11          2HG2      VAL  11 -11.345   6.901   3.339
   90    H    LYS  12           H        LYS  12 -12.435   3.962   7.981
   91    HA   LYS  12           HA       LYS  12 -10.240   2.284   8.765
   92    HB2  LYS  12           1HB      LYS  12 -12.020   2.792  10.343
   93    HB3  LYS  12           2HB      LYS  12 -13.220   2.108   9.259
   94    HG2  LYS  12           1HG      LYS  12 -12.320  -0.103   9.586
   95    HG3  LYS  12           2HG      LYS  12 -10.998   0.548  10.561
   96    HD2  LYS  12           1HD      LYS  12 -12.527   1.271  12.262
   97    HD3  LYS  12           2HD      LYS  12 -13.915   0.860  11.258
   98    HE2  LYS  12           1HE      LYS  12 -11.899  -1.116  12.321
   99    HE3  LYS  12           2HE      LYS  12 -13.475  -0.795  13.041
  100    HZ1  LYS  12           3HZ      LYS  12 -13.891  -2.626  11.743
  101    HZ2  LYS  12           1HZ      LYS  12 -12.836  -2.142  10.501
  102    HZ3  LYS  12           2HZ      LYS  12 -14.338  -1.372  10.695
  103    H    TRP  13           H        TRP  13  -9.520   0.585   7.668
  104    HA   TRP  13           HA       TRP  13 -10.924  -0.274   5.293
  105    HB2  TRP  13           1HB      TRP  13  -8.216  -0.240   6.160
  106    HB3  TRP  13           2HB      TRP  13  -8.649  -1.919   5.857
  107    HD1  TRP  13           HD1      TRP  13 -10.708  -1.073   3.395
  108    HE1  TRP  13           HE1      TRP  13  -9.638  -0.533   1.119
  109    HE3  TRP  13           HE3      TRP  13  -5.944  -0.085   4.962
  110    HZ2  TRP  13           HZ2      TRP  13  -7.100   0.206   0.123
  111    HZ3  TRP  13           HZ3      TRP  13  -4.255   0.528   3.284
  112    HH2  TRP  13           HH2      TRP  13  -4.823   0.670   0.913
  113    H    GLU  14           H        GLU  14 -12.272  -1.952   5.201
  114    HA   GLU  14           HA       GLU  14 -12.628  -3.574   7.575
  115    HB2  GLU  14           1HB      GLU  14 -14.110  -3.568   4.945
  116    HB3  GLU  14           2HB      GLU  14 -14.530  -4.577   6.323
  117    HG2  GLU  14           1HG      GLU  14 -14.730  -2.418   7.643
  118    HG3  GLU  14           2HG      GLU  14 -14.683  -1.593   6.085
  119    H    LYS  15           H        LYS  15 -11.043  -3.796   4.563
  120    HA   LYS  15           HA       LYS  15 -10.619  -6.673   4.910
  121    HB2  LYS  15           1HB      LYS  15  -9.952  -4.811   2.623
  122    HB3  LYS  15           2HB      LYS  15  -9.443  -6.492   2.687
  123    HG2  LYS  15           1HG      LYS  15 -11.757  -7.219   2.697
  124    HG3  LYS  15           2HG      LYS  15 -12.300  -5.540   2.701
  125    HD2  LYS  15           1HD      LYS  15 -12.423  -6.443   0.459
  126    HD3  LYS  15           2HD      LYS  15 -11.184  -5.192   0.538
  127    HE2  LYS  15           1HE      LYS  15 -10.340  -7.024  -0.755
  128    HE3  LYS  15           2HE      LYS  15  -9.475  -6.976   0.779
  129    HZ1  LYS  15           3HZ      LYS  15 -10.116  -9.232   0.115
  130    HZ2  LYS  15           1HZ      LYS  15 -11.755  -8.783   0.169
  131    HZ3  LYS  15           2HZ      LYS  15 -10.830  -8.783   1.591
  132    HA   PRO  16           HA       PRO  16  -6.919  -5.480   7.177
  133    HB2  PRO  16           1HB      PRO  16  -6.433  -8.394   6.815
  134    HB3  PRO  16           2HB      PRO  16  -6.365  -7.415   8.285
  135    HG2  PRO  16           1HG      PRO  16  -8.418  -9.048   7.844
  136    HG3  PRO  16           2HG      PRO  16  -8.669  -7.450   8.573
  137    HD2  PRO  16           1HD      PRO  16  -9.187  -8.364   5.773
  138    HD3  PRO  16           2HD      PRO  16 -10.128  -7.253   6.791
  139    H    VAL  17           H        VAL  17  -4.775  -5.222   6.642
  140    HA   VAL  17           HA       VAL  17  -4.012  -6.122   3.946
  141    HB   VAL  17           HB       VAL  17  -2.942  -3.622   5.241
  142   HG11  VAL  17          1HG1      VAL  17  -2.358  -3.027   2.940
  143   HG12  VAL  17          2HG1      VAL  17  -3.037  -4.553   2.376
  144   HG13  VAL  17          3HG1      VAL  17  -1.622  -4.553   3.429
  145   HG21  VAL  17          3HG2      VAL  17  -5.305  -3.819   3.380
  146   HG22  VAL  17          1HG2      VAL  17  -4.520  -2.323   3.887
  147   HG23  VAL  17          2HG2      VAL  17  -5.346  -3.332   5.074
  148    H    THR  18           H        THR  18  -3.007  -7.994   4.827
  149    HA   THR  18           HA       THR  18  -0.772  -7.696   6.619
  150    HB   THR  18           HB       THR  18  -1.420 -10.061   4.842
  151    HG1  THR  18           HG1      THR  18  -3.198  -9.628   6.198
  152   HG21  THR  18          3HG2      THR  18   0.840 -10.094   5.772
  153   HG22  THR  18          1HG2      THR  18  -0.162 -11.339   6.520
  154   HG23  THR  18          2HG2      THR  18   0.187  -9.846   7.393
  155    H    ILE  19           H        ILE  19   0.691  -6.304   5.767
  156    HA   ILE  19           HA       ILE  19   1.633  -6.785   3.031
  157    HB   ILE  19           HB       ILE  19   0.875  -4.512   3.473
  158   HG12  ILE  19          1HG1      ILE  19   3.878  -4.663   3.167
  159   HG13  ILE  19          2HG1      ILE  19   2.699  -4.834   1.870
  160   HG21  ILE  19          1HG2      ILE  19   2.990  -4.466   5.613
  161   HG22  ILE  19          2HG2      ILE  19   1.246  -4.306   5.831
  162   HG23  ILE  19          3HG2      ILE  19   2.155  -3.038   5.001
  163   HD11  ILE  19          3HD1      ILE  19   3.187  -2.373   3.528
  164   HD12  ILE  19          1HD1      ILE  19   1.952  -2.534   2.278
  165   HD13  ILE  19          2HD1      ILE  19   3.658  -2.625   1.846
  166    H    SER  20           H        SER  20   3.409  -7.912   2.788
  167    HA   SER  20           HA       SER  20   5.294  -8.135   5.005
  168    HB2  SER  20           1HB      SER  20   6.246  -9.991   3.508
  169    HB3  SER  20           2HB      SER  20   4.650 -10.267   4.207
  170    HG   SER  20           HG       SER  20   5.067  -9.190   1.609
  171    H    LEU  21           H        LEU  21   7.098  -6.986   4.995
  172    HA   LEU  21           HA       LEU  21   8.001  -5.757   2.506
  173    HB2  LEU  21           1HB      LEU  21   8.724  -5.320   5.392
  174    HB3  LEU  21           2HB      LEU  21   9.690  -4.653   4.094
  175    HG   LEU  21           HG       LEU  21   7.573  -3.499   3.287
  176   HD11  LEU  21          1HD1      LEU  21   6.628  -4.256   6.049
  177   HD12  LEU  21          2HD1      LEU  21   5.955  -4.839   4.526
  178   HD13  LEU  21          3HD1      LEU  21   5.826  -3.132   4.951
  179   HD21  LEU  21          3HD2      LEU  21   9.400  -2.350   4.424
  180   HD22  LEU  21          1HD2      LEU  21   8.689  -2.753   5.985
  181   HD23  LEU  21          2HD2      LEU  21   7.836  -1.676   4.878
  182    H    GLN  22           H        GLN  22  10.162  -5.925   1.786
  183    HA   GLN  22           HA       GLN  22  11.298  -8.481   1.825
  184    HB2  GLN  22           1HB      GLN  22  11.666  -6.833   0.031
  185    HB3  GLN  22           2HB      GLN  22  12.595  -5.833   1.137
  186    HG2  GLN  22           1HG      GLN  22  14.282  -7.570   1.321
  187    HG3  GLN  22           2HG      GLN  22  13.337  -8.615   0.260
  188   HE21  GLN  22          2HE2      GLN  22  13.248  -8.166  -1.932
  189   HE22  GLN  22          1HE2      GLN  22  14.345  -7.075  -2.697
  190    H    ASN  23           H        ASN  23  11.525  -5.894   4.028
  191    HA   ASN  23           HA       ASN  23  14.033  -6.481   5.215
  192    HB2  ASN  23           1HB      ASN  23  11.627  -5.064   6.385
  193    HB3  ASN  23           2HB      ASN  23  13.250  -5.049   7.064
  194   HD21  ASN  23          2HD2      ASN  23  11.622  -2.828   6.188
  195   HD22  ASN  23          1HD2      ASN  23  12.533  -2.003   4.966
  196    H    GLY  24           H        GLY  24  10.973  -7.998   5.384
  197    HA2  GLY  24           1HA      GLY  24  10.590 -10.079   6.427
  198    HA3  GLY  24           2HA      GLY  24  11.955  -9.773   7.493
  199    H    ALA  25           H        ALA  25   8.739  -8.453   6.734
  200    HA   ALA  25           HA       ALA  25   7.910  -8.510   9.460
  201    HB1  ALA  25           3HB      ALA  25   9.413  -6.574   9.584
  202    HB2  ALA  25           1HB      ALA  25   7.731  -6.114   9.856
  203    HB3  ALA  25           2HB      ALA  25   8.496  -5.786   8.300
  204    HA   PRO  26           HA       PRO  26   4.219  -8.163   6.864
  205    HB2  PRO  26           1HB      PRO  26   2.898 -10.064   8.466
  206    HB3  PRO  26           2HB      PRO  26   3.696 -10.365   6.923
  207    HG2  PRO  26           1HG      PRO  26   4.491 -11.355   9.429
  208    HG3  PRO  26           2HG      PRO  26   5.441 -11.393   7.935
  209    HD2  PRO  26           1HD      PRO  26   5.592  -9.501  10.236
  210    HD3  PRO  26           2HD      PRO  26   6.886 -10.096   9.172
  211    H    ARG  27           H        ARG  27   3.399  -6.201   7.439
  212    HA   ARG  27           HA       ARG  27   2.313  -5.828  10.130
  213    HB2  ARG  27           1HB      ARG  27   2.836  -3.967   7.832
  214    HB3  ARG  27           2HB      ARG  27   1.754  -3.494   9.133
  215    HG2  ARG  27           1HG      ARG  27   3.642  -3.978  10.723
  216    HG3  ARG  27           2HG      ARG  27   4.683  -4.126   9.304
  217    HD2  ARG  27           1HD      ARG  27   4.755  -1.873  10.311
  218    HD3  ARG  27           2HD      ARG  27   4.178  -1.861   8.646
  219    HE   ARG  27           HE       ARG  27   1.931  -1.551   9.514
  220   HH11  ARG  27          1HH1      ARG  27   4.524  -1.109  11.818
  221   HH12  ARG  27          2HH1      ARG  27   3.609  -0.037  12.836
  222   HH21  ARG  27          1HH2      ARG  27   0.703  -0.121  10.876
  223   HH22  ARG  27          2HH2      ARG  27   1.463   0.518  12.306
  224    H    ILE  28           H        ILE  28   0.154  -4.969  10.411
  225    HA   ILE  28           HA       ILE  28  -1.694  -5.651   8.214
  226    HB   ILE  28           HB       ILE  28  -2.269  -6.015  11.165
  227   HG12  ILE  28          1HG1      ILE  28  -1.821  -8.114   9.028
  228   HG13  ILE  28          2HG1      ILE  28  -0.674  -7.699  10.297
  229   HG21  ILE  28          1HG2      ILE  28  -3.900  -6.700   8.719
  230   HG22  ILE  28          2HG2      ILE  28  -4.237  -5.410   9.873
  231   HG23  ILE  28          3HG2      ILE  28  -4.333  -7.094  10.383
  232   HD11  ILE  28          3HD1      ILE  28  -3.420  -8.859  10.710
  233   HD12  ILE  28          1HD1      ILE  28  -2.271  -8.445  11.983
  234   HD13  ILE  28          2HD1      ILE  28  -1.890  -9.728  10.833
  235    H    PHE  29           H        PHE  29  -2.306  -3.705   7.468
  236    HA   PHE  29           HA       PHE  29  -2.447  -1.386   9.133
  237    HB2  PHE  29           1HB      PHE  29  -3.437  -1.827   6.309
  238    HB3  PHE  29           2HB      PHE  29  -3.385  -0.267   7.124
  239    HD1  PHE  29           HD1      PHE  29  -0.830  -0.157   8.392
  240    HD2  PHE  29           HD2      PHE  29  -1.876  -1.871   4.642
  241    HE1  PHE  29           HE1      PHE  29   1.471   0.191   7.596
  242    HE2  PHE  29           HE2      PHE  29   0.424  -1.535   3.842
  243    HZ   PHE  29           HZ       PHE  29   2.102  -0.501   5.318
  244    H    ASN  30           H        ASN  30  -4.135  -0.454  10.106
  245    HA   ASN  30           HA       ASN  30  -6.617  -1.986  10.250
  246    HB2  ASN  30           1HB      ASN  30  -5.748   0.481  11.777
  247    HB3  ASN  30           2HB      ASN  30  -7.173  -0.491  12.120
  248   HD21  ASN  30          2HD2      ASN  30  -3.695  -0.344  12.237
  249   HD22  ASN  30          1HD2      ASN  30  -3.485  -1.672  13.334
  250    H    GLY  31           H        GLY  31  -5.351   0.691   8.614
  251    HA2  GLY  31           1HA      GLY  31  -7.880   1.271   7.395
  252    HA3  GLY  31           2HA      GLY  31  -7.323   2.557   8.457
  253    H    VAL  32           H        VAL  32  -7.687   3.235   5.946
  254    HA   VAL  32           HA       VAL  32  -5.520   2.776   4.180
  255    HB   VAL  32           HB       VAL  32  -7.403   5.138   4.175
  256   HG11  VAL  32          1HG1      VAL  32  -6.954   5.216   1.795
  257   HG12  VAL  32          2HG1      VAL  32  -5.885   3.822   1.930
  258   HG13  VAL  32          3HG1      VAL  32  -5.450   5.347   2.703
  259   HG21  VAL  32          3HG2      VAL  32  -8.814   3.823   2.669
  260   HG22  VAL  32          1HG2      VAL  32  -8.679   3.064   4.256
  261   HG23  VAL  32          2HG2      VAL  32  -7.754   2.432   2.894
  262    H    TYR  33           H        TYR  33  -6.039   4.993   6.783
  263    HA   TYR  33           HA       TYR  33  -4.325   7.079   6.048
  264    HB2  TYR  33           1HB      TYR  33  -5.990   7.170   7.887
  265    HB3  TYR  33           2HB      TYR  33  -4.970   6.096   8.835
  266    HD1  TYR  33           HD1      TYR  33  -5.123   9.450   7.276
  267    HD2  TYR  33           HD2      TYR  33  -3.179   6.944  10.109
  268    HE1  TYR  33           HE1      TYR  33  -3.950  11.408   8.194
  269    HE2  TYR  33           HE2      TYR  33  -1.996   8.887  11.031
  270    HH   TYR  33           HH       TYR  33  -2.876  12.098  10.278
  271    H    GLU  34           H        GLU  34  -3.700   4.131   7.936
  272    HA   GLU  34           HA       GLU  34  -0.994   4.580   8.490
  273    HB2  GLU  34           1HB      GLU  34  -2.529   2.019   8.059
  274    HB3  GLU  34           2HB      GLU  34  -0.838   2.042   8.530
  275    HG2  GLU  34           1HG      GLU  34  -1.468   3.304  10.560
  276    HG3  GLU  34           2HG      GLU  34  -3.162   3.131  10.094
  277    H    ALA  35           H        ALA  35  -2.544   2.936   5.764
  278    HA   ALA  35           HA       ALA  35  -0.220   2.010   4.508
  279    HB1  ALA  35           3HB      ALA  35  -2.867   2.691   3.229
  280    HB2  ALA  35           1HB      ALA  35  -2.476   1.167   4.024
  281    HB3  ALA  35           2HB      ALA  35  -1.620   1.642   2.556
  282    H    PHE  36           H        PHE  36  -2.094   4.980   3.956
  283    HA   PHE  36           HA       PHE  36  -0.652   5.914   1.746
  284    HB2  PHE  36           1HB      PHE  36  -2.823   6.839   2.417
  285    HB3  PHE  36           2HB      PHE  36  -2.096   7.512   3.871
  286    HD1  PHE  36           HD1      PHE  36  -1.609   7.576   0.171
  287    HD2  PHE  36           HD2      PHE  36  -1.505   9.727   3.841
  288    HE1  PHE  36           HE1      PHE  36  -1.093   9.643  -1.059
  289    HE2  PHE  36           HE2      PHE  36  -0.987  11.797   2.617
  290    HZ   PHE  36           HZ       PHE  36  -0.784  11.757   0.163
  291    H    ASP  37           H        ASP  37  -0.200   6.534   5.205
  292    HA   ASP  37           HA       ASP  37   2.020   8.280   4.855
  293    HB2  ASP  37           1HB      ASP  37   0.709   8.374   6.895
  294    HB3  ASP  37           2HB      ASP  37   1.101   6.698   7.265
  295    H    PHE  38           H        PHE  38   1.703   4.832   5.552
  296    HA   PHE  38           HA       PHE  38   4.380   4.253   6.080
  297    HB2  PHE  38           1HB      PHE  38   2.445   2.731   6.478
  298    HB3  PHE  38           2HB      PHE  38   2.368   2.431   4.747
  299    HD1  PHE  38           HD1      PHE  38   4.554   2.105   7.715
  300    HD2  PHE  38           HD2      PHE  38   3.702   0.783   3.761
  301    HE1  PHE  38           HE1      PHE  38   6.175   0.273   7.983
  302    HE2  PHE  38           HE2      PHE  38   5.321  -1.048   4.020
  303    HZ   PHE  38           HZ       PHE  38   6.556  -1.305   6.132
  304    H    LEU  39           H        LEU  39   2.624   4.283   3.003
  305    HA   LEU  39           HA       LEU  39   4.678   3.276   1.377
  306    HB2  LEU  39           1HB      LEU  39   2.477   5.224   0.702
  307    HB3  LEU  39           2HB      LEU  39   3.490   4.418  -0.480
  308    HG   LEU  39           HG       LEU  39   1.625   3.006   1.429
  309   HD11  LEU  39          1HD1      LEU  39   0.226   2.643  -0.553
  310   HD12  LEU  39          2HD1      LEU  39   1.307   3.665  -1.495
  311   HD13  LEU  39          3HD1      LEU  39   0.382   4.354  -0.160
  312   HD21  LEU  39          3HD2      LEU  39   3.173   1.999  -0.960
  313   HD22  LEU  39          1HD2      LEU  39   2.035   1.061   0.008
  314   HD23  LEU  39          2HD2      LEU  39   3.534   1.644   0.730
  315    H    GLN  40           H        GLN  40   4.039   6.520   2.566
  316    HA   GLN  40           HA       GLN  40   5.967   7.772   0.847
  317    HB2  GLN  40           1HB      GLN  40   4.650   8.808   3.362
  318    HB3  GLN  40           2HB      GLN  40   5.587   9.772   2.230
  319    HG2  GLN  40           1HG      GLN  40   3.927   9.220   0.472
  320    HG3  GLN  40           2HG      GLN  40   2.964   8.402   1.700
  321   HE21  GLN  40          2HE2      GLN  40   2.293  10.708   0.056
  322   HE22  GLN  40          1HE2      GLN  40   1.906  11.984   1.163
  323    H    HIS  41           H        HIS  41   5.990   6.296   3.983
  324    HA   HIS  41           HA       HIS  41   8.407   7.466   4.917
  325    HB2  HIS  41           1HB      HIS  41   6.820   5.053   5.730
  326    HB3  HIS  41           2HB      HIS  41   8.406   5.356   6.430
  327    HD1  HIS  41           HD1      HIS  41   7.640   5.918   8.764
  328    HD2  HIS  41           HD2      HIS  41   5.788   8.224   5.845
  329    HE1  HIS  41           HE1      HIS  41   6.382   7.710  10.008
  330    HE2  HIS  41           HE2      HIS  41   5.054   8.893   8.227
  331    H    GLU  42           H        GLU  42   7.892   4.043   4.028
  332    HA   GLU  42           HA       GLU  42  10.090   4.076   2.226
  333    HB2  GLU  42           1HB      GLU  42  11.462   2.381   3.520
  334    HB3  GLU  42           2HB      GLU  42  11.525   4.041   4.081
  335    HG2  GLU  42           1HG      GLU  42   9.799   3.413   5.798
  336    HG3  GLU  42           2HG      GLU  42  10.052   1.734   5.315
  337    H    TRP  43           H        TRP  43   8.298   3.340   1.022
  338    HA   TRP  43           HA       TRP  43   7.578   0.543   1.388
  339    HB2  TRP  43           1HB      TRP  43   5.746   1.921   0.743
  340    HB3  TRP  43           2HB      TRP  43   6.682   2.701  -0.524
  341    HD1  TRP  43           HD1      TRP  43   5.967   1.965  -2.825
  342    HE1  TRP  43           HE1      TRP  43   5.019  -0.170  -3.896
  343    HE3  TRP  43           HE3      TRP  43   5.811  -1.035   1.325
  344    HZ2  TRP  43           HZ2      TRP  43   4.311  -2.766  -3.101
  345    HZ3  TRP  43           HZ3      TRP  43   4.991  -3.331   1.063
  346    HH2  TRP  43           HH2      TRP  43   4.252  -4.173  -1.098
  347    HA   PRO  44           HA       PRO  44  11.290  -0.871  -0.591
  348    HB2  PRO  44           1HB      PRO  44   9.322  -2.973  -1.417
  349    HB3  PRO  44           2HB      PRO  44  10.972  -3.159  -0.809
  350    HG2  PRO  44           1HG      PRO  44   8.876  -3.514   0.800
  351    HG3  PRO  44           2HG      PRO  44  10.356  -2.732   1.382
  352    HD2  PRO  44           1HD      PRO  44   7.706  -1.556   0.802
  353    HD3  PRO  44           2HD      PRO  44   8.983  -0.983   1.889
  354    H    ALA  45           H        ALA  45   8.269  -1.139  -2.499
  355    HA   ALA  45           HA       ALA  45   9.737  -0.998  -4.976
  356    HB1  ALA  45           3HB      ALA  45   7.547  -1.076  -6.051
  357    HB2  ALA  45           1HB      ALA  45   6.763  -0.880  -4.484
  358    HB3  ALA  45           2HB      ALA  45   7.695  -2.338  -4.827
  359    H    ARG  46           H        ARG  46  10.680   0.891  -5.415
  360    HA   ARG  46           HA       ARG  46   9.105   3.363  -5.035
  361    HB2  ARG  46           1HB      ARG  46  11.247   4.519  -4.590
  362    HB3  ARG  46           2HB      ARG  46  10.916   3.262  -3.403
  363    HG2  ARG  46           1HG      ARG  46  12.507   1.805  -4.356
  364    HG3  ARG  46           2HG      ARG  46  12.656   2.798  -5.803
  365    HD2  ARG  46           1HD      ARG  46  13.685   4.575  -4.489
  366    HD3  ARG  46           2HD      ARG  46  13.508   3.606  -3.025
  367    HE   ARG  46           HE       ARG  46  15.154   2.110  -3.844
  368   HH11  ARG  46          1HH1      ARG  46  14.702   4.932  -5.876
  369   HH12  ARG  46          2HH1      ARG  46  16.214   4.731  -6.706
  370   HH21  ARG  46          1HH2      ARG  46  17.147   1.845  -4.931
  371   HH22  ARG  46          2HH2      ARG  46  17.600   2.965  -6.185
  372    H    GLY  47           H        GLY  47   9.381   5.011  -6.609
  373    HA2  GLY  47           1HA      GLY  47  11.063   5.811  -8.279
  374    HA3  GLY  47           2HA      GLY  47  11.001   4.186  -8.939
  375    H    ASP  48           H        ASP  48   8.498   3.555  -9.318
  376    HA   ASP  48           HA       ASP  48   7.934   5.492 -11.439
  377    HB2  ASP  48           1HB      ASP  48   8.733   3.072 -11.898
  378    HB3  ASP  48           2HB      ASP  48   7.085   2.609 -11.488
  379    H    ARG  49           H        ARG  49   5.542   4.414 -12.316
  380    HA   ARG  49           HA       ARG  49   3.775   6.010 -10.786
  381    HB2  ARG  49           1HB      ARG  49   3.248   4.074 -13.044
  382    HB3  ARG  49           2HB      ARG  49   2.093   5.252 -12.432
  383    HG2  ARG  49           1HG      ARG  49   3.214   7.033 -13.347
  384    HG3  ARG  49           2HG      ARG  49   4.764   6.189 -13.362
  385    HD2  ARG  49           1HD      ARG  49   2.417   5.527 -15.135
  386    HD3  ARG  49           2HD      ARG  49   3.803   6.505 -15.620
  387    HE   ARG  49           HE       ARG  49   4.603   3.957 -14.597
  388   HH11  ARG  49          1HH1      ARG  49   3.417   5.624 -17.440
  389   HH12  ARG  49          2HH1      ARG  49   4.024   4.424 -18.549
  390   HH21  ARG  49          1HH2      ARG  49   5.394   2.372 -16.046
  391   HH22  ARG  49          2HH2      ARG  49   5.148   2.579 -17.759
  392    H    ALA  50           H        ALA  50   4.672   2.723 -10.532
  393    HA   ALA  50           HA       ALA  50   2.273   1.658  -9.477
  394    HB1  ALA  50           3HB      ALA  50   3.665  -0.135  -8.590
  395    HB2  ALA  50           1HB      ALA  50   5.114   0.814  -8.921
  396    HB3  ALA  50           2HB      ALA  50   4.111   0.243 -10.254
  397    H    HIS  51           H        HIS  51   5.113   3.141  -7.967
  398    HA   HIS  51           HA       HIS  51   4.119   2.974  -5.303
  399    HB2  HIS  51           1HB      HIS  51   6.538   3.264  -5.943
  400    HB3  HIS  51           2HB      HIS  51   6.162   4.914  -6.416
  401    HD1  HIS  51           HD1      HIS  51   7.403   3.009  -3.662
  402    HD2  HIS  51           HD2      HIS  51   5.093   6.444  -4.048
  403    HE1  HIS  51           HE1      HIS  51   7.587   4.199  -1.457
  404    HE2  HIS  51           HE2      HIS  51   6.341   6.360  -1.784
  405    H    GLU  52           H        GLU  52   4.084   5.412  -7.834
  406    HA   GLU  52           HA       GLU  52   2.941   7.516  -6.355
  407    HB2  GLU  52           1HB      GLU  52   4.058   7.822  -8.513
  408    HB3  GLU  52           2HB      GLU  52   2.777   6.924  -9.314
  409    HG2  GLU  52           1HG      GLU  52   1.175   8.641  -8.753
  410    HG3  GLU  52           2HG      GLU  52   2.405   9.522  -7.846
  411    H    GLN  53           H        GLN  53   1.445   5.071  -8.455
  412    HA   GLN  53           HA       GLN  53  -1.194   6.012  -8.185
  413    HB2  GLN  53           1HB      GLN  53  -0.407   4.460  -9.967
  414    HB3  GLN  53           2HB      GLN  53  -0.284   3.186  -8.765
  415    HG2  GLN  53           1HG      GLN  53  -2.320   3.031 -10.127
  416    HG3  GLN  53           2HG      GLN  53  -2.660   3.224  -8.409
  417   HE21  GLN  53          2HE2      GLN  53  -3.639   5.069  -7.686
  418   HE22  GLN  53          1HE2      GLN  53  -4.360   6.229  -8.747
  419    H    ALA  54           H        ALA  54   0.712   3.707  -6.310
  420    HA   ALA  54           HA       ALA  54  -1.309   2.757  -4.624
  421    HB1  ALA  54           3HB      ALA  54   0.944   1.793  -4.702
  422    HB2  ALA  54           1HB      ALA  54   0.473   2.206  -3.052
  423    HB3  ALA  54           2HB      ALA  54   1.588   3.246  -3.940
  424    H    LEU  55           H        LEU  55   0.766   5.618  -4.364
  425    HA   LEU  55           HA       LEU  55  -0.277   6.583  -1.925
  426    HB2  LEU  55           1HB      LEU  55   1.002   8.042  -4.237
  427    HB3  LEU  55           2HB      LEU  55   0.609   8.797  -2.705
  428    HG   LEU  55           HG       LEU  55   2.556   6.520  -3.073
  429   HD11  LEU  55          1HD1      LEU  55   3.029   9.442  -2.512
  430   HD12  LEU  55          2HD1      LEU  55   3.375   8.610  -4.027
  431   HD13  LEU  55          3HD1      LEU  55   4.265   8.186  -2.564
  432   HD21  LEU  55          3HD2      LEU  55   3.141   6.948  -0.741
  433   HD22  LEU  55          1HD2      LEU  55   1.449   6.481  -0.897
  434   HD23  LEU  55          2HD2      LEU  55   1.876   8.173  -0.644
  435    H    ARG  56           H        ARG  56  -1.073   7.329  -5.293
  436    HA   ARG  56           HA       ARG  56  -3.026   9.263  -4.823
  437    HB2  ARG  56           1HB      ARG  56  -2.021   8.819  -7.025
  438    HB3  ARG  56           2HB      ARG  56  -2.874   7.284  -7.101
  439    HG2  ARG  56           1HG      ARG  56  -5.010   8.466  -7.090
  440    HG3  ARG  56           2HG      ARG  56  -4.155  10.008  -7.009
  441    HD2  ARG  56           1HD      ARG  56  -3.082   9.519  -9.154
  442    HD3  ARG  56           2HD      ARG  56  -3.948   7.985  -9.237
  443    HE   ARG  56           HE       ARG  56  -5.942   9.786  -8.972
  444   HH11  ARG  56          1HH1      ARG  56  -3.236   9.499 -11.177
  445   HH12  ARG  56          2HH1      ARG  56  -4.019  10.390 -12.450
  446   HH21  ARG  56          1HH2      ARG  56  -6.993  10.902 -10.637
  447   HH22  ARG  56          2HH2      ARG  56  -6.164  11.203 -12.140
  448    H    LEU  57           H        LEU  57  -3.354   5.742  -5.133
  449    HA   LEU  57           HA       LEU  57  -6.153   5.623  -4.976
  450    HB2  LEU  57           1HB      LEU  57  -4.050   3.631  -4.148
  451    HB3  LEU  57           2HB      LEU  57  -5.766   3.278  -4.130
  452    HG   LEU  57           HG       LEU  57  -4.190   4.036  -6.590
  453   HD11  LEU  57          1HD1      LEU  57  -3.520   1.858  -5.749
  454   HD12  LEU  57          2HD1      LEU  57  -4.465   1.691  -7.230
  455   HD13  LEU  57          3HD1      LEU  57  -5.209   1.356  -5.665
  456   HD21  LEU  57          3HD2      LEU  57  -6.195   3.349  -7.800
  457   HD22  LEU  57          1HD2      LEU  57  -6.540   4.690  -6.706
  458   HD23  LEU  57          2HD2      LEU  57  -7.022   3.050  -6.270
  459    H    CYS  58           H        CYS  58  -3.710   5.306  -2.408
  460    HA   CYS  58           HA       CYS  58  -5.537   5.021  -0.291
  461    HB2  CYS  58           1HB      CYS  58  -2.734   6.161  -0.221
  462    HB3  CYS  58           2HB      CYS  58  -3.641   5.565   1.166
  463    HG   CYS  58           HG       CYS  58  -2.163   3.805  -1.332
  464    H    ARG  59           H        ARG  59  -4.062   7.860  -1.767
  465    HA   ARG  59           HA       ARG  59  -4.962   9.788   0.068
  466    HB2  ARG  59           1HB      ARG  59  -3.232  10.211  -1.630
  467    HB3  ARG  59           2HB      ARG  59  -4.440  10.065  -2.900
  468    HG2  ARG  59           1HG      ARG  59  -5.597  12.024  -2.035
  469    HG3  ARG  59           2HG      ARG  59  -4.397  12.167  -0.748
  470    HD2  ARG  59           1HD      ARG  59  -2.642  12.450  -2.448
  471    HD3  ARG  59           2HD      ARG  59  -3.870  12.368  -3.710
  472    HE   ARG  59           HE       ARG  59  -4.796  14.375  -2.224
  473   HH11  ARG  59          1HH1      ARG  59  -1.563  13.732  -3.436
  474   HH12  ARG  59          2HH1      ARG  59  -1.129  15.413  -3.500
  475   HH21  ARG  59          1HH2      ARG  59  -4.227  16.556  -2.306
  476   HH22  ARG  59          2HH2      ARG  59  -2.647  17.026  -2.852
  477    H    ALA  60           H        ALA  60  -6.376   8.658  -2.992
  478    HA   ALA  60           HA       ALA  60  -8.686  10.286  -2.844
  479    HB1  ALA  60           3HB      ALA  60  -8.291   7.704  -4.352
  480    HB2  ALA  60           1HB      ALA  60  -7.887   9.316  -4.943
  481    HB3  ALA  60           2HB      ALA  60  -9.570   8.888  -4.631
  482    H    SER  61           H        SER  61  -7.934   7.074  -1.637
  483    HA   SER  61           HA       SER  61 -10.563   6.326  -0.933
  484    HB2  SER  61           1HB      SER  61  -7.932   5.481   0.296
  485    HB3  SER  61           2HB      SER  61  -9.479   4.675   0.554
  486    HG   SER  61           HG       SER  61  -7.977   4.888  -1.840
  487    H    LEU  62           H        LEU  62  -8.073   8.175   0.764
  488    HA   LEU  62           HA       LEU  62  -9.442   8.351   3.242
  489    HB2  LEU  62           1HB      LEU  62  -7.319  10.089   1.997
  490    HB3  LEU  62           2HB      LEU  62  -7.944  10.353   3.614
  491    HG   LEU  62           HG       LEU  62  -6.522   7.857   2.682
  492   HD11  LEU  62          1HD1      LEU  62  -4.705   8.629   4.134
  493   HD12  LEU  62          2HD1      LEU  62  -5.595  10.121   4.441
  494   HD13  LEU  62          3HD1      LEU  62  -5.016   9.759   2.815
  495   HD21  LEU  62          3HD2      LEU  62  -7.463   8.685   5.425
  496   HD22  LEU  62          1HD2      LEU  62  -6.522   7.242   5.046
  497   HD23  LEU  62          2HD2      LEU  62  -8.167   7.410   4.431
  498    H    MET  63           H        MET  63 -10.077   9.733   0.242
  499    HA   MET  63           HA       MET  63 -11.715  11.858   1.440
  500    HB2  MET  63           1HB      MET  63 -10.715  11.451  -1.382
  501    HB3  MET  63           2HB      MET  63 -11.909  12.668  -0.953
  502    HG2  MET  63           1HG      MET  63  -9.118  12.497   0.164
  503    HG3  MET  63           2HG      MET  63  -9.643  13.584  -1.121
  504    HE1  MET  63           3HE      MET  63 -11.424  15.554  -0.750
  505    HE2  MET  63           1HE      MET  63 -12.225  15.856   0.789
  506    HE3  MET  63           2HE      MET  63 -12.560  14.373  -0.103
  507    H    GLY  64           H        GLY  64 -12.064   8.768   0.865
  508    HA2  GLY  64           1HA      GLY  64 -13.918   7.426   0.647
  509    HA3  GLY  64           2HA      GLY  64 -14.897   8.885   0.666
  510    H    ASP  65           H        ASP  65 -12.399   8.599  -1.703
  511    HA   ASP  65           HA       ASP  65 -14.417   8.683  -3.796
  512    HB2  ASP  65           1HB      ASP  65 -12.365  10.182  -3.729
  513    HB3  ASP  65           2HB      ASP  65 -11.415   8.756  -4.133
  514    H    VAL  66           H        VAL  66 -11.617   6.702  -2.915
  515    HA   VAL  66           HA       VAL  66 -12.349   4.688  -4.885
  516    HB   VAL  66           HB       VAL  66  -9.991   4.884  -2.999
  517   HG11  VAL  66          1HG1      VAL  66  -9.061   2.965  -4.248
  518   HG12  VAL  66          2HG1      VAL  66 -10.612   2.777  -5.067
  519   HG13  VAL  66          3HG1      VAL  66 -10.502   2.547  -3.320
  520   HG21  VAL  66          3HG2      VAL  66  -8.700   5.220  -5.056
  521   HG22  VAL  66          1HG2      VAL  66  -9.924   6.473  -4.837
  522   HG23  VAL  66          2HG2      VAL  66 -10.193   5.168  -5.994
  523    H    ALA  67           H        ALA  67 -13.318   2.805  -4.409
  524    HA   ALA  67           HA       ALA  67 -14.454   2.337  -1.858
  525    HB1  ALA  67           3HB      ALA  67 -15.503   1.521  -3.903
  526    HB2  ALA  67           1HB      ALA  67 -15.174   0.189  -2.794
  527    HB3  ALA  67           2HB      ALA  67 -14.131   0.451  -4.193
  528    H    GLY  68           H        GLY  68 -13.988   0.663  -0.375
  529    HA2  GLY  68           1HA      GLY  68 -11.321   0.624   0.418
  530    HA3  GLY  68           2HA      GLY  68 -12.574  -0.432   1.047
  531    H    GLU  69           H        GLU  69 -13.172  -1.937  -1.227
  532    HA   GLU  69           HA       GLU  69 -11.056  -3.832  -1.077
  533    HB2  GLU  69           1HB      GLU  69 -13.395  -3.750  -2.989
  534    HB3  GLU  69           2HB      GLU  69 -12.375  -5.145  -2.667
  535    HG2  GLU  69           1HG      GLU  69 -13.119  -5.060  -0.294
  536    HG3  GLU  69           2HG      GLU  69 -14.248  -3.784  -0.747
  537    H    ILE  70           H        ILE  70 -12.089  -1.547  -3.561
  538    HA   ILE  70           HA       ILE  70 -10.485  -2.375  -5.674
  539    HB   ILE  70           HB       ILE  70 -11.259   0.456  -4.947
  540   HG12  ILE  70          1HG1      ILE  70 -12.565  -1.546  -6.805
  541   HG13  ILE  70          2HG1      ILE  70 -13.185  -1.037  -5.237
  542   HG21  ILE  70          1HG2      ILE  70 -10.876   0.978  -7.308
  543   HG22  ILE  70          2HG2      ILE  70 -10.298  -0.665  -7.578
  544   HG23  ILE  70          3HG2      ILE  70  -9.400   0.422  -6.520
  545   HD11  ILE  70          3HD1      ILE  70 -13.448   1.239  -6.086
  546   HD12  ILE  70          1HD1      ILE  70 -14.355   0.073  -7.048
  547   HD13  ILE  70          2HD1      ILE  70 -12.831   0.722  -7.655
  548    H    ALA  71           H        ALA  71  -9.763  -0.014  -3.123
  549    HA   ALA  71           HA       ALA  71  -7.192   0.661  -4.046
  550    HB1  ALA  71           3HB      ALA  71  -8.289   0.844  -1.245
  551    HB2  ALA  71           1HB      ALA  71  -8.466   2.063  -2.506
  552    HB3  ALA  71           2HB      ALA  71  -6.868   1.686  -1.863
  553    H    ARG  72           H        ARG  72  -8.263  -1.777  -1.675
  554    HA   ARG  72           HA       ARG  72  -5.603  -2.276  -0.776
  555    HB2  ARG  72           1HB      ARG  72  -7.907  -2.735   0.404
  556    HB3  ARG  72           2HB      ARG  72  -7.761  -4.300  -0.392
  557    HG2  ARG  72           1HG      ARG  72  -5.262  -3.867   0.731
  558    HG3  ARG  72           2HG      ARG  72  -6.399  -3.280   1.944
  559    HD2  ARG  72           1HD      ARG  72  -5.953  -5.597   2.360
  560    HD3  ARG  72           2HD      ARG  72  -7.607  -5.438   1.774
  561    HE   ARG  72           HE       ARG  72  -6.042  -5.941  -0.449
  562   HH11  ARG  72          1HH1      ARG  72  -6.718  -7.566   2.574
  563   HH12  ARG  72          2HH1      ARG  72  -6.625  -9.158   1.885
  564   HH21  ARG  72          1HH2      ARG  72  -5.899  -8.048  -1.357
  565   HH22  ARG  72          2HH2      ARG  72  -6.198  -9.437  -0.351
  566    H    THR  73           H        THR  73  -7.708  -3.833  -3.161
  567    HA   THR  73           HA       THR  73  -6.015  -6.079  -3.562
  568    HB   THR  73           HB       THR  73  -7.965  -4.885  -5.543
  569    HG1  THR  73           HG1      THR  73  -8.426  -6.932  -3.590
  570   HG21  THR  73          3HG2      THR  73  -6.871  -7.687  -5.238
  571   HG22  THR  73          1HG2      THR  73  -6.446  -6.543  -6.512
  572   HG23  THR  73          2HG2      THR  73  -8.087  -7.181  -6.411
  573    H    ALA  74           H        ALA  74  -6.329  -2.946  -5.201
  574    HA   ALA  74           HA       ALA  74  -4.331  -3.434  -7.154
  575    HB1  ALA  74           3HB      ALA  74  -5.300  -0.796  -6.056
  576    HB2  ALA  74           1HB      ALA  74  -6.027  -1.680  -7.397
  577    HB3  ALA  74           2HB      ALA  74  -4.394  -1.031  -7.550
  578    H    PHE  75           H        PHE  75  -4.272  -2.289  -3.866
  579    HA   PHE  75           HA       PHE  75  -1.661  -1.307  -3.705
  580    HB2  PHE  75           1HB      PHE  75  -3.425  -1.147  -1.926
  581    HB3  PHE  75           2HB      PHE  75  -3.167  -2.851  -1.579
  582    HD1  PHE  75           HD2      PHE  75  -1.119  -3.603  -0.493
  583    HD2  PHE  75           HD1      PHE  75  -1.858   0.520  -1.237
  584    HE1  PHE  75           HE2      PHE  75   0.663  -3.003   1.089
  585    HE2  PHE  75           HE1      PHE  75  -0.078   1.125   0.348
  586    HZ   PHE  75           HZ       PHE  75   1.187  -0.632   1.508
  587    H    VAL  76           H        VAL  76  -2.928  -4.594  -3.272
  588    HA   VAL  76           HA       VAL  76  -0.456  -5.839  -2.716
  589    HB   VAL  76           HB       VAL  76  -2.942  -7.056  -3.941
  590   HG11  VAL  76          1HG1      VAL  76  -2.072  -9.186  -3.090
  591   HG12  VAL  76          2HG1      VAL  76  -0.599  -8.369  -2.565
  592   HG13  VAL  76          3HG1      VAL  76  -0.988  -8.471  -4.283
  593   HG21  VAL  76          3HG2      VAL  76  -3.390  -6.001  -1.790
  594   HG22  VAL  76          1HG2      VAL  76  -2.048  -6.888  -1.065
  595   HG23  VAL  76          2HG2      VAL  76  -3.466  -7.759  -1.653
  596    H    ALA  77           H        ALA  77  -2.106  -5.048  -5.711
  597    HA   ALA  77           HA       ALA  77  -0.476  -6.521  -7.475
  598    HB1  ALA  77           3HB      ALA  77  -1.914  -3.917  -7.993
  599    HB2  ALA  77           1HB      ALA  77  -2.611  -5.528  -8.154
  600    HB3  ALA  77           2HB      ALA  77  -1.297  -5.026  -9.217
  601    H    ALA  78           H        ALA  78  -0.176  -3.254  -6.144
  602    HA   ALA  78           HA       ALA  78   2.225  -2.622  -7.557
  603    HB1  ALA  78           3HB      ALA  78   0.732  -0.883  -6.693
  604    HB2  ALA  78           1HB      ALA  78   2.368  -0.702  -6.060
  605    HB3  ALA  78           2HB      ALA  78   1.100  -1.388  -5.044
  606    H    SER  79           H        SER  79   1.477  -4.345  -4.665
  607    HA   SER  79           HA       SER  79   4.009  -4.147  -3.390
  608    HB2  SER  79           1HB      SER  79   1.874  -6.277  -3.102
  609    HB3  SER  79           2HB      SER  79   3.207  -5.989  -1.984
  610    HG   SER  79           HG       SER  79   1.285  -4.008  -2.645
  611    H    ARG  80           H        ARG  80   2.908  -5.878  -6.102
  612    HA   ARG  80           HA       ARG  80   4.466  -8.229  -5.862
  613    HB2  ARG  80           1HB      ARG  80   3.353  -6.920  -8.349
  614    HB3  ARG  80           2HB      ARG  80   3.963  -8.566  -8.245
  615    HG2  ARG  80           1HG      ARG  80   2.205  -9.110  -6.631
  616    HG3  ARG  80           2HG      ARG  80   1.587  -7.464  -6.761
  617    HD2  ARG  80           1HD      ARG  80   1.197  -7.842  -9.169
  618    HD3  ARG  80           2HD      ARG  80   1.740  -9.508  -8.972
  619    HE   ARG  80           HE       ARG  80  -0.350  -8.935  -7.154
  620   HH11  ARG  80          1HH1      ARG  80   0.272  -9.646 -10.524
  621   HH12  ARG  80          2HH1      ARG  80  -1.347 -10.195 -10.836
  622   HH21  ARG  80          1HH2      ARG  80  -2.477  -9.690  -7.544
  623   HH22  ARG  80          2HH2      ARG  80  -2.916 -10.218  -9.147
  624    H    GLN  81           H        GLN  81   5.235  -5.003  -6.862
  625    HA   GLN  81           HA       GLN  81   7.563  -5.687  -8.371
  626    HB2  GLN  81           1HB      GLN  81   6.814  -3.079  -7.039
  627    HB3  GLN  81           2HB      GLN  81   8.152  -3.292  -8.160
  628    HG2  GLN  81           1HG      GLN  81   6.402  -4.124  -9.815
  629    HG3  GLN  81           2HG      GLN  81   5.210  -3.447  -8.706
  630   HE21  GLN  81          2HE2      GLN  81   5.850  -2.705 -11.438
  631   HE22  GLN  81          1HE2      GLN  81   6.291  -1.029 -11.389
  632    H    ALA  82           H        ALA  82   6.861  -5.289  -5.009
  633    HA   ALA  82           HA       ALA  82   9.627  -5.121  -4.201
  634    HB1  ALA  82           3HB      ALA  82   7.149  -5.691  -2.571
  635    HB2  ALA  82           1HB      ALA  82   7.876  -4.105  -2.829
  636    HB3  ALA  82           2HB      ALA  82   8.752  -5.340  -1.926
  637    H    HIS  83           H        HIS  83   7.492  -7.523  -5.196
  638    HA   HIS  83           HA       HIS  83   7.604  -9.764  -5.408
  639    HB2  HIS  83           1HB      HIS  83  10.526  -9.251  -4.827
  640    HB3  HIS  83           2HB      HIS  83   9.888 -10.825  -5.302
  641    HD1  HIS  83           HD1      HIS  83   8.834 -10.970  -7.735
  642    HD2  HIS  83           HD2      HIS  83  10.957  -7.492  -6.902
  643    HE1  HIS  83           HE1      HIS  83   9.232  -9.869  -9.959
  644    HE2  HIS  83           HE2      HIS  83  10.638  -7.841  -9.450
  645    H    CYS  84           H        CYS  84   7.057  -8.526  -2.811
  646    HA   CYS  84           HA       CYS  84   7.518 -10.902  -1.151
  647    HB2  CYS  84           1HB      CYS  84   7.395  -8.053  -0.133
  648    HB3  CYS  84           2HB      CYS  84   7.698  -9.499   0.824
  649    HG   CYS  84           HG       CYS  84   9.818  -8.620  -1.695
  650    H    LEU  85           H        LEU  85   5.509 -11.604  -2.012
  651    HA   LEU  85           HA       LEU  85   3.157 -10.006  -1.323
  652    HB2  LEU  85           1HB      LEU  85   3.490 -12.405  -3.118
  653    HB3  LEU  85           2HB      LEU  85   1.953 -11.631  -2.788
  654    HG   LEU  85           HG       LEU  85   4.301 -10.278  -4.108
  655   HD11  LEU  85          1HD1      LEU  85   1.768 -11.406  -5.291
  656   HD12  LEU  85          2HD1      LEU  85   3.399 -12.034  -5.524
  657   HD13  LEU  85          3HD1      LEU  85   2.967 -10.447  -6.157
  658   HD21  LEU  85          3HD2      LEU  85   2.668  -8.533  -4.632
  659   HD22  LEU  85          1HD2      LEU  85   2.850  -8.745  -2.891
  660   HD23  LEU  85          2HD2      LEU  85   1.439  -9.408  -3.717
  661    H    MET  86           H        MET  86   1.760 -10.576   0.198
  662    HA   MET  86           HA       MET  86   1.570 -13.395   0.967
  663    HB2  MET  86           1HB      MET  86   1.749 -11.047   2.857
  664    HB3  MET  86           2HB      MET  86   1.057 -12.587   3.337
  665    HG2  MET  86           1HG      MET  86   3.225 -13.664   2.745
  666    HG3  MET  86           2HG      MET  86   3.887 -12.054   2.471
  667    HE1  MET  86           3HE      MET  86   1.303 -13.184   5.229
  668    HE2  MET  86           1HE      MET  86   2.385 -13.572   6.567
  669    HE3  MET  86           2HE      MET  86   2.408 -14.553   5.100
  670    H    GLU  87           H        GLU  87  -0.354 -13.883   0.095
  671    HA   GLU  87           HA       GLU  87  -2.507 -12.072  -0.164
  672    HB2  GLU  87           1HB      GLU  87  -2.194 -14.155  -1.506
  673    HB3  GLU  87           2HB      GLU  87  -2.621 -15.094  -0.083
  674    HG2  GLU  87           1HG      GLU  87  -4.838 -14.406  -0.142
  675    HG3  GLU  87           2HG      GLU  87  -4.477 -13.015  -1.167
  676    H    ASP  88           H        ASP  88  -4.192 -11.609   1.179
  677    HA   ASP  88           HA       ASP  88  -3.479 -11.795   3.913
  678    HB2  ASP  88           1HB      ASP  88  -4.612  -9.834   2.776
  679    HB3  ASP  88           2HB      ASP  88  -6.106 -10.762   2.858
  680    H    LYS  89           H        LYS  89  -4.940 -12.409   5.636
  681    HA   LYS  89           HA       LYS  89  -5.808 -15.135   5.154
  682    HB2  LYS  89           1HB      LYS  89  -5.995 -15.013   7.762
  683    HB3  LYS  89           2HB      LYS  89  -4.415 -15.097   6.992
  684    HG2  LYS  89           1HG      LYS  89  -4.206 -12.657   7.187
  685    HG3  LYS  89           2HG      LYS  89  -5.769 -12.602   8.005
  686    HD2  LYS  89           1HD      LYS  89  -4.942 -13.776   9.875
  687    HD3  LYS  89           2HD      LYS  89  -3.483 -14.272   9.016
  688    HE2  LYS  89           1HE      LYS  89  -4.180 -11.426   9.731
  689    HE3  LYS  89           2HE      LYS  89  -3.092 -12.457  10.660
  690    HZ1  LYS  89           3HZ      LYS  89  -1.729 -11.155   9.277
  691    HZ2  LYS  89           1HZ      LYS  89  -2.700 -11.412   7.908
  692    HZ3  LYS  89           2HZ      LYS  89  -1.771 -12.680   8.544
  693    H    ALA  90           H        ALA  90  -7.246 -12.104   5.331
  694    HA   ALA  90           HA       ALA  90  -9.785 -13.118   6.363
  695    HB1  ALA  90           3HB      ALA  90  -9.057 -10.878   7.028
  696    HB2  ALA  90           1HB      ALA  90 -10.573 -10.823   6.128
  697    HB3  ALA  90           2HB      ALA  90  -9.060 -10.375   5.339
  698    H    GLU  91           H        GLU  91  -8.287 -13.642   3.657
  699    HA   GLU  91           HA       GLU  91 -10.725 -13.460   2.021
  700    HB2  GLU  91           1HB      GLU  91  -7.886 -13.371   0.981
  701    HB3  GLU  91           2HB      GLU  91  -9.363 -13.172   0.045
  702    HG2  GLU  91           1HG      GLU  91  -9.853 -11.118   1.322
  703    HG3  GLU  91           2HG      GLU  91  -8.312 -11.302   2.156
  704    H    ALA  92           H        ALA  92 -11.243 -15.271   0.808
  705    HA   ALA  92           HA       ALA  92 -11.523 -17.498   0.487
  706    HB1  ALA  92           3HB      ALA  92  -8.534 -17.658   0.868
  707    HB2  ALA  92           1HB      ALA  92  -9.361 -17.345  -0.657
  708    HB3  ALA  92           2HB      ALA  92  -9.560 -18.900   0.152
  709    HA   PRO  93           HA       PRO  93 -12.051 -17.901   4.991
  710    HB2  PRO  93           1HB      PRO  93 -14.155 -19.762   4.021
  711    HB3  PRO  93           2HB      PRO  93 -14.267 -18.444   5.192
  712    HG2  PRO  93           1HG      PRO  93 -15.260 -18.172   2.741
  713    HG3  PRO  93           2HG      PRO  93 -14.438 -16.821   3.545
  714    HD2  PRO  93           1HD      PRO  93 -13.436 -18.643   1.397
  715    HD3  PRO  93           2HD      PRO  93 -13.173 -16.899   1.610
  716    H    ASN  94           H        ASN  94 -11.566 -20.457   2.640
  717    HA   ASN  94           HA       ASN  94 -11.381 -22.505   4.680
  718    HB2  ASN  94           1HB      ASN  94 -11.014 -22.548   1.689
  719    HB3  ASN  94           2HB      ASN  94 -10.708 -23.956   2.700
  720   HD21  ASN  94          2HD2      ASN  94 -12.823 -23.418   4.565
  721   HD22  ASN  94          1HD2      ASN  94 -14.312 -23.778   3.754
  722    H    THR  95           H        THR  95  -9.321 -20.148   3.629
  723    HA   THR  95           HA       THR  95  -6.857 -21.575   3.583
  724    HB   THR  95           HB       THR  95  -7.364 -18.646   4.170
  725    HG1  THR  95           HG1      THR  95  -7.843 -18.622   2.115
  726   HG21  THR  95          3HG2      THR  95  -5.140 -19.364   4.897
  727   HG22  THR  95          1HG2      THR  95  -5.033 -18.321   3.480
  728   HG23  THR  95          2HG2      THR  95  -4.840 -20.065   3.307
  729    H    ILE  96           H        ILE  96  -8.554 -19.702   6.082
  730    HA   ILE  96           HA       ILE  96  -6.529 -20.439   8.043
  731    HB   ILE  96           HB       ILE  96  -7.818 -18.941   9.579
  732   HG12  ILE  96          1HG1      ILE  96  -9.347 -18.237   7.063
  733   HG13  ILE  96          2HG1      ILE  96 -10.004 -19.156   8.413
  734   HG21  ILE  96          1HG2      ILE  96  -5.868 -18.143   8.374
  735   HG22  ILE  96          2HG2      ILE  96  -7.075 -16.865   8.502
  736   HG23  ILE  96          3HG2      ILE  96  -6.872 -17.735   6.983
  737   HD11  ILE  96          3HD1      ILE  96  -9.713 -17.227   9.873
  738   HD12  ILE  96          1HD1      ILE  96 -10.714 -16.832   8.477
  739   HD13  ILE  96          2HD1      ILE  96  -9.032 -16.308   8.531
  740    H    ALA  97           H        ALA  97  -6.889 -21.677   9.817
  741    HA   ALA  97           HA       ALA  97  -9.082 -23.531   9.702
  742    HB1  ALA  97           3HB      ALA  97  -6.841 -24.276  10.340
  743    HB2  ALA  97           1HB      ALA  97  -8.010 -24.594  11.621
  744    HB3  ALA  97           2HB      ALA  97  -6.896 -23.234  11.763
  745    H    SER  98           H        SER  98 -10.828 -23.648  11.042
  746    HA   SER  98           HA       SER  98 -11.066 -21.664  13.186
  747    HB2  SER  98           1HB      SER  98 -13.202 -22.123  11.089
  748    HB3  SER  98           2HB      SER  98 -13.268 -20.975  12.426
  749    HG   SER  98           HG       SER  98 -11.074 -20.377  11.220
  750    H    GLY  99           H        GLY  99 -11.331 -22.889  14.937
  751    HA2  GLY  99           1HA      GLY  99 -12.392 -24.330  16.398
  752    HA3  GLY  99           2HA      GLY  99 -13.597 -24.640  15.154
  753    H    SER 100           H        SER 100 -13.698 -26.787  14.937
  754    HA   SER 100           HA       SER 100 -11.280 -28.383  15.072
  755    HB2  SER 100           1HB      SER 100 -12.936 -30.297  14.811
  756    HB3  SER 100           2HB      SER 100 -13.130 -29.307  16.258
  757    HG   SER 100           HG       SER 100 -14.632 -29.121  13.853
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1  -7.207  24.939   7.289
    2    H2   MET   1           2H       MET   1  -8.250  25.570   6.118
    3    H3   MET   1           3H       MET   1  -8.884  24.888   7.532
    4    HA   MET   1           HA       MET   1  -7.379  27.414   7.235
    5    HB2  MET   1           1HB      MET   1 -10.112  26.740   8.350
    6    HB3  MET   1           2HB      MET   1  -9.377  28.336   8.418
    7    HG2  MET   1           1HG      MET   1  -9.411  28.517   6.028
    8    HG3  MET   1           2HG      MET   1  -9.965  26.851   5.869
    9    HE1  MET   1           3HE      MET   1 -11.155  29.459   8.558
   10    HE2  MET   1           1HE      MET   1 -12.538  30.196   7.748
   11    HE3  MET   1           2HE      MET   1 -10.907  30.463   7.131
   12    H    GLU   2           H        GLU   2  -7.532  28.625   9.463
   13    HA   GLU   2           HA       GLU   2  -6.033  26.957  11.305
   14    HB2  GLU   2           1HB      GLU   2  -6.652  29.915  11.309
   15    HB3  GLU   2           2HB      GLU   2  -5.639  29.108  12.497
   16    HG2  GLU   2           1HG      GLU   2  -4.009  28.562  10.862
   17    HG3  GLU   2           2HG      GLU   2  -5.065  29.084   9.549
   18    H    VAL   3           H        VAL   3  -8.787  29.206  11.569
   19    HA   VAL   3           HA       VAL   3  -9.460  28.333  14.205
   20    HB   VAL   3           HB       VAL   3 -11.060  29.950  12.211
   21   HG11  VAL   3          1HG1      VAL   3 -11.552  29.488  15.150
   22   HG12  VAL   3          2HG1      VAL   3 -12.546  28.898  13.819
   23   HG13  VAL   3          3HG1      VAL   3 -12.430  30.631  14.133
   24   HG21  VAL   3          3HG2      VAL   3  -9.002  31.040  12.881
   25   HG22  VAL   3          1HG2      VAL   3  -9.391  30.776  14.581
   26   HG23  VAL   3          2HG2      VAL   3 -10.386  31.858  13.607
   27    H    GLN   4           H        GLN   4 -11.180  28.003  11.099
   28    HA   GLN   4           HA       GLN   4 -12.800  25.871  12.183
   29    HB2  GLN   4           1HB      GLN   4 -12.663  27.086   9.417
   30    HB3  GLN   4           2HB      GLN   4 -13.795  25.822   9.888
   31    HG2  GLN   4           1HG      GLN   4 -14.744  27.313  11.580
   32    HG3  GLN   4           2HG      GLN   4 -13.621  28.578  11.087
   33   HE21  GLN   4          2HE2      GLN   4 -16.537  28.551  11.096
   34   HE22  GLN   4          1HE2      GLN   4 -17.018  28.879   9.463
   35    H    SER   5           H        SER   5 -12.187  23.840  12.222
   36    HA   SER   5           HA       SER   5  -9.673  23.038  11.177
   37    HB2  SER   5           1HB      SER   5 -11.868  21.292  12.305
   38    HB3  SER   5           2HB      SER   5 -10.148  20.909  12.212
   39    HG   SER   5           HG       SER   5  -9.998  22.998  13.536
   40    H    MET   6           H        MET   6  -9.166  21.666   9.528
   41    HA   MET   6           HA       MET   6 -11.295  21.065   7.599
   42    HB2  MET   6           1HB      MET   6  -9.337  22.281   6.740
   43    HB3  MET   6           2HB      MET   6  -8.281  20.991   7.299
   44    HG2  MET   6           1HG      MET   6  -9.396  19.439   5.751
   45    HG3  MET   6           2HG      MET   6 -10.394  20.769   5.165
   46    HE1  MET   6           3HE      MET   6  -6.778  19.282   5.412
   47    HE2  MET   6           1HE      MET   6  -6.584  20.853   6.189
   48    HE3  MET   6           2HE      MET   6  -5.812  20.536   4.635
   49    H    LEU   7           H        LEU   7 -12.224  19.177   8.152
   50    HA   LEU   7           HA       LEU   7 -10.595  17.007   9.200
   51    HB2  LEU   7           1HB      LEU   7 -13.568  17.187   8.701
   52    HB3  LEU   7           2HB      LEU   7 -12.756  15.830   9.458
   53    HG   LEU   7           HG       LEU   7 -12.911  18.638  10.561
   54   HD11  LEU   7          1HD1      LEU   7 -15.029  17.482  10.730
   55   HD12  LEU   7          2HD1      LEU   7 -14.276  17.590  12.322
   56   HD13  LEU   7          3HD1      LEU   7 -14.233  16.071  11.426
   57   HD21  LEU   7          3HD2      LEU   7 -10.800  17.575  11.148
   58   HD22  LEU   7          1HD2      LEU   7 -11.664  16.150  11.726
   59   HD23  LEU   7          2HD2      LEU   7 -11.851  17.693  12.559
   60    H    LEU   8           H        LEU   8 -10.711  14.855   8.286
   61    HA   LEU   8           HA       LEU   8 -11.102  14.882   5.366
   62    HB2  LEU   8           1HB      LEU   8  -8.702  14.935   6.031
   63    HB3  LEU   8           2HB      LEU   8  -8.937  13.434   6.904
   64    HG   LEU   8           HG       LEU   8  -9.529  12.330   4.750
   65   HD11  LEU   8          1HD1      LEU   8  -8.656  14.966   3.578
   66   HD12  LEU   8          2HD1      LEU   8 -10.273  14.265   3.503
   67   HD13  LEU   8          3HD1      LEU   8  -8.932  13.484   2.664
   68   HD21  LEU   8          3HD2      LEU   8  -6.826  13.664   4.843
   69   HD22  LEU   8          1HD2      LEU   8  -7.239  12.221   3.915
   70   HD23  LEU   8          2HD2      LEU   8  -7.278  12.178   5.677
   71    H    ASN   9           H        ASN   9 -11.623  12.766   4.447
   72    HA   ASN   9           HA       ASN   9 -13.301  11.234   6.257
   73    HB2  ASN   9           1HB      ASN   9 -12.880  10.980   3.265
   74    HB3  ASN   9           2HB      ASN   9 -14.010  10.009   4.204
   75   HD21  ASN   9          2HD2      ASN   9 -14.508  11.830   1.985
   76   HD22  ASN   9          1HD2      ASN   9 -15.621  13.016   2.578
   77    H    ASP  10           H        ASP  10 -11.133  10.686   7.351
   78    HA   ASP  10           HA       ASP  10  -9.470   8.754   6.083
   79    HB2  ASP  10           1HB      ASP  10  -8.440   8.457   8.293
   80    HB3  ASP  10           2HB      ASP  10  -8.602  10.160   7.889
   81    H    VAL  11           H        VAL  11 -10.115   6.818   5.561
   82    HA   VAL  11           HA       VAL  11 -12.338   5.604   7.009
   83    HB   VAL  11           HB       VAL  11 -11.127   4.623   4.420
   84   HG11  VAL  11          1HG1      VAL  11 -13.865   4.260   5.627
   85   HG12  VAL  11          2HG1      VAL  11 -12.574   3.057   5.623
   86   HG13  VAL  11          3HG1      VAL  11 -13.301   3.578   4.103
   87   HG21  VAL  11          3HG2      VAL  11 -12.877   5.851   3.234
   88   HG22  VAL  11          1HG2      VAL  11 -11.799   6.947   4.100
   89   HG23  VAL  11          2HG2      VAL  11 -13.397   6.582   4.753
   90    H    LYS  12           H        LYS  12 -12.172   3.618   7.968
   91    HA   LYS  12           HA       LYS  12  -9.448   2.843   8.627
   92    HB2  LYS  12           1HB      LYS  12 -12.124   2.040   9.783
   93    HB3  LYS  12           2HB      LYS  12 -10.579   1.438  10.366
   94    HG2  LYS  12           1HG      LYS  12 -10.145   3.306  11.516
   95    HG3  LYS  12           2HG      LYS  12 -10.754   4.355  10.233
   96    HD2  LYS  12           1HD      LYS  12 -12.521   2.772  12.094
   97    HD3  LYS  12           2HD      LYS  12 -12.058   4.453  12.367
   98    HE2  LYS  12           1HE      LYS  12 -13.109   5.122  10.299
   99    HE3  LYS  12           2HE      LYS  12 -13.478   3.444   9.904
  100    HZ1  LYS  12           3HZ      LYS  12 -15.377   4.696  10.811
  101    HZ2  LYS  12           1HZ      LYS  12 -14.544   4.879  12.274
  102    HZ3  LYS  12           2HZ      LYS  12 -14.984   3.332  11.737
  103    H    TRP  13           H        TRP  13 -10.984   2.256   6.086
  104    HA   TRP  13           HA       TRP  13 -11.088   0.638   4.514
  105    HB2  TRP  13           1HB      TRP  13  -8.812  -0.014   6.076
  106    HB3  TRP  13           2HB      TRP  13  -9.659  -1.523   5.749
  107    HD1  TRP  13           HD1      TRP  13 -10.642  -1.027   2.821
  108    HE1  TRP  13           HE1      TRP  13  -8.962  -0.877   0.883
  109    HE3  TRP  13           HE3      TRP  13  -6.436   0.119   5.488
  110    HZ2  TRP  13           HZ2      TRP  13  -6.214  -0.356   0.531
  111    HZ3  TRP  13           HZ3      TRP  13  -4.320   0.423   4.271
  112    HH2  TRP  13           HH2      TRP  13  -4.213   0.190   1.844
  113    H    GLU  14           H        GLU  14 -11.429  -1.946   4.399
  114    HA   GLU  14           HA       GLU  14 -13.568  -2.624   6.306
  115    HB2  GLU  14           1HB      GLU  14 -13.002  -3.936   3.646
  116    HB3  GLU  14           2HB      GLU  14 -14.424  -4.146   4.653
  117    HG2  GLU  14           1HG      GLU  14 -15.152  -1.904   4.169
  118    HG3  GLU  14           2HG      GLU  14 -13.672  -1.588   3.259
  119    H    LYS  15           H        LYS  15 -11.176  -4.197   4.250
  120    HA   LYS  15           HA       LYS  15 -10.521  -6.053   6.425
  121    HB2  LYS  15           1HB      LYS  15  -9.838  -6.401   3.501
  122    HB3  LYS  15           2HB      LYS  15  -9.770  -7.612   4.770
  123    HG2  LYS  15           1HG      LYS  15 -11.691  -8.256   3.751
  124    HG3  LYS  15           2HG      LYS  15 -12.364  -7.100   4.899
  125    HD2  LYS  15           1HD      LYS  15 -12.322  -5.364   3.152
  126    HD3  LYS  15           2HD      LYS  15 -11.682  -6.545   2.009
  127    HE2  LYS  15           1HE      LYS  15 -13.724  -7.912   2.356
  128    HE3  LYS  15           2HE      LYS  15 -14.366  -6.634   3.385
  129    HZ1  LYS  15           3HZ      LYS  15 -13.723  -6.433   0.490
  130    HZ2  LYS  15           1HZ      LYS  15 -14.196  -5.113   1.455
  131    HZ3  LYS  15           2HZ      LYS  15 -15.267  -6.405   1.197
  132    HA   PRO  16           HA       PRO  16  -6.766  -3.660   6.824
  133    HB2  PRO  16           1HB      PRO  16  -5.444  -5.565   8.326
  134    HB3  PRO  16           2HB      PRO  16  -6.557  -4.361   8.982
  135    HG2  PRO  16           1HG      PRO  16  -7.058  -7.224   8.282
  136    HG3  PRO  16           2HG      PRO  16  -7.633  -6.292   9.677
  137    HD2  PRO  16           1HD      PRO  16  -9.235  -6.806   7.595
  138    HD3  PRO  16           2HD      PRO  16  -9.305  -5.248   8.448
  139    H    VAL  17           H        VAL  17  -4.608  -3.746   6.113
  140    HA   VAL  17           HA       VAL  17  -4.145  -5.810   4.075
  141    HB   VAL  17           HB       VAL  17  -2.869  -3.079   4.328
  142   HG11  VAL  17          1HG1      VAL  17  -2.002  -3.498   2.081
  143   HG12  VAL  17          2HG1      VAL  17  -2.710  -5.114   2.105
  144   HG13  VAL  17          3HG1      VAL  17  -1.415  -4.702   3.229
  145   HG21  VAL  17          3HG2      VAL  17  -5.025  -4.065   2.468
  146   HG22  VAL  17          1HG2      VAL  17  -4.234  -2.493   2.372
  147   HG23  VAL  17          2HG2      VAL  17  -5.222  -2.899   3.775
  148    H    THR  18           H        THR  18  -2.595  -7.240   4.358
  149    HA   THR  18           HA       THR  18  -0.511  -6.760   6.377
  150    HB   THR  18           HB       THR  18  -1.245  -9.384   5.057
  151    HG1  THR  18           HG1      THR  18  -2.614  -7.976   6.876
  152   HG21  THR  18          3HG2      THR  18   0.293  -8.761   7.582
  153   HG22  THR  18          1HG2      THR  18   0.995  -9.295   6.055
  154   HG23  THR  18          2HG2      THR  18  -0.068 -10.371   6.961
  155    H    ILE  19           H        ILE  19   1.140  -5.744   5.372
  156    HA   ILE  19           HA       ILE  19   1.854  -6.569   2.652
  157    HB   ILE  19           HB       ILE  19   1.494  -4.191   2.896
  158   HG12  ILE  19          1HG1      ILE  19   4.465  -4.729   2.687
  159   HG13  ILE  19          2HG1      ILE  19   3.307  -4.939   1.378
  160   HG21  ILE  19          1HG2      ILE  19   2.885  -2.798   4.362
  161   HG22  ILE  19          2HG2      ILE  19   3.611  -4.256   5.037
  162   HG23  ILE  19          3HG2      ILE  19   1.892  -3.940   5.268
  163   HD11  ILE  19          3HD1      ILE  19   4.508  -2.858   1.144
  164   HD12  ILE  19          1HD1      ILE  19   3.990  -2.355   2.752
  165   HD13  ILE  19          2HD1      ILE  19   2.801  -2.546   1.464
  166    H    SER  20           H        SER  20   3.395  -8.011   2.448
  167    HA   SER  20           HA       SER  20   5.246  -8.537   4.596
  168    HB2  SER  20           1HB      SER  20   4.253 -10.393   3.286
  169    HB3  SER  20           2HB      SER  20   5.044  -9.782   1.834
  170    HG   SER  20           HG       SER  20   6.746 -10.838   2.425
  171    H    LEU  21           H        LEU  21   7.122  -7.519   4.807
  172    HA   LEU  21           HA       LEU  21   8.069  -5.854   2.621
  173    HB2  LEU  21           1HB      LEU  21   9.074  -6.095   5.457
  174    HB3  LEU  21           2HB      LEU  21   9.579  -4.889   4.287
  175    HG   LEU  21           HG       LEU  21   6.840  -5.168   5.523
  176   HD11  LEU  21          1HD1      LEU  21   8.921  -2.997   5.720
  177   HD12  LEU  21          2HD1      LEU  21   8.498  -4.151   6.985
  178   HD13  LEU  21          3HD1      LEU  21   7.314  -2.958   6.446
  179   HD21  LEU  21          3HD2      LEU  21   7.800  -3.229   3.424
  180   HD22  LEU  21          1HD2      LEU  21   6.237  -3.178   4.240
  181   HD23  LEU  21          2HD2      LEU  21   6.637  -4.532   3.182
  182    H    GLN  22           H        GLN  22  10.711  -5.698   2.876
  183    HA   GLN  22           HA       GLN  22  11.545  -7.821   1.264
  184    HB2  GLN  22           1HB      GLN  22  12.529  -5.579   1.198
  185    HB3  GLN  22           2HB      GLN  22  13.218  -5.826   2.795
  186    HG2  GLN  22           1HG      GLN  22  14.606  -7.637   1.918
  187    HG3  GLN  22           2HG      GLN  22  13.912  -7.388   0.316
  188   HE21  GLN  22          2HE2      GLN  22  16.686  -7.190   1.198
  189   HE22  GLN  22          1HE2      GLN  22  17.192  -5.582   0.809
  190    H    ASN  23           H        ASN  23  11.842  -7.345   4.732
  191    HA   ASN  23           HA       ASN  23  13.692  -9.561   5.008
  192    HB2  ASN  23           1HB      ASN  23  12.287  -7.968   7.160
  193    HB3  ASN  23           2HB      ASN  23  13.608  -9.102   7.409
  194   HD21  ASN  23          2HD2      ASN  23  13.546  -6.375   8.176
  195   HD22  ASN  23          1HD2      ASN  23  14.821  -5.568   7.321
  196    H    GLY  24           H        GLY  24  10.554  -9.524   4.310
  197    HA2  GLY  24           1HA      GLY  24   9.052 -11.302   4.347
  198    HA3  GLY  24           2HA      GLY  24  10.097 -12.130   5.494
  199    H    ALA  25           H        ALA  25   9.527  -8.965   6.429
  200    HA   ALA  25           HA       ALA  25   7.789  -9.857   8.576
  201    HB1  ALA  25           3HB      ALA  25   8.216  -7.657   9.557
  202    HB2  ALA  25           1HB      ALA  25   9.095  -7.175   8.107
  203    HB3  ALA  25           2HB      ALA  25   9.721  -8.469   9.130
  204    HA   PRO  26           HA       PRO  26   4.353  -8.063   6.313
  205    HB2  PRO  26           1HB      PRO  26   2.470  -9.537   7.677
  206    HB3  PRO  26           2HB      PRO  26   3.348 -10.097   6.255
  207    HG2  PRO  26           1HG      PRO  26   3.546 -11.040   8.964
  208    HG3  PRO  26           2HG      PRO  26   4.368 -11.654   7.524
  209    HD2  PRO  26           1HD      PRO  26   5.374  -9.874   9.635
  210    HD3  PRO  26           2HD      PRO  26   6.272 -10.846   8.451
  211    H    ARG  27           H        ARG  27   3.871  -6.033   6.868
  212    HA   ARG  27           HA       ARG  27   3.053  -5.436   9.615
  213    HB2  ARG  27           1HB      ARG  27   3.721  -3.662   7.266
  214    HB3  ARG  27           2HB      ARG  27   3.024  -3.039   8.755
  215    HG2  ARG  27           1HG      ARG  27   4.966  -3.975   9.989
  216    HG3  ARG  27           2HG      ARG  27   5.675  -4.428   8.437
  217    HD2  ARG  27           1HD      ARG  27   5.765  -2.121   7.747
  218    HD3  ARG  27           2HD      ARG  27   4.899  -1.614   9.198
  219    HE   ARG  27           HE       ARG  27   7.255  -3.007   9.915
  220   HH11  ARG  27          1HH1      ARG  27   6.230   0.082   8.594
  221   HH12  ARG  27          2HH1      ARG  27   7.598   0.946   9.231
  222   HH21  ARG  27          1HH2      ARG  27   9.031  -1.865  10.749
  223   HH22  ARG  27          2HH2      ARG  27   9.185  -0.161  10.454
  224    H    ILE  28           H        ILE  28   1.017  -5.182  10.187
  225    HA   ILE  28           HA       ILE  28  -1.032  -5.242   8.082
  226    HB   ILE  28           HB       ILE  28  -1.320  -5.771  11.047
  227   HG12  ILE  28          1HG1      ILE  28  -1.262  -7.701   8.715
  228   HG13  ILE  28          2HG1      ILE  28   0.036  -7.477   9.882
  229   HG21  ILE  28          1HG2      ILE  28  -3.377  -4.935  10.061
  230   HG22  ILE  28          2HG2      ILE  28  -3.534  -6.650  10.449
  231   HG23  ILE  28          3HG2      ILE  28  -3.275  -6.144   8.780
  232   HD11  ILE  28          3HD1      ILE  28  -2.731  -8.482  10.508
  233   HD12  ILE  28          1HD1      ILE  28  -1.409  -8.288  11.659
  234   HD13  ILE  28          2HD1      ILE  28  -1.277  -9.470  10.356
  235    H    PHE  29           H        PHE  29  -2.082  -3.441   7.605
  236    HA   PHE  29           HA       PHE  29  -1.888  -1.144   9.402
  237    HB2  PHE  29           1HB      PHE  29  -2.999  -1.297   6.591
  238    HB3  PHE  29           2HB      PHE  29  -2.707   0.173   7.518
  239    HD1  PHE  29           HD2      PHE  29  -0.183   0.252   8.491
  240    HD2  PHE  29           HD1      PHE  29  -1.461  -1.788   4.984
  241    HE1  PHE  29           HE2      PHE  29   2.109   0.342   7.610
  242    HE2  PHE  29           HE1      PHE  29   0.831  -1.704   4.098
  243    HZ   PHE  29           HZ       PHE  29   2.621  -0.639   5.411
  244    H    ASN  30           H        ASN  30  -3.618  -0.166  10.355
  245    HA   ASN  30           HA       ASN  30  -5.984  -1.828  10.626
  246    HB2  ASN  30           1HB      ASN  30  -5.241   0.755  12.021
  247    HB3  ASN  30           2HB      ASN  30  -6.603  -0.277  12.439
  248   HD21  ASN  30          2HD2      ASN  30  -3.157   0.127  12.554
  249   HD22  ASN  30          1HD2      ASN  30  -2.848  -1.166  13.669
  250    H    GLY  31           H        GLY  31  -5.012   1.094   9.068
  251    HA2  GLY  31           1HA      GLY  31  -7.644   1.292   7.824
  252    HA3  GLY  31           2HA      GLY  31  -7.069   2.704   8.702
  253    H    VAL  32           H        VAL  32  -7.490   3.401   6.297
  254    HA   VAL  32           HA       VAL  32  -5.529   2.608   4.375
  255    HB   VAL  32           HB       VAL  32  -7.253   5.080   4.223
  256   HG11  VAL  32          1HG1      VAL  32  -7.056   4.753   1.818
  257   HG12  VAL  32          2HG1      VAL  32  -6.046   3.336   2.084
  258   HG13  VAL  32          3HG1      VAL  32  -5.473   4.932   2.568
  259   HG21  VAL  32          3HG2      VAL  32  -8.923   3.711   3.071
  260   HG22  VAL  32          1HG2      VAL  32  -8.681   3.171   4.732
  261   HG23  VAL  32          2HG2      VAL  32  -7.964   2.268   3.398
  262    H    TYR  33           H        TYR  33  -5.747   5.130   6.768
  263    HA   TYR  33           HA       TYR  33  -3.928   6.947   5.621
  264    HB2  TYR  33           1HB      TYR  33  -5.385   7.623   7.458
  265    HB3  TYR  33           2HB      TYR  33  -4.581   6.489   8.540
  266    HD1  TYR  33           HD2      TYR  33  -3.974   9.500   6.450
  267    HD2  TYR  33           HD1      TYR  33  -2.683   7.147   9.752
  268    HE1  TYR  33           HE2      TYR  33  -2.320  11.224   7.025
  269    HE2  TYR  33           HE1      TYR  33  -1.023   8.863  10.336
  270    HH   TYR  33           HH       TYR  33   0.215  10.688   9.197
  271    H    GLU  34           H        GLU  34  -3.460   4.311   7.943
  272    HA   GLU  34           HA       GLU  34  -0.716   4.675   8.372
  273    HB2  GLU  34           1HB      GLU  34  -2.404   2.175   8.480
  274    HB3  GLU  34           2HB      GLU  34  -0.743   2.265   9.055
  275    HG2  GLU  34           1HG      GLU  34  -1.292   3.592  10.853
  276    HG3  GLU  34           2HG      GLU  34  -2.763   4.197  10.090
  277    H    ALA  35           H        ALA  35  -2.450   2.957   5.838
  278    HA   ALA  35           HA       ALA  35  -0.190   1.679   4.697
  279    HB1  ALA  35           3HB      ALA  35  -2.499   0.958   4.266
  280    HB2  ALA  35           1HB      ALA  35  -1.614   1.271   2.772
  281    HB3  ALA  35           2HB      ALA  35  -2.786   2.448   3.368
  282    H    PHE  36           H        PHE  36  -1.934   4.660   3.841
  283    HA   PHE  36           HA       PHE  36  -0.229   5.443   1.741
  284    HB2  PHE  36           1HB      PHE  36  -2.461   6.407   2.051
  285    HB3  PHE  36           2HB      PHE  36  -1.955   7.138   3.570
  286    HD1  PHE  36           HD1      PHE  36  -1.330   7.172  -0.088
  287    HD2  PHE  36           HD2      PHE  36  -0.972   9.255   3.606
  288    HE1  PHE  36           HE1      PHE  36  -0.634   9.196  -1.301
  289    HE2  PHE  36           HE2      PHE  36  -0.274  11.280   2.400
  290    HZ   PHE  36           HZ       PHE  36  -0.103  11.254  -0.056
  291    H    ASP  37           H        ASP  37  -0.167   6.036   5.201
  292    HA   ASP  37           HA       ASP  37   1.932   7.921   5.236
  293    HB2  ASP  37           1HB      ASP  37   0.388   7.515   7.135
  294    HB3  ASP  37           2HB      ASP  37   1.143   5.946   7.390
  295    H    PHE  38           H        PHE  38   1.889   4.400   5.578
  296    HA   PHE  38           HA       PHE  38   4.616   3.987   6.032
  297    HB2  PHE  38           1HB      PHE  38   2.954   2.223   6.339
  298    HB3  PHE  38           2HB      PHE  38   2.612   2.219   4.613
  299    HD1  PHE  38           HD2      PHE  38   5.376   1.671   7.036
  300    HD2  PHE  38           HD1      PHE  38   3.740   0.754   3.214
  301    HE1  PHE  38           HE2      PHE  38   7.120  -0.030   6.697
  302    HE2  PHE  38           HE1      PHE  38   5.482  -0.943   2.872
  303    HZ   PHE  38           HZ       PHE  38   7.174  -1.337   4.614
  304    H    LEU  39           H        LEU  39   2.778   4.242   3.032
  305    HA   LEU  39           HA       LEU  39   4.818   3.598   1.229
  306    HB2  LEU  39           1HB      LEU  39   2.468   5.458   0.911
  307    HB3  LEU  39           2HB      LEU  39   3.494   4.939  -0.411
  308    HG   LEU  39           HG       LEU  39   1.804   3.106   1.291
  309   HD11  LEU  39          1HD1      LEU  39   1.399   4.123  -1.518
  310   HD12  LEU  39          2HD1      LEU  39   0.431   4.545  -0.104
  311   HD13  LEU  39          3HD1      LEU  39   0.419   2.893  -0.721
  312   HD21  LEU  39          3HD2      LEU  39   3.791   2.003   0.438
  313   HD22  LEU  39          1HD2      LEU  39   3.440   2.590  -1.188
  314   HD23  LEU  39          2HD2      LEU  39   2.357   1.434  -0.414
  315    H    GLN  40           H        GLN  40   4.149   6.546   2.965
  316    HA   GLN  40           HA       GLN  40   5.966   8.082   1.314
  317    HB2  GLN  40           1HB      GLN  40   4.237   8.771   3.677
  318    HB3  GLN  40           2HB      GLN  40   5.419   9.904   3.039
  319    HG2  GLN  40           1HG      GLN  40   3.184   8.695   1.428
  320    HG3  GLN  40           2HG      GLN  40   3.109  10.268   2.221
  321   HE21  GLN  40          2HE2      GLN  40   2.927   9.599  -0.611
  322   HE22  GLN  40          1HE2      GLN  40   4.196  10.479  -1.399
  323    H    HIS  41           H        HIS  41   5.966   6.514   4.428
  324    HA   HIS  41           HA       HIS  41   8.482   7.824   5.114
  325    HB2  HIS  41           1HB      HIS  41   6.583   6.110   6.694
  326    HB3  HIS  41           2HB      HIS  41   8.190   6.506   7.291
  327    HD1  HIS  41           HD1      HIS  41   8.647   9.024   7.867
  328    HD2  HIS  41           HD2      HIS  41   4.700   8.125   6.906
  329    HE1  HIS  41           HE1      HIS  41   7.287  10.996   8.650
  330    HE2  HIS  41           HE2      HIS  41   4.892  10.332   8.241
  331    H    GLU  42           H        GLU  42   7.418   4.437   5.558
  332    HA   GLU  42           HA       GLU  42  10.247   3.757   5.164
  333    HB2  GLU  42           1HB      GLU  42   8.172   2.281   6.779
  334    HB3  GLU  42           2HB      GLU  42   9.880   1.883   6.671
  335    HG2  GLU  42           1HG      GLU  42  10.317   4.213   7.594
  336    HG3  GLU  42           2HG      GLU  42   8.598   4.250   7.984
  337    H    TRP  43           H        TRP  43   8.216   3.824   2.964
  338    HA   TRP  43           HA       TRP  43   7.792   1.144   2.149
  339    HB2  TRP  43           1HB      TRP  43   6.698   3.014   1.010
  340    HB3  TRP  43           2HB      TRP  43   8.257   3.623   0.467
  341    HD1  TRP  43           HD1      TRP  43   9.022   2.848  -1.852
  342    HE1  TRP  43           HE1      TRP  43   8.274   1.049  -3.536
  343    HE3  TRP  43           HE3      TRP  43   5.552   0.414   1.032
  344    HZ2  TRP  43           HZ2      TRP  43   6.456  -1.100  -3.630
  345    HZ3  TRP  43           HZ3      TRP  43   4.359  -1.500   0.059
  346    HH2  TRP  43           HH2      TRP  43   4.801  -2.241  -2.220
  347    HA   PRO  44           HA       PRO  44  12.183   0.454   1.869
  348    HB2  PRO  44           1HB      PRO  44  12.127  -2.139   2.462
  349    HB3  PRO  44           2HB      PRO  44  11.639  -0.926   3.652
  350    HG2  PRO  44           1HG      PRO  44   9.967  -2.783   2.049
  351    HG3  PRO  44           2HG      PRO  44   9.681  -2.122   3.667
  352    HD2  PRO  44           1HD      PRO  44   8.614  -1.185   1.193
  353    HD3  PRO  44           2HD      PRO  44   8.427  -0.452   2.797
  354    H    ALA  45           H        ALA  45  10.562   0.344  -0.692
  355    HA   ALA  45           HA       ALA  45  12.466  -1.277  -2.171
  356    HB1  ALA  45           3HB      ALA  45  10.656  -2.862  -1.698
  357    HB2  ALA  45           1HB      ALA  45  10.755  -2.491  -3.419
  358    HB3  ALA  45           2HB      ALA  45   9.493  -1.755  -2.430
  359    H    ARG  46           H        ARG  46  11.708  -1.081  -4.667
  360    HA   ARG  46           HA       ARG  46  11.290   1.772  -5.106
  361    HB2  ARG  46           1HB      ARG  46  12.085  -0.448  -7.003
  362    HB3  ARG  46           2HB      ARG  46  11.847   1.225  -7.490
  363    HG2  ARG  46           1HG      ARG  46  13.904   0.224  -5.538
  364    HG3  ARG  46           2HG      ARG  46  14.194   0.752  -7.197
  365    HD2  ARG  46           1HD      ARG  46  13.212   2.441  -4.897
  366    HD3  ARG  46           2HD      ARG  46  14.791   2.526  -5.671
  367    HE   ARG  46           HE       ARG  46  12.609   2.990  -7.483
  368   HH11  ARG  46          1HH1      ARG  46  14.864   4.446  -5.250
  369   HH12  ARG  46          2HH1      ARG  46  14.599   6.064  -5.825
  370   HH21  ARG  46          1HH2      ARG  46  12.243   5.146  -8.259
  371   HH22  ARG  46          2HH2      ARG  46  13.109   6.461  -7.524
  372    H    GLY  47           H        GLY  47  10.213   0.729  -7.897
  373    HA2  GLY  47           1HA      GLY  47   7.957  -0.210  -8.364
  374    HA3  GLY  47           2HA      GLY  47   7.416   0.719  -6.964
  375    H    ASP  48           H        ASP  48   8.488   3.041  -7.148
  376    HA   ASP  48           HA       ASP  48   8.595   5.076  -8.102
  377    HB2  ASP  48           1HB      ASP  48  10.116   3.569  -9.657
  378    HB3  ASP  48           2HB      ASP  48   8.860   3.915 -10.842
  379    H    ARG  49           H        ARG  49   7.283   3.675 -11.031
  380    HA   ARG  49           HA       ARG  49   5.253   5.623 -11.254
  381    HB2  ARG  49           1HB      ARG  49   5.334   2.937 -12.632
  382    HB3  ARG  49           2HB      ARG  49   4.509   4.389 -13.182
  383    HG2  ARG  49           1HG      ARG  49   7.491   4.069 -12.934
  384    HG3  ARG  49           2HG      ARG  49   6.566   3.943 -14.431
  385    HD2  ARG  49           1HD      ARG  49   6.704   6.388 -12.671
  386    HD3  ARG  49           2HD      ARG  49   7.643   6.146 -14.143
  387    HE   ARG  49           HE       ARG  49   4.869   6.894 -13.943
  388   HH11  ARG  49          1HH1      ARG  49   7.310   5.413 -15.974
  389   HH12  ARG  49          2HH1      ARG  49   6.476   5.758 -17.460
  390   HH21  ARG  49          1HH2      ARG  49   3.768   7.371 -15.893
  391   HH22  ARG  49          2HH2      ARG  49   4.462   6.877 -17.416
  392    H    ALA  50           H        ALA  50   5.142   2.171 -10.402
  393    HA   ALA  50           HA       ALA  50   2.355   2.093  -9.905
  394    HB1  ALA  50           3HB      ALA  50   2.813  -0.058  -8.821
  395    HB2  ALA  50           1HB      ALA  50   4.540   0.287  -8.873
  396    HB3  ALA  50           2HB      ALA  50   3.639   0.076 -10.373
  397    H    HIS  51           H        HIS  51   5.112   2.993  -7.996
  398    HA   HIS  51           HA       HIS  51   3.927   2.863  -5.434
  399    HB2  HIS  51           1HB      HIS  51   6.344   3.034  -5.693
  400    HB3  HIS  51           2HB      HIS  51   6.178   4.604  -6.469
  401    HD1  HIS  51           HD1      HIS  51   5.870   2.943  -3.099
  402    HD2  HIS  51           HD2      HIS  51   5.975   6.756  -4.748
  403    HE1  HIS  51           HE1      HIS  51   6.073   4.516  -1.152
  404    HE2  HIS  51           HE2      HIS  51   6.352   6.799  -2.186
  405    H    GLU  52           H        GLU  52   4.111   5.402  -7.879
  406    HA   GLU  52           HA       GLU  52   2.812   7.406  -6.354
  407    HB2  GLU  52           1HB      GLU  52   2.963   7.074  -9.354
  408    HB3  GLU  52           2HB      GLU  52   2.468   8.537  -8.512
  409    HG2  GLU  52           1HG      GLU  52   4.660   8.747  -7.524
  410    HG3  GLU  52           2HG      GLU  52   5.169   7.240  -8.284
  411    H    GLN  53           H        GLN  53   1.640   4.931  -8.587
  412    HA   GLN  53           HA       GLN  53  -1.033   5.774  -8.708
  413    HB2  GLN  53           1HB      GLN  53   0.019   2.944  -8.893
  414    HB3  GLN  53           2HB      GLN  53  -1.551   3.501  -9.455
  415    HG2  GLN  53           1HG      GLN  53  -0.379   5.016 -11.036
  416    HG3  GLN  53           2HG      GLN  53   1.144   4.283 -10.537
  417   HE21  GLN  53          2HE2      GLN  53  -0.041   4.344 -13.158
  418   HE22  GLN  53          1HE2      GLN  53  -0.284   2.700 -13.640
  419    H    ALA  54           H        ALA  54   0.601   3.516  -6.519
  420    HA   ALA  54           HA       ALA  54  -1.620   2.782  -4.984
  421    HB1  ALA  54           3HB      ALA  54  -0.024   2.124  -3.266
  422    HB2  ALA  54           1HB      ALA  54   1.244   3.050  -4.072
  423    HB3  ALA  54           2HB      ALA  54   0.545   1.637  -4.864
  424    H    LEU  55           H        LEU  55   0.586   5.530  -4.689
  425    HA   LEU  55           HA       LEU  55  -0.393   6.589  -2.279
  426    HB2  LEU  55           1HB      LEU  55   0.812   7.994  -4.664
  427    HB3  LEU  55           2HB      LEU  55   0.528   8.753  -3.111
  428    HG   LEU  55           HG       LEU  55   2.374   6.407  -3.565
  429   HD11  LEU  55          1HD1      LEU  55   3.210   8.421  -4.653
  430   HD12  LEU  55          2HD1      LEU  55   4.180   8.021  -3.235
  431   HD13  LEU  55          3HD1      LEU  55   2.997   9.328  -3.155
  432   HD21  LEU  55          3HD2      LEU  55   1.938   8.163  -1.151
  433   HD22  LEU  55          1HD2      LEU  55   3.144   6.886  -1.298
  434   HD23  LEU  55          2HD2      LEU  55   1.428   6.483  -1.316
  435    H    ARG  56           H        ARG  56  -1.294   7.222  -5.637
  436    HA   ARG  56           HA       ARG  56  -3.225   9.196  -5.187
  437    HB2  ARG  56           1HB      ARG  56  -2.247   8.560  -7.405
  438    HB3  ARG  56           2HB      ARG  56  -3.232   7.105  -7.374
  439    HG2  ARG  56           1HG      ARG  56  -5.255   8.539  -7.280
  440    HG3  ARG  56           2HG      ARG  56  -4.211   9.950  -7.477
  441    HD2  ARG  56           1HD      ARG  56  -3.360   8.917  -9.592
  442    HD3  ARG  56           2HD      ARG  56  -4.593   7.668  -9.409
  443    HE   ARG  56           HE       ARG  56  -5.381  10.502  -9.529
  444   HH11  ARG  56          1HH1      ARG  56  -5.459   7.270 -10.900
  445   HH12  ARG  56          2HH1      ARG  56  -6.659   7.671 -12.092
  446   HH21  ARG  56          1HH2      ARG  56  -6.957  11.017 -11.110
  447   HH22  ARG  56          2HH2      ARG  56  -7.493   9.784 -12.214
  448    H    LEU  57           H        LEU  57  -3.497   5.673  -5.322
  449    HA   LEU  57           HA       LEU  57  -6.312   5.550  -5.135
  450    HB2  LEU  57           1HB      LEU  57  -4.242   3.500  -4.352
  451    HB3  LEU  57           2HB      LEU  57  -5.953   3.182  -4.572
  452    HG   LEU  57           HG       LEU  57  -4.126   4.174  -6.759
  453   HD11  LEU  57          1HD1      LEU  57  -4.241   1.889  -7.636
  454   HD12  LEU  57          2HD1      LEU  57  -5.097   1.384  -6.179
  455   HD13  LEU  57          3HD1      LEU  57  -3.435   1.962  -6.069
  456   HD21  LEU  57          3HD2      LEU  57  -6.939   3.084  -6.828
  457   HD22  LEU  57          1HD2      LEU  57  -5.968   3.514  -8.236
  458   HD23  LEU  57          2HD2      LEU  57  -6.464   4.761  -7.092
  459    H    CYS  58           H        CYS  58  -3.780   5.175  -2.657
  460    HA   CYS  58           HA       CYS  58  -5.523   4.751  -0.488
  461    HB2  CYS  58           1HB      CYS  58  -2.770   6.010  -0.465
  462    HB3  CYS  58           2HB      CYS  58  -3.609   5.337   0.929
  463    HG   CYS  58           HG       CYS  58  -2.239   3.674  -1.711
  464    H    ARG  59           H        ARG  59  -4.173   7.716  -1.866
  465    HA   ARG  59           HA       ARG  59  -5.225   9.474   0.083
  466    HB2  ARG  59           1HB      ARG  59  -3.446  10.229  -1.338
  467    HB3  ARG  59           2HB      ARG  59  -4.395   9.921  -2.786
  468    HG2  ARG  59           1HG      ARG  59  -5.931  11.700  -2.182
  469    HG3  ARG  59           2HG      ARG  59  -5.031  11.989  -0.694
  470    HD2  ARG  59           1HD      ARG  59  -3.138  12.766  -1.887
  471    HD3  ARG  59           2HD      ARG  59  -3.781  12.183  -3.423
  472    HE   ARG  59           HE       ARG  59  -5.630  13.898  -2.963
  473   HH11  ARG  59          1HH1      ARG  59  -2.270  14.328  -2.037
  474   HH12  ARG  59          2HH1      ARG  59  -2.360  16.067  -2.088
  475   HH21  ARG  59          1HH2      ARG  59  -5.739  16.139  -3.036
  476   HH22  ARG  59          2HH2      ARG  59  -4.342  17.104  -2.661
  477    H    ALA  60           H        ALA  60  -6.489   8.290  -3.005
  478    HA   ALA  60           HA       ALA  60  -8.830   9.887  -3.011
  479    HB1  ALA  60           3HB      ALA  60  -7.954   8.803  -5.030
  480    HB2  ALA  60           1HB      ALA  60  -9.642   8.382  -4.740
  481    HB3  ALA  60           2HB      ALA  60  -8.366   7.226  -4.356
  482    H    SER  61           H        SER  61  -8.039   6.771  -1.609
  483    HA   SER  61           HA       SER  61 -10.689   6.090  -0.850
  484    HB2  SER  61           1HB      SER  61  -8.813   4.453  -0.994
  485    HB3  SER  61           2HB      SER  61  -8.093   5.202   0.429
  486    HG   SER  61           HG       SER  61 -10.719   4.522   0.784
  487    H    LEU  62           H        LEU  62  -8.126   7.997   0.602
  488    HA   LEU  62           HA       LEU  62  -9.411   8.354   3.130
  489    HB2  LEU  62           1HB      LEU  62  -7.213   9.892   1.746
  490    HB3  LEU  62           2HB      LEU  62  -7.779  10.263   3.363
  491    HG   LEU  62           HG       LEU  62  -6.568   7.617   2.546
  492   HD11  LEU  62          1HD1      LEU  62  -4.926   9.414   2.405
  493   HD12  LEU  62          2HD1      LEU  62  -4.593   8.359   3.778
  494   HD13  LEU  62          3HD1      LEU  62  -5.343   9.934   4.038
  495   HD21  LEU  62          3HD2      LEU  62  -8.112   7.467   4.438
  496   HD22  LEU  62          1HD2      LEU  62  -7.236   8.759   5.259
  497   HD23  LEU  62          2HD2      LEU  62  -6.444   7.214   4.951
  498    H    MET  63           H        MET  63 -10.184   9.452   0.091
  499    HA   MET  63           HA       MET  63 -11.487  11.866   1.121
  500    HB2  MET  63           1HB      MET  63 -11.188  10.870  -1.719
  501    HB3  MET  63           2HB      MET  63 -12.014  12.350  -1.253
  502    HG2  MET  63           1HG      MET  63  -9.872  13.147  -0.262
  503    HG3  MET  63           2HG      MET  63  -9.090  11.726  -0.955
  504    HE1  MET  63           3HE      MET  63 -10.862  15.136  -1.643
  505    HE2  MET  63           1HE      MET  63 -11.967  14.010  -2.430
  506    HE3  MET  63           2HE      MET  63 -11.018  15.136  -3.400
  507    H    GLY  64           H        GLY  64 -12.062   8.611   0.476
  508    HA2  GLY  64           1HA      GLY  64 -14.041   7.505   1.107
  509    HA3  GLY  64           2HA      GLY  64 -14.919   9.014   0.919
  510    H    ASP  65           H        ASP  65 -13.016   8.722  -1.763
  511    HA   ASP  65           HA       ASP  65 -15.321   7.977  -3.354
  512    HB2  ASP  65           1HB      ASP  65 -12.558   8.914  -4.143
  513    HB3  ASP  65           2HB      ASP  65 -13.842   8.548  -5.293
  514    H    VAL  66           H        VAL  66 -12.626   6.415  -2.055
  515    HA   VAL  66           HA       VAL  66 -12.995   4.152  -3.904
  516    HB   VAL  66           HB       VAL  66 -10.591   4.794  -2.179
  517   HG11  VAL  66          1HG1      VAL  66 -11.047   2.500  -4.082
  518   HG12  VAL  66          2HG1      VAL  66 -10.947   2.391  -2.326
  519   HG13  VAL  66          3HG1      VAL  66  -9.531   2.870  -3.261
  520   HG21  VAL  66          3HG2      VAL  66 -10.751   6.230  -4.134
  521   HG22  VAL  66          1HG2      VAL  66 -10.940   4.820  -5.176
  522   HG23  VAL  66          2HG2      VAL  66  -9.422   5.085  -4.316
  523    H    ALA  67           H        ALA  67 -14.291   2.681  -3.059
  524    HA   ALA  67           HA       ALA  67 -14.779   2.607  -0.222
  525    HB1  ALA  67           3HB      ALA  67 -16.556   1.051  -0.744
  526    HB2  ALA  67           1HB      ALA  67 -15.977   0.909  -2.403
  527    HB3  ALA  67           2HB      ALA  67 -16.627   2.443  -1.824
  528    H    GLY  68           H        GLY  68 -12.776   1.853   0.559
  529    HA2  GLY  68           1HA      GLY  68 -11.540   0.229   1.586
  530    HA3  GLY  68           2HA      GLY  68 -13.020  -0.704   1.528
  531    H    GLU  69           H        GLU  69 -13.325  -2.207  -0.103
  532    HA   GLU  69           HA       GLU  69 -11.319  -3.966  -0.536
  533    HB2  GLU  69           1HB      GLU  69 -13.787  -4.284  -0.918
  534    HB3  GLU  69           2HB      GLU  69 -13.572  -3.527  -2.492
  535    HG2  GLU  69           1HG      GLU  69 -13.583  -5.900  -2.766
  536    HG3  GLU  69           2HG      GLU  69 -11.953  -5.302  -3.073
  537    H    ILE  70           H        ILE  70 -12.281  -1.399  -2.790
  538    HA   ILE  70           HA       ILE  70 -10.747  -2.142  -4.990
  539    HB   ILE  70           HB       ILE  70 -11.375   0.682  -4.117
  540   HG12  ILE  70          1HG1      ILE  70 -12.957  -1.184  -5.902
  541   HG13  ILE  70          2HG1      ILE  70 -13.390  -0.750  -4.251
  542   HG21  ILE  70          1HG2      ILE  70 -11.208   1.207  -6.513
  543   HG22  ILE  70          2HG2      ILE  70 -10.699  -0.452  -6.829
  544   HG23  ILE  70          3HG2      ILE  70  -9.686   0.611  -5.852
  545   HD11  ILE  70          3HD1      ILE  70 -13.643   1.580  -4.928
  546   HD12  ILE  70          1HD1      ILE  70 -14.688   0.514  -5.867
  547   HD13  ILE  70          2HD1      ILE  70 -13.206   1.147  -6.581
  548    H    ALA  71           H        ALA  71  -9.868  -0.093  -2.235
  549    HA   ALA  71           HA       ALA  71  -7.302   0.598  -3.263
  550    HB1  ALA  71           3HB      ALA  71  -8.475   2.030  -1.672
  551    HB2  ALA  71           1HB      ALA  71  -6.894   1.554  -1.053
  552    HB3  ALA  71           2HB      ALA  71  -8.353   0.775  -0.440
  553    H    ARG  72           H        ARG  72  -8.528  -1.957  -1.200
  554    HA   ARG  72           HA       ARG  72  -6.003  -2.785  -0.182
  555    HB2  ARG  72           1HB      ARG  72  -8.103  -3.376   0.955
  556    HB3  ARG  72           2HB      ARG  72  -8.580  -4.360  -0.425
  557    HG2  ARG  72           1HG      ARG  72  -6.683  -5.836  -0.048
  558    HG3  ARG  72           2HG      ARG  72  -6.166  -4.842   1.310
  559    HD2  ARG  72           1HD      ARG  72  -7.308  -6.723   2.202
  560    HD3  ARG  72           2HD      ARG  72  -8.365  -5.327   2.394
  561    HE   ARG  72           HE       ARG  72  -9.466  -6.206   0.260
  562   HH11  ARG  72          1HH1      ARG  72  -7.918  -8.272   2.629
  563   HH12  ARG  72          2HH1      ARG  72  -8.941  -9.631   2.306
  564   HH21  ARG  72          1HH2      ARG  72 -10.814  -7.964  -0.170
  565   HH22  ARG  72          2HH2      ARG  72 -10.596  -9.467   0.692
  566    H    THR  73           H        THR  73  -8.075  -4.006  -2.794
  567    HA   THR  73           HA       THR  73  -6.372  -6.118  -3.545
  568    HB   THR  73           HB       THR  73  -7.701  -5.908  -5.757
  569    HG1  THR  73           HG1      THR  73  -9.408  -4.303  -4.155
  570   HG21  THR  73          3HG2      THR  73  -9.127  -6.378  -3.137
  571   HG22  THR  73          1HG2      THR  73  -8.193  -7.571  -4.040
  572   HG23  THR  73          2HG2      THR  73  -9.685  -6.922  -4.720
  573    H    ALA  74           H        ALA  74  -6.686  -2.789  -4.690
  574    HA   ALA  74           HA       ALA  74  -4.828  -3.025  -6.816
  575    HB1  ALA  74           3HB      ALA  74  -6.523  -1.257  -6.698
  576    HB2  ALA  74           1HB      ALA  74  -4.898  -0.602  -6.898
  577    HB3  ALA  74           2HB      ALA  74  -5.681  -0.553  -5.319
  578    H    PHE  75           H        PHE  75  -4.504  -2.184  -3.406
  579    HA   PHE  75           HA       PHE  75  -1.871  -1.196  -3.508
  580    HB2  PHE  75           1HB      PHE  75  -3.424  -0.935  -1.568
  581    HB3  PHE  75           2HB      PHE  75  -3.188  -2.639  -1.197
  582    HD1  PHE  75           HD1      PHE  75  -1.563   0.655  -1.342
  583    HD2  PHE  75           HD2      PHE  75  -1.218  -3.400  -0.094
  584    HE1  PHE  75           HE1      PHE  75   0.417   1.235  -0.005
  585    HE2  PHE  75           HE2      PHE  75   0.763  -2.826   1.245
  586    HZ   PHE  75           HZ       PHE  75   1.582  -0.503   1.288
  587    H    VAL  76           H        VAL  76  -3.149  -4.452  -2.996
  588    HA   VAL  76           HA       VAL  76  -0.655  -5.709  -2.562
  589    HB   VAL  76           HB       VAL  76  -3.209  -6.910  -3.660
  590   HG11  VAL  76          1HG1      VAL  76  -2.312  -9.051  -2.884
  591   HG12  VAL  76          2HG1      VAL  76  -0.810  -8.253  -2.416
  592   HG13  VAL  76          3HG1      VAL  76  -1.277  -8.328  -4.116
  593   HG21  VAL  76          3HG2      VAL  76  -2.163  -6.771  -0.836
  594   HG22  VAL  76          1HG2      VAL  76  -3.613  -7.629  -1.356
  595   HG23  VAL  76          2HG2      VAL  76  -3.536  -5.872  -1.481
  596    H    ALA  77           H        ALA  77  -2.486  -4.935  -5.457
  597    HA   ALA  77           HA       ALA  77  -0.915  -6.388  -7.301
  598    HB1  ALA  77           3HB      ALA  77  -2.551  -3.892  -7.743
  599    HB2  ALA  77           1HB      ALA  77  -3.136  -5.553  -7.850
  600    HB3  ALA  77           2HB      ALA  77  -1.939  -4.963  -9.003
  601    H    ALA  78           H        ALA  78  -0.498  -3.285  -5.757
  602    HA   ALA  78           HA       ALA  78   1.613  -2.405  -7.485
  603    HB1  ALA  78           3HB      ALA  78   0.885  -1.458  -4.714
  604    HB2  ALA  78           1HB      ALA  78   0.238  -0.815  -6.225
  605    HB3  ALA  78           2HB      ALA  78   1.953  -0.634  -5.851
  606    H    SER  79           H        SER  79   1.393  -4.123  -4.427
  607    HA   SER  79           HA       SER  79   4.177  -4.094  -3.838
  608    HB2  SER  79           1HB      SER  79   2.241  -4.538  -2.222
  609    HB3  SER  79           2HB      SER  79   2.194  -6.168  -2.887
  610    HG   SER  79           HG       SER  79   4.200  -6.570  -2.073
  611    H    ARG  80           H        ARG  80   2.372  -5.695  -6.160
  612    HA   ARG  80           HA       ARG  80   3.633  -8.173  -6.433
  613    HB2  ARG  80           1HB      ARG  80   1.623  -7.601  -7.668
  614    HB3  ARG  80           2HB      ARG  80   2.467  -6.315  -8.514
  615    HG2  ARG  80           1HG      ARG  80   2.275  -8.091 -10.035
  616    HG3  ARG  80           2HG      ARG  80   3.953  -8.093  -9.494
  617    HD2  ARG  80           1HD      ARG  80   3.479  -9.916  -7.960
  618    HD3  ARG  80           2HD      ARG  80   1.776  -9.886  -8.423
  619    HE   ARG  80           HE       ARG  80   3.759 -10.337 -10.520
  620   HH11  ARG  80          1HH1      ARG  80   1.355 -11.728  -8.380
  621   HH12  ARG  80          2HH1      ARG  80   1.113 -13.136  -9.367
  622   HH21  ARG  80          1HH2      ARG  80   3.403 -12.135 -11.841
  623   HH22  ARG  80          2HH2      ARG  80   2.273 -13.366 -11.345
  624    H    GLN  81           H        GLN  81   4.526  -4.965  -7.663
  625    HA   GLN  81           HA       GLN  81   6.759  -5.980  -9.160
  626    HB2  GLN  81           1HB      GLN  81   5.984  -3.150  -8.443
  627    HB3  GLN  81           2HB      GLN  81   7.305  -3.581  -9.520
  628    HG2  GLN  81           1HG      GLN  81   5.596  -4.792 -10.926
  629    HG3  GLN  81           2HG      GLN  81   4.365  -4.010  -9.936
  630   HE21  GLN  81          2HE2      GLN  81   4.946  -3.774 -12.787
  631   HE22  GLN  81          1HE2      GLN  81   5.253  -2.090 -13.077
  632    H    ALA  82           H        ALA  82   6.256  -5.337  -5.912
  633    HA   ALA  82           HA       ALA  82   8.984  -4.604  -5.289
  634    HB1  ALA  82           3HB      ALA  82   8.288  -4.750  -2.958
  635    HB2  ALA  82           1HB      ALA  82   6.747  -5.454  -3.447
  636    HB3  ALA  82           2HB      ALA  82   7.137  -3.791  -3.889
  637    H    HIS  83           H        HIS  83   7.476  -7.363  -6.241
  638    HA   HIS  83           HA       HIS  83   8.099  -9.541  -6.399
  639    HB2  HIS  83           1HB      HIS  83  10.699  -8.724  -5.083
  640    HB3  HIS  83           2HB      HIS  83  10.405 -10.189  -6.008
  641    HD1  HIS  83           HD1      HIS  83  10.228  -9.922  -8.618
  642    HD2  HIS  83           HD2      HIS  83  11.297  -6.479  -6.542
  643    HE1  HIS  83           HE1      HIS  83  11.114  -8.324 -10.351
  644    HE2  HIS  83           HE2      HIS  83  11.567  -6.185  -9.091
  645    H    CYS  84           H        CYS  84   6.750  -8.486  -4.007
  646    HA   CYS  84           HA       CYS  84   7.168 -10.738  -2.279
  647    HB2  CYS  84           1HB      CYS  84   8.890  -9.082  -1.526
  648    HB3  CYS  84           2HB      CYS  84   7.586  -7.958  -1.164
  649    HG   CYS  84           HG       CYS  84   7.308  -8.744   1.238
  650    H    LEU  85           H        LEU  85   5.119 -11.303  -2.536
  651    HA   LEU  85           HA       LEU  85   3.008  -9.435  -1.724
  652    HB2  LEU  85           1HB      LEU  85   2.845 -12.116  -3.113
  653    HB3  LEU  85           2HB      LEU  85   1.459 -11.141  -2.662
  654    HG   LEU  85           HG       LEU  85   3.594 -10.317  -4.632
  655   HD11  LEU  85          1HD1      LEU  85   0.765 -11.262  -5.064
  656   HD12  LEU  85          2HD1      LEU  85   2.238 -12.127  -5.502
  657   HD13  LEU  85          3HD1      LEU  85   1.830 -10.614  -6.310
  658   HD21  LEU  85          3HD2      LEU  85   0.996  -9.004  -3.844
  659   HD22  LEU  85          1HD2      LEU  85   2.058  -8.478  -5.150
  660   HD23  LEU  85          2HD2      LEU  85   2.618  -8.414  -3.479
  661    H    MET  86           H        MET  86   1.213 -10.477  -0.411
  662    HA   MET  86           HA       MET  86   2.253 -11.558   1.986
  663    HB2  MET  86           1HB      MET  86   0.179 -10.226   1.897
  664    HB3  MET  86           2HB      MET  86  -0.605 -11.507   0.984
  665    HG2  MET  86           1HG      MET  86  -0.351 -13.016   2.893
  666    HG3  MET  86           2HG      MET  86   0.414 -11.719   3.810
  667    HE1  MET  86           3HE      MET  86  -2.891 -12.969   2.096
  668    HE2  MET  86           1HE      MET  86  -2.621 -11.414   1.307
  669    HE3  MET  86           2HE      MET  86  -3.986 -11.622   2.406
  670    H    GLU  87           H        GLU  87   1.105 -12.958  -0.944
  671    HA   GLU  87           HA       GLU  87   0.733 -15.615   0.102
  672    HB2  GLU  87           1HB      GLU  87  -0.572 -14.798  -1.809
  673    HB3  GLU  87           2HB      GLU  87   0.904 -14.591  -2.741
  674    HG2  GLU  87           1HG      GLU  87   1.289 -17.009  -2.647
  675    HG3  GLU  87           2HG      GLU  87  -0.212 -17.200  -1.742
  676    H    ASP  88           H        ASP  88   3.405 -13.748  -0.828
  677    HA   ASP  88           HA       ASP  88   4.954 -16.006  -1.836
  678    HB2  ASP  88           1HB      ASP  88   5.032 -13.763  -2.965
  679    HB3  ASP  88           2HB      ASP  88   5.820 -13.125  -1.526
  680    H    LYS  89           H        LYS  89   5.895 -17.266  -0.387
  681    HA   LYS  89           HA       LYS  89   6.569 -16.280   2.240
  682    HB2  LYS  89           1HB      LYS  89   6.678 -18.962   0.906
  683    HB3  LYS  89           2HB      LYS  89   7.544 -18.695   2.413
  684    HG2  LYS  89           1HG      LYS  89   5.525 -18.183   3.569
  685    HG3  LYS  89           2HG      LYS  89   4.604 -18.162   2.065
  686    HD2  LYS  89           1HD      LYS  89   4.867 -20.513   1.781
  687    HD3  LYS  89           2HD      LYS  89   6.050 -20.597   3.088
  688    HE2  LYS  89           1HE      LYS  89   3.722 -21.403   3.648
  689    HE3  LYS  89           2HE      LYS  89   4.407 -20.196   4.736
  690    HZ1  LYS  89           3HZ      LYS  89   2.012 -19.890   3.988
  691    HZ2  LYS  89           1HZ      LYS  89   2.644 -19.424   2.484
  692    HZ3  LYS  89           2HZ      LYS  89   3.032 -18.540   3.882
  693    H    ALA  90           H        ALA  90   8.231 -14.909   2.221
  694    HA   ALA  90           HA       ALA  90  10.558 -15.254   0.605
  695    HB1  ALA  90           3HB      ALA  90  10.109 -13.445   2.978
  696    HB2  ALA  90           1HB      ALA  90   9.791 -13.041   1.291
  697    HB3  ALA  90           2HB      ALA  90  11.444 -13.334   1.830
  698    H    GLU  91           H        GLU  91   9.612 -16.264   3.790
  699    HA   GLU  91           HA       GLU  91  12.322 -17.321   4.235
  700    HB2  GLU  91           1HB      GLU  91  10.152 -16.741   6.255
  701    HB3  GLU  91           2HB      GLU  91  11.691 -17.500   6.626
  702    HG2  GLU  91           1HG      GLU  91  12.802 -15.418   5.758
  703    HG3  GLU  91           2HG      GLU  91  11.198 -14.685   5.709
  704    H    ALA  92           H        ALA  92  12.553 -19.450   4.946
  705    HA   ALA  92           HA       ALA  92  10.151 -21.127   4.966
  706    HB1  ALA  92           3HB      ALA  92  12.671 -21.765   3.431
  707    HB2  ALA  92           1HB      ALA  92  11.098 -21.368   2.738
  708    HB3  ALA  92           2HB      ALA  92  11.307 -22.858   3.658
  709    HA   PRO  93           HA       PRO  93  12.656 -21.965   8.687
  710    HB2  PRO  93           1HB      PRO  93  10.546 -22.695  10.235
  711    HB3  PRO  93           2HB      PRO  93  11.018 -21.012   9.984
  712    HG2  PRO  93           1HG      PRO  93   8.834 -22.582   8.682
  713    HG3  PRO  93           2HG      PRO  93   8.823 -20.901   9.246
  714    HD2  PRO  93           1HD      PRO  93   9.134 -21.599   6.632
  715    HD3  PRO  93           2HD      PRO  93   9.829 -20.125   7.333
  716    H    ASN  94           H        ASN  94  13.541 -23.861   9.243
  717    HA   ASN  94           HA       ASN  94  12.381 -26.293   8.084
  718    HB2  ASN  94           1HB      ASN  94  14.548 -27.315   8.346
  719    HB3  ASN  94           2HB      ASN  94  14.772 -25.738   7.602
  720   HD21  ASN  94          2HD2      ASN  94  16.592 -27.456   9.149
  721   HD22  ASN  94          1HD2      ASN  94  17.177 -26.456  10.445
  722    H    THR  95           H        THR  95  12.220 -24.669  10.893
  723    HA   THR  95           HA       THR  95  12.473 -26.899  12.720
  724    HB   THR  95           HB       THR  95  11.355 -24.157  13.323
  725    HG1  THR  95           HG1      THR  95  14.049 -25.057  13.069
  726   HG21  THR  95          3HG2      THR  95  12.207 -24.609  15.572
  727   HG22  THR  95          1HG2      THR  95  12.807 -26.180  15.039
  728   HG23  THR  95          2HG2      THR  95  11.073 -25.861  15.070
  729    H    ILE  96           H        ILE  96  10.098 -25.749  10.643
  730    HA   ILE  96           HA       ILE  96   7.891 -26.556  12.374
  731    HB   ILE  96           HB       ILE  96   7.559 -24.443  11.257
  732   HG12  ILE  96          1HG1      ILE  96   5.829 -26.587  10.007
  733   HG13  ILE  96          2HG1      ILE  96   5.595 -25.889  11.605
  734   HG21  ILE  96          1HG2      ILE  96   9.021 -24.740   9.347
  735   HG22  ILE  96          2HG2      ILE  96   7.408 -24.257   8.818
  736   HG23  ILE  96          3HG2      ILE  96   7.918 -25.939   8.668
  737   HD11  ILE  96          3HD1      ILE  96   5.169 -23.711  10.593
  738   HD12  ILE  96          1HD1      ILE  96   4.054 -24.938   9.991
  739   HD13  ILE  96          2HD1      ILE  96   5.407 -24.409   8.990
  740    H    ALA  97           H        ALA  97   7.140 -28.538  12.298
  741    HA   ALA  97           HA       ALA  97   7.703 -30.300  10.082
  742    HB1  ALA  97           3HB      ALA  97   7.664 -31.176  12.365
  743    HB2  ALA  97           1HB      ALA  97   6.438 -31.960  11.369
  744    HB3  ALA  97           2HB      ALA  97   5.970 -30.711  12.523
  745    H    SER  98           H        SER  98   6.611 -30.056   8.258
  746    HA   SER  98           HA       SER  98   4.224 -28.567   8.057
  747    HB2  SER  98           1HB      SER  98   4.264 -29.409   5.664
  748    HB3  SER  98           2HB      SER  98   5.718 -28.564   6.199
  749    HG   SER  98           HG       SER  98   6.407 -30.404   5.191
  750    H    GLY  99           H        GLY  99   4.874 -32.052   7.892
  751    HA2  GLY  99           1HA      GLY  99   3.234 -33.631   8.693
  752    HA3  GLY  99           2HA      GLY  99   1.975 -32.506   8.194
  753    H    SER 100           H        SER 100   4.787 -34.072   6.701
  754    HA   SER 100           HA       SER 100   3.019 -35.082   4.594
  755    HB2  SER 100           1HB      SER 100   5.039 -34.515   3.015
  756    HB3  SER 100           2HB      SER 100   3.884 -33.255   3.444
  757    HG   SER 100           HG       SER 100   5.370 -32.663   5.148
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1 -17.247  31.409   5.422
    2    H2   MET   1           2H       MET   1 -15.621  31.291   5.898
    3    H3   MET   1           3H       MET   1 -16.434  29.926   5.306
    4    HA   MET   1           HA       MET   1 -15.852  32.371   3.742
    5    HB2  MET   1           1HB      MET   1 -14.609  29.610   3.647
    6    HB3  MET   1           2HB      MET   1 -14.295  30.894   2.489
    7    HG2  MET   1           1HG      MET   1 -13.285  32.250   4.200
    8    HG3  MET   1           2HG      MET   1 -13.702  31.061   5.432
    9    HE1  MET   1           3HE      MET   1 -12.600  28.665   5.612
   10    HE2  MET   1           1HE      MET   1 -11.416  28.037   4.465
   11    HE3  MET   1           2HE      MET   1 -13.080  28.309   3.952
   12    H    GLU   2           H        GLU   2 -16.003  31.666   1.315
   13    HA   GLU   2           HA       GLU   2 -18.635  30.619   0.863
   14    HB2  GLU   2           1HB      GLU   2 -16.409  31.289  -1.074
   15    HB3  GLU   2           2HB      GLU   2 -18.054  30.873  -1.540
   16    HG2  GLU   2           1HG      GLU   2 -18.898  32.823  -0.365
   17    HG3  GLU   2           2HG      GLU   2 -17.264  33.232   0.153
   18    H    VAL   3           H        VAL   3 -15.355  29.407   0.545
   19    HA   VAL   3           HA       VAL   3 -16.346  26.776  -0.256
   20    HB   VAL   3           HB       VAL   3 -13.483  27.661   0.168
   21   HG11  VAL   3          1HG1      VAL   3 -14.619  25.238  -1.220
   22   HG12  VAL   3          2HG1      VAL   3 -13.799  25.252   0.341
   23   HG13  VAL   3          3HG1      VAL   3 -12.911  25.666  -1.126
   24   HG21  VAL   3          3HG2      VAL   3 -13.343  27.779  -2.287
   25   HG22  VAL   3          1HG2      VAL   3 -14.470  28.962  -1.622
   26   HG23  VAL   3          2HG2      VAL   3 -15.082  27.493  -2.386
   27    H    GLN   4           H        GLN   4 -16.374  25.045   1.118
   28    HA   GLN   4           HA       GLN   4 -15.983  25.667   3.931
   29    HB2  GLN   4           1HB      GLN   4 -17.153  23.194   2.647
   30    HB3  GLN   4           2HB      GLN   4 -17.155  23.561   4.367
   31    HG2  GLN   4           1HG      GLN   4 -18.638  24.986   2.178
   32    HG3  GLN   4           2HG      GLN   4 -19.311  24.064   3.520
   33   HE21  GLN   4          2HE2      GLN   4 -19.834  26.798   2.723
   34   HE22  GLN   4          1HE2      GLN   4 -19.435  27.794   4.088
   35    H    SER   5           H        SER   5 -14.592  24.637   5.289
   36    HA   SER   5           HA       SER   5 -12.396  23.227   3.959
   37    HB2  SER   5           1HB      SER   5 -11.209  23.702   6.174
   38    HB3  SER   5           2HB      SER   5 -11.604  25.102   5.178
   39    HG   SER   5           HG       SER   5 -13.622  24.442   6.903
   40    H    MET   6           H        MET   6 -12.833  21.105   3.871
   41    HA   MET   6           HA       MET   6 -13.760  19.765   6.320
   42    HB2  MET   6           1HB      MET   6 -13.805  18.813   3.449
   43    HB3  MET   6           2HB      MET   6 -14.309  17.849   4.829
   44    HG2  MET   6           1HG      MET   6 -16.056  19.506   5.318
   45    HG3  MET   6           2HG      MET   6 -15.573  20.408   3.883
   46    HE1  MET   6           3HE      MET   6 -17.162  17.108   5.268
   47    HE2  MET   6           1HE      MET   6 -15.774  16.492   4.376
   48    HE3  MET   6           2HE      MET   6 -17.407  16.171   3.794
   49    H    LEU   7           H        LEU   7 -12.781  17.672   6.826
   50    HA   LEU   7           HA       LEU   7  -9.942  17.597   6.019
   51    HB2  LEU   7           1HB      LEU   7 -11.172  16.814   8.665
   52    HB3  LEU   7           2HB      LEU   7  -9.481  16.624   8.245
   53    HG   LEU   7           HG       LEU   7 -10.935  19.261   8.476
   54   HD11  LEU   7          1HD1      LEU   7 -10.635  18.181  10.636
   55   HD12  LEU   7          2HD1      LEU   7  -9.573  19.580  10.480
   56   HD13  LEU   7          3HD1      LEU   7  -8.919  17.951  10.294
   57   HD21  LEU   7          3HD2      LEU   7  -9.114  19.297   6.828
   58   HD22  LEU   7          1HD2      LEU   7  -8.006  18.674   8.050
   59   HD23  LEU   7          2HD2      LEU   7  -8.735  20.268   8.251
   60    H    LEU   8           H        LEU   8  -8.967  15.535   5.814
   61    HA   LEU   8           HA       LEU   8 -10.841  13.433   5.085
   62    HB2  LEU   8           1HB      LEU   8  -7.823  13.482   4.901
   63    HB3  LEU   8           2HB      LEU   8  -8.877  12.261   4.212
   64    HG   LEU   8           HG       LEU   8  -8.690  15.154   3.372
   65   HD11  LEU   8          1HD1      LEU   8  -7.902  14.218   1.257
   66   HD12  LEU   8          2HD1      LEU   8  -7.983  12.596   1.946
   67   HD13  LEU   8          3HD1      LEU   8  -6.842  13.773   2.598
   68   HD21  LEU   8          3HD2      LEU   8 -11.000  14.378   3.245
   69   HD22  LEU   8          1HD2      LEU   8 -10.482  12.963   2.327
   70   HD23  LEU   8          2HD2      LEU   8 -10.310  14.577   1.635
   71    H    ASN   9           H        ASN   9 -11.328  11.784   6.381
   72    HA   ASN   9           HA       ASN   9 -10.075  11.777   9.016
   73    HB2  ASN   9           1HB      ASN   9 -12.048  10.525   9.749
   74    HB3  ASN   9           2HB      ASN   9 -12.525  11.992   8.900
   75   HD21  ASN   9          2HD2      ASN   9 -12.558   8.545   8.894
   76   HD22  ASN   9          1HD2      ASN   9 -13.573   8.350   7.511
   77    H    ASP  10           H        ASP  10  -9.976   9.580  10.106
   78    HA   ASP  10           HA       ASP  10  -8.216   7.923   8.579
   79    HB2  ASP  10           1HB      ASP  10  -9.430   7.504  11.322
   80    HB3  ASP  10           2HB      ASP  10  -8.185   6.484  10.612
   81    H    VAL  11           H        VAL  11  -9.247   6.930   6.899
   82    HA   VAL  11           HA       VAL  11 -11.695   5.489   7.352
   83    HB   VAL  11           HB       VAL  11 -11.403   4.838   4.935
   84   HG11  VAL  11          1HG1      VAL  11 -11.438   7.778   5.585
   85   HG12  VAL  11          2HG1      VAL  11 -12.828   6.692   5.597
   86   HG13  VAL  11          3HG1      VAL  11 -12.006   7.057   4.079
   87   HG21  VAL  11          3HG2      VAL  11  -8.987   5.074   4.763
   88   HG22  VAL  11          1HG2      VAL  11  -9.126   6.805   5.069
   89   HG23  VAL  11          2HG2      VAL  11  -9.800   6.113   3.593
   90    H    LYS  12           H        LYS  12 -11.620   3.591   8.298
   91    HA   LYS  12           HA       LYS  12  -9.165   2.077   8.323
   92    HB2  LYS  12           1HB      LYS  12 -11.832   1.319   9.543
   93    HB3  LYS  12           2HB      LYS  12 -10.274   0.588   9.892
   94    HG2  LYS  12           1HG      LYS  12 -10.423   1.947  11.695
   95    HG3  LYS  12           2HG      LYS  12  -9.696   3.098  10.572
   96    HD2  LYS  12           1HD      LYS  12 -11.910   3.975  10.032
   97    HD3  LYS  12           2HD      LYS  12 -12.648   2.810  11.131
   98    HE2  LYS  12           1HE      LYS  12 -10.756   5.039  11.871
   99    HE3  LYS  12           2HE      LYS  12 -12.488   4.985  12.192
  100    HZ1  LYS  12           3HZ      LYS  12 -11.797   2.773  13.414
  101    HZ2  LYS  12           1HZ      LYS  12 -11.677   4.282  14.184
  102    HZ3  LYS  12           2HZ      LYS  12 -10.299   3.562  13.517
  103    H    TRP  13           H        TRP  13  -9.020  -0.137   7.636
  104    HA   TRP  13           HA       TRP  13 -10.436  -0.540   5.152
  105    HB2  TRP  13           1HB      TRP  13  -7.971  -1.487   6.320
  106    HB3  TRP  13           2HB      TRP  13  -8.922  -2.838   5.711
  107    HD1  TRP  13           HD1      TRP  13 -10.079  -1.889   3.079
  108    HE1  TRP  13           HE1      TRP  13  -8.613  -1.176   1.089
  109    HE3  TRP  13           HE3      TRP  13  -5.761  -0.834   5.601
  110    HZ2  TRP  13           HZ2      TRP  13  -5.963  -0.300   0.645
  111    HZ3  TRP  13           HZ3      TRP  13  -3.804  -0.074   4.320
  112    HH2  TRP  13           HH2      TRP  13  -3.903   0.188   1.894
  113    H    GLU  14           H        GLU  14 -11.957  -2.047   4.716
  114    HA   GLU  14           HA       GLU  14 -13.421  -3.244   6.839
  115    HB2  GLU  14           1HB      GLU  14 -13.481  -3.990   3.907
  116    HB3  GLU  14           2HB      GLU  14 -14.727  -4.324   5.101
  117    HG2  GLU  14           1HG      GLU  14 -13.914  -1.621   4.053
  118    HG3  GLU  14           2HG      GLU  14 -15.403  -2.492   3.696
  119    H    LYS  15           H        LYS  15 -10.870  -4.245   4.719
  120    HA   LYS  15           HA       LYS  15 -10.538  -6.688   6.297
  121    HB2  LYS  15           1HB      LYS  15 -10.227  -6.485   3.292
  122    HB3  LYS  15           2HB      LYS  15  -9.877  -7.908   4.265
  123    HG2  LYS  15           1HG      LYS  15 -12.200  -8.136   4.854
  124    HG3  LYS  15           2HG      LYS  15 -12.593  -6.632   4.019
  125    HD2  LYS  15           1HD      LYS  15 -11.816  -7.651   1.906
  126    HD3  LYS  15           2HD      LYS  15 -11.546  -9.167   2.772
  127    HE2  LYS  15           1HE      LYS  15 -13.905  -9.286   3.337
  128    HE3  LYS  15           2HE      LYS  15 -14.191  -7.737   2.542
  129    HZ1  LYS  15           3HZ      LYS  15 -13.451  -8.759   0.452
  130    HZ2  LYS  15           1HZ      LYS  15 -14.825  -9.519   1.093
  131    HZ3  LYS  15           2HZ      LYS  15 -13.304 -10.253   1.243
  132    HA   PRO  16           HA       PRO  16  -6.682  -4.463   6.982
  133    HB2  PRO  16           1HB      PRO  16  -6.095  -7.161   8.121
  134    HB3  PRO  16           2HB      PRO  16  -5.813  -5.559   8.816
  135    HG2  PRO  16           1HG      PRO  16  -7.846  -7.037   9.659
  136    HG3  PRO  16           2HG      PRO  16  -8.038  -5.289   9.429
  137    HD2  PRO  16           1HD      PRO  16  -9.001  -7.542   7.728
  138    HD3  PRO  16           2HD      PRO  16  -9.769  -5.980   8.076
  139    H    VAL  17           H        VAL  17  -4.613  -4.531   6.123
  140    HA   VAL  17           HA       VAL  17  -4.196  -6.584   4.048
  141    HB   VAL  17           HB       VAL  17  -3.093  -3.770   4.071
  142   HG11  VAL  17          1HG1      VAL  17  -3.107  -5.892   1.927
  143   HG12  VAL  17          2HG1      VAL  17  -1.704  -5.325   2.833
  144   HG13  VAL  17          3HG1      VAL  17  -2.536  -4.236   1.723
  145   HG21  VAL  17          3HG2      VAL  17  -5.482  -3.661   3.816
  146   HG22  VAL  17          1HG2      VAL  17  -5.440  -4.917   2.580
  147   HG23  VAL  17          2HG2      VAL  17  -4.719  -3.340   2.257
  148    H    THR  18           H        THR  18  -2.440  -7.829   4.220
  149    HA   THR  18           HA       THR  18  -0.392  -7.122   6.186
  150    HB   THR  18           HB       THR  18   0.370  -9.554   5.577
  151    HG1  THR  18           HG1      THR  18  -1.176 -10.811   4.658
  152   HG21  THR  18          3HG2      THR  18  -1.160 -10.477   7.247
  153   HG22  THR  18          1HG2      THR  18  -2.184  -9.048   7.105
  154   HG23  THR  18          2HG2      THR  18  -0.548  -8.900   7.750
  155    H    ILE  19           H        ILE  19   1.016  -5.734   5.173
  156    HA   ILE  19           HA       ILE  19   1.751  -6.272   2.407
  157    HB   ILE  19           HB       ILE  19   1.272  -3.958   2.925
  158   HG12  ILE  19          1HG1      ILE  19   4.225  -4.422   2.480
  159   HG13  ILE  19          2HG1      ILE  19   2.979  -4.320   1.241
  160   HG21  ILE  19          1HG2      ILE  19   2.730  -2.650   4.456
  161   HG22  ILE  19          2HG2      ILE  19   3.442  -4.170   5.002
  162   HG23  ILE  19          3HG2      ILE  19   1.728  -3.854   5.272
  163   HD11  ILE  19          3HD1      ILE  19   2.601  -1.990   1.796
  164   HD12  ILE  19          1HD1      ILE  19   4.291  -2.275   1.388
  165   HD13  ILE  19          2HD1      ILE  19   3.812  -2.086   3.074
  166    H    SER  20           H        SER  20   3.225  -7.753   2.118
  167    HA   SER  20           HA       SER  20   5.151  -8.387   4.144
  168    HB2  SER  20           1HB      SER  20   3.981 -10.062   2.630
  169    HB3  SER  20           2HB      SER  20   5.027  -9.487   1.331
  170    HG   SER  20           HG       SER  20   5.820 -11.361   2.450
  171    H    LEU  21           H        LEU  21   6.847  -7.105   4.407
  172    HA   LEU  21           HA       LEU  21   8.037  -5.735   2.144
  173    HB2  LEU  21           1HB      LEU  21   8.856  -5.774   5.052
  174    HB3  LEU  21           2HB      LEU  21   9.503  -4.710   3.819
  175    HG   LEU  21           HG       LEU  21   6.652  -4.710   4.816
  176   HD11  LEU  21          1HD1      LEU  21   8.895  -2.744   5.250
  177   HD12  LEU  21          2HD1      LEU  21   8.222  -3.836   6.461
  178   HD13  LEU  21          3HD1      LEU  21   7.225  -2.545   5.787
  179   HD21  LEU  21          3HD2      LEU  21   6.394  -2.699   3.459
  180   HD22  LEU  21          1HD2      LEU  21   6.813  -4.089   2.459
  181   HD23  LEU  21          2HD2      LEU  21   8.040  -2.886   2.855
  182    H    GLN  22           H        GLN  22  10.293  -5.961   1.607
  183    HA   GLN  22           HA       GLN  22  11.101  -8.625   1.288
  184    HB2  GLN  22           1HB      GLN  22  11.801  -6.749  -0.183
  185    HB3  GLN  22           2HB      GLN  22  12.826  -6.146   1.111
  186    HG2  GLN  22           1HG      GLN  22  14.102  -7.375  -0.561
  187    HG3  GLN  22           2HG      GLN  22  14.174  -8.161   1.017
  188   HE21  GLN  22          2HE2      GLN  22  13.085 -10.110   1.327
  189   HE22  GLN  22          1HE2      GLN  22  12.542 -11.084   0.000
  190    H    ASN  23           H        ASN  23  11.435  -6.513   3.923
  191    HA   ASN  23           HA       ASN  23  13.744  -7.515   5.176
  192    HB2  ASN  23           1HB      ASN  23  11.249  -6.412   6.492
  193    HB3  ASN  23           2HB      ASN  23  12.862  -6.490   7.198
  194   HD21  ASN  23          2HD2      ASN  23  14.437  -5.032   6.524
  195   HD22  ASN  23          1HD2      ASN  23  14.041  -3.611   5.611
  196    H    GLY  24           H        GLY  24  10.592  -8.835   4.749
  197    HA2  GLY  24           1HA      GLY  24  10.321 -11.207   4.941
  198    HA3  GLY  24           2HA      GLY  24  11.463 -11.192   6.274
  199    H    ALA  25           H        ALA  25   8.779  -8.929   5.978
  200    HA   ALA  25           HA       ALA  25   7.116 -10.439   7.791
  201    HB1  ALA  25           3HB      ALA  25   8.732  -9.416   9.333
  202    HB2  ALA  25           1HB      ALA  25   7.101  -8.794   9.581
  203    HB3  ALA  25           2HB      ALA  25   8.295  -7.821   8.723
  204    HA   PRO  26           HA       PRO  26   4.250  -7.742   5.603
  205    HB2  PRO  26           1HB      PRO  26   2.136  -9.505   6.379
  206    HB3  PRO  26           2HB      PRO  26   2.884  -9.344   4.791
  207    HG2  PRO  26           1HG      PRO  26   3.078 -11.571   6.402
  208    HG3  PRO  26           2HG      PRO  26   4.208 -11.159   5.102
  209    HD2  PRO  26           1HD      PRO  26   4.482 -10.742   8.058
  210    HD3  PRO  26           2HD      PRO  26   5.713 -11.221   6.865
  211    H    ARG  27           H        ARG  27   3.808  -5.939   6.736
  212    HA   ARG  27           HA       ARG  27   2.786  -6.108   9.434
  213    HB2  ARG  27           1HB      ARG  27   4.369  -4.306   8.886
  214    HB3  ARG  27           2HB      ARG  27   3.235  -3.668   7.698
  215    HG2  ARG  27           1HG      ARG  27   1.602  -3.278   9.477
  216    HG3  ARG  27           2HG      ARG  27   2.753  -3.889  10.661
  217    HD2  ARG  27           1HD      ARG  27   4.253  -2.050  10.204
  218    HD3  ARG  27           2HD      ARG  27   3.197  -1.476   8.908
  219    HE   ARG  27           HE       ARG  27   1.798  -1.710  11.373
  220   HH11  ARG  27          1HH1      ARG  27   4.134   0.361   9.778
  221   HH12  ARG  27          2HH1      ARG  27   3.522   1.810  10.517
  222   HH21  ARG  27          1HH2      ARG  27   0.994   0.164  12.331
  223   HH22  ARG  27          2HH2      ARG  27   1.716   1.706  11.962
  224    H    ILE  28           H        ILE  28   0.751  -5.618  10.095
  225    HA   ILE  28           HA       ILE  28  -1.293  -5.779   8.010
  226    HB   ILE  28           HB       ILE  28  -1.692  -5.988  10.993
  227   HG12  ILE  28          1HG1      ILE  28  -1.188  -8.236   9.028
  228   HG13  ILE  28          2HG1      ILE  28  -0.013  -7.646  10.197
  229   HG21  ILE  28          1HG2      ILE  28  -3.698  -5.585   9.651
  230   HG22  ILE  28          2HG2      ILE  28  -3.718  -7.198  10.365
  231   HG23  ILE  28          3HG2      ILE  28  -3.319  -6.993   8.658
  232   HD11  ILE  28          3HD1      ILE  28  -1.066  -9.675  10.983
  233   HD12  ILE  28          1HD1      ILE  28  -2.658  -8.934  10.830
  234   HD13  ILE  28          2HD1      ILE  28  -1.509  -8.317  12.016
  235    H    PHE  29           H        PHE  29  -2.027  -3.862   7.309
  236    HA   PHE  29           HA       PHE  29  -2.038  -1.540   9.035
  237    HB2  PHE  29           1HB      PHE  29  -2.995  -1.937   6.194
  238    HB3  PHE  29           2HB      PHE  29  -3.073  -0.401   7.048
  239    HD1  PHE  29           HD1      PHE  29  -0.543  -0.201   8.401
  240    HD2  PHE  29           HD2      PHE  29  -1.415  -1.768   4.543
  241    HE1  PHE  29           HE1      PHE  29   1.745   0.327   7.676
  242    HE2  PHE  29           HE2      PHE  29   0.874  -1.243   3.809
  243    HZ   PHE  29           HZ       PHE  29   2.461  -0.197   5.381
  244    H    ASN  30           H        ASN  30  -3.811  -0.485   9.845
  245    HA   ASN  30           HA       ASN  30  -6.241  -2.114  10.039
  246    HB2  ASN  30           1HB      ASN  30  -5.433   0.360  11.593
  247    HB3  ASN  30           2HB      ASN  30  -6.811  -0.681  11.939
  248   HD21  ASN  30          2HD2      ASN  30  -3.349  -0.370  12.037
  249   HD22  ASN  30          1HD2      ASN  30  -3.055  -1.733  13.080
  250    H    GLY  31           H        GLY  31  -5.021   0.891   8.821
  251    HA2  GLY  31           1HA      GLY  31  -7.570   1.331   7.461
  252    HA3  GLY  31           2HA      GLY  31  -6.947   2.632   8.471
  253    H    VAL  32           H        VAL  32  -7.402   2.985   5.770
  254    HA   VAL  32           HA       VAL  32  -5.091   2.529   4.179
  255    HB   VAL  32           HB       VAL  32  -7.115   4.714   3.704
  256   HG11  VAL  32          1HG1      VAL  32  -5.212   4.738   2.219
  257   HG12  VAL  32          2HG1      VAL  32  -6.639   4.194   1.339
  258   HG13  VAL  32          3HG1      VAL  32  -5.429   3.024   1.864
  259   HG21  VAL  32          3HG2      VAL  32  -8.367   2.691   4.195
  260   HG22  VAL  32          1HG2      VAL  32  -7.386   1.781   3.046
  261   HG23  VAL  32          2HG2      VAL  32  -8.459   3.058   2.471
  262    H    TYR  33           H        TYR  33  -5.949   4.857   6.523
  263    HA   TYR  33           HA       TYR  33  -4.350   7.040   5.819
  264    HB2  TYR  33           1HB      TYR  33  -6.108   6.943   7.630
  265    HB3  TYR  33           2HB      TYR  33  -4.945   6.078   8.624
  266    HD1  TYR  33           HD2      TYR  33  -2.969   7.249   9.526
  267    HD2  TYR  33           HD1      TYR  33  -5.922   9.308   7.255
  268    HE1  TYR  33           HE2      TYR  33  -2.104   9.397  10.355
  269    HE2  TYR  33           HE1      TYR  33  -5.064  11.460   8.082
  270    HH   TYR  33           HH       TYR  33  -3.795  12.263  10.134
  271    H    GLU  34           H        GLU  34  -3.636   4.142   7.733
  272    HA   GLU  34           HA       GLU  34  -0.981   4.859   8.414
  273    HB2  GLU  34           1HB      GLU  34  -2.191   2.099   8.170
  274    HB3  GLU  34           2HB      GLU  34  -0.693   2.494   8.997
  275    HG2  GLU  34           1HG      GLU  34  -2.004   3.913  10.559
  276    HG3  GLU  34           2HG      GLU  34  -3.473   3.327   9.777
  277    H    ALA  35           H        ALA  35  -2.395   2.969   5.804
  278    HA   ALA  35           HA       ALA  35  -0.034   2.028   4.640
  279    HB1  ALA  35           3HB      ALA  35  -2.294   1.176   4.124
  280    HB2  ALA  35           1HB      ALA  35  -1.369   1.578   2.676
  281    HB3  ALA  35           2HB      ALA  35  -2.630   2.671   3.247
  282    H    PHE  36           H        PHE  36  -1.999   4.879   3.830
  283    HA   PHE  36           HA       PHE  36  -0.456   5.928   1.780
  284    HB2  PHE  36           1HB      PHE  36  -2.670   6.791   2.408
  285    HB3  PHE  36           2HB      PHE  36  -2.007   7.425   3.905
  286    HD1  PHE  36           HD2      PHE  36  -1.521   7.658   0.215
  287    HD2  PHE  36           HD1      PHE  36  -1.346   9.628   3.985
  288    HE1  PHE  36           HE2      PHE  36  -1.009   9.783  -0.920
  289    HE2  PHE  36           HE1      PHE  36  -0.836  11.753   2.857
  290    HZ   PHE  36           HZ       PHE  36  -0.668  11.835   0.400
  291    H    ASP  37           H        ASP  37  -0.194   6.478   5.266
  292    HA   ASP  37           HA       ASP  37   1.908   8.356   5.111
  293    HB2  ASP  37           1HB      ASP  37   0.493   8.231   7.073
  294    HB3  ASP  37           2HB      ASP  37   1.012   6.577   7.382
  295    H    PHE  38           H        PHE  38   1.896   4.843   5.709
  296    HA   PHE  38           HA       PHE  38   4.643   4.575   6.200
  297    HB2  PHE  38           1HB      PHE  38   3.125   2.772   6.738
  298    HB3  PHE  38           2HB      PHE  38   2.682   2.587   5.044
  299    HD1  PHE  38           HD2      PHE  38   5.708   2.525   7.222
  300    HD2  PHE  38           HD1      PHE  38   3.706   0.923   3.823
  301    HE1  PHE  38           HE2      PHE  38   7.530   0.896   6.917
  302    HE2  PHE  38           HE1      PHE  38   5.521  -0.703   3.512
  303    HZ   PHE  38           HZ       PHE  38   7.437  -0.718   5.059
  304    H    LEU  39           H        LEU  39   2.819   4.527   3.187
  305    HA   LEU  39           HA       LEU  39   4.877   3.678   1.477
  306    HB2  LEU  39           1HB      LEU  39   2.515   5.466   0.931
  307    HB3  LEU  39           2HB      LEU  39   3.544   4.780  -0.311
  308    HG   LEU  39           HG       LEU  39   1.870   3.177   1.621
  309   HD11  LEU  39          1HD1      LEU  39   0.488   4.432   0.059
  310   HD12  LEU  39          2HD1      LEU  39   0.460   2.710  -0.319
  311   HD13  LEU  39          3HD1      LEU  39   1.435   3.811  -1.293
  312   HD21  LEU  39          3HD2      LEU  39   3.453   2.341  -0.806
  313   HD22  LEU  39          1HD2      LEU  39   2.427   1.292   0.172
  314   HD23  LEU  39          2HD2      LEU  39   3.881   2.005   0.872
  315    H    GLN  40           H        GLN  40   4.289   6.719   2.989
  316    HA   GLN  40           HA       GLN  40   6.097   8.151   1.216
  317    HB2  GLN  40           1HB      GLN  40   4.625   9.051   3.699
  318    HB3  GLN  40           2HB      GLN  40   5.602  10.094   2.678
  319    HG2  GLN  40           1HG      GLN  40   4.091   9.734   0.819
  320    HG3  GLN  40           2HG      GLN  40   3.132   8.621   1.795
  321   HE21  GLN  40          2HE2      GLN  40   2.380  11.137   0.492
  322   HE22  GLN  40          1HE2      GLN  40   1.761  12.149   1.748
  323    H    HIS  41           H        HIS  41   6.138   6.543   4.282
  324    HA   HIS  41           HA       HIS  41   8.411   7.935   5.327
  325    HB2  HIS  41           1HB      HIS  41   6.937   5.454   6.171
  326    HB3  HIS  41           2HB      HIS  41   8.444   5.924   6.949
  327    HD1  HIS  41           HD1      HIS  41   7.407   6.484   9.198
  328    HD2  HIS  41           HD2      HIS  41   5.726   8.588   6.031
  329    HE1  HIS  41           HE1      HIS  41   5.929   8.229  10.245
  330    HE2  HIS  41           HE2      HIS  41   4.726   9.289   8.302
  331    H    GLU  42           H        GLU  42   8.055   4.515   4.299
  332    HA   GLU  42           HA       GLU  42  10.545   4.644   2.899
  333    HB2  GLU  42           1HB      GLU  42  11.648   2.851   4.281
  334    HB3  GLU  42           2HB      GLU  42  11.567   4.447   5.013
  335    HG2  GLU  42           1HG      GLU  42   9.692   3.741   6.388
  336    HG3  GLU  42           2HG      GLU  42   9.720   2.150   5.626
  337    H    TRP  43           H        TRP  43   8.926   4.005   1.339
  338    HA   TRP  43           HA       TRP  43   8.135   1.220   1.364
  339    HB2  TRP  43           1HB      TRP  43   6.612   2.737   0.313
  340    HB3  TRP  43           2HB      TRP  43   7.888   3.446  -0.666
  341    HD1  TRP  43           HD1      TRP  43   8.224   2.489  -3.011
  342    HE1  TRP  43           HE1      TRP  43   7.230   0.533  -4.348
  343    HE3  TRP  43           HE3      TRP  43   5.654   0.124   0.757
  344    HZ2  TRP  43           HZ2      TRP  43   5.584  -1.700  -3.887
  345    HZ3  TRP  43           HZ3      TRP  43   4.404  -1.912   0.199
  346    HH2  TRP  43           HH2      TRP  43   4.368  -2.806  -2.067
  347    HA   PRO  44           HA       PRO  44  12.269   0.397  -0.113
  348    HB2  PRO  44           1HB      PRO  44  12.429  -2.126   0.729
  349    HB3  PRO  44           2HB      PRO  44  12.360  -0.784   1.876
  350    HG2  PRO  44           1HG      PRO  44  10.221  -2.694   1.062
  351    HG3  PRO  44           2HG      PRO  44  10.551  -1.987   2.652
  352    HD2  PRO  44           1HD      PRO  44   8.628  -1.097   0.820
  353    HD3  PRO  44           2HD      PRO  44   9.225  -0.197   2.227
  354    H    ALA  45           H        ALA  45   9.989   0.143  -2.026
  355    HA   ALA  45           HA       ALA  45  11.186  -1.973  -3.677
  356    HB1  ALA  45           3HB      ALA  45   9.001  -2.532  -4.589
  357    HB2  ALA  45           1HB      ALA  45   8.241  -1.344  -3.531
  358    HB3  ALA  45           2HB      ALA  45   9.026  -2.764  -2.840
  359    H    ARG  46           H        ARG  46  12.157  -1.027  -5.324
  360    HA   ARG  46           HA       ARG  46  11.422   1.602  -6.208
  361    HB2  ARG  46           1HB      ARG  46  13.768   0.901  -6.168
  362    HB3  ARG  46           2HB      ARG  46  13.420  -0.369  -7.333
  363    HG2  ARG  46           1HG      ARG  46  12.996   1.196  -9.052
  364    HG3  ARG  46           2HG      ARG  46  12.976   2.543  -7.913
  365    HD2  ARG  46           1HD      ARG  46  15.356   2.151  -7.437
  366    HD3  ARG  46           2HD      ARG  46  15.367   0.846  -8.624
  367    HE   ARG  46           HE       ARG  46  15.540   2.412 -10.267
  368   HH11  ARG  46          1HH1      ARG  46  14.372   3.989  -7.363
  369   HH12  ARG  46          2HH1      ARG  46  14.378   5.575  -8.068
  370   HH21  ARG  46          1HH2      ARG  46  15.599   4.501 -11.184
  371   HH22  ARG  46          2HH2      ARG  46  15.111   5.876 -10.226
  372    H    GLY  47           H        GLY  47  10.180   2.149  -7.895
  373    HA2  GLY  47           1HA      GLY  47   9.606   0.492 -10.112
  374    HA3  GLY  47           2HA      GLY  47   8.319   0.349  -8.923
  375    H    ASP  48           H        ASP  48   8.642   3.097  -8.008
  376    HA   ASP  48           HA       ASP  48   8.105   5.246  -8.448
  377    HB2  ASP  48           1HB      ASP  48   8.722   4.400 -11.264
  378    HB3  ASP  48           2HB      ASP  48   8.079   6.000 -10.911
  379    H    ARG  49           H        ARG  49   6.608   3.584 -11.240
  380    HA   ARG  49           HA       ARG  49   4.359   5.305 -11.112
  381    HB2  ARG  49           1HB      ARG  49   4.562   2.683 -12.592
  382    HB3  ARG  49           2HB      ARG  49   3.436   3.994 -12.922
  383    HG2  ARG  49           1HG      ARG  49   5.464   5.437 -13.371
  384    HG3  ARG  49           2HG      ARG  49   6.406   3.945 -13.348
  385    HD2  ARG  49           1HD      ARG  49   5.920   4.295 -15.609
  386    HD3  ARG  49           2HD      ARG  49   4.750   3.084 -15.091
  387    HE   ARG  49           HE       ARG  49   3.259   5.198 -14.778
  388   HH11  ARG  49          1HH1      ARG  49   5.597   4.641 -17.331
  389   HH12  ARG  49          2HH1      ARG  49   4.748   5.615 -18.498
  390   HH21  ARG  49          1HH2      ARG  49   2.149   6.483 -16.294
  391   HH22  ARG  49          2HH2      ARG  49   2.779   6.662 -17.905
  392    H    ALA  50           H        ALA  50   4.780   1.889 -10.180
  393    HA   ALA  50           HA       ALA  50   2.126   1.493  -9.315
  394    HB1  ALA  50           3HB      ALA  50   2.977  -0.434  -8.095
  395    HB2  ALA  50           1HB      ALA  50   4.628   0.142  -8.308
  396    HB3  ALA  50           2HB      ALA  50   3.681  -0.357  -9.710
  397    H    HIS  51           H        HIS  51   4.979   2.750  -7.683
  398    HA   HIS  51           HA       HIS  51   3.804   2.972  -5.104
  399    HB2  HIS  51           1HB      HIS  51   6.230   2.988  -5.395
  400    HB3  HIS  51           2HB      HIS  51   6.133   4.470  -6.337
  401    HD1  HIS  51           HD1      HIS  51   6.717   6.481  -5.044
  402    HD2  HIS  51           HD2      HIS  51   5.126   3.498  -2.615
  403    HE1  HIS  51           HE1      HIS  51   6.789   7.400  -2.701
  404    HE2  HIS  51           HE2      HIS  51   5.995   5.512  -1.234
  405    H    GLU  52           H        GLU  52   4.105   5.135  -7.866
  406    HA   GLU  52           HA       GLU  52   2.994   7.451  -6.740
  407    HB2  GLU  52           1HB      GLU  52   4.166   7.105  -9.015
  408    HB3  GLU  52           2HB      GLU  52   2.588   6.605  -9.603
  409    HG2  GLU  52           1HG      GLU  52   2.844   8.881 -10.162
  410    HG3  GLU  52           2HG      GLU  52   1.702   8.814  -8.820
  411    H    GLN  53           H        GLN  53   1.522   4.739  -8.471
  412    HA   GLN  53           HA       GLN  53  -1.144   5.618  -8.389
  413    HB2  GLN  53           1HB      GLN  53  -0.422   3.779  -9.828
  414    HB3  GLN  53           2HB      GLN  53  -0.036   2.798  -8.421
  415    HG2  GLN  53           1HG      GLN  53  -2.425   2.849  -7.783
  416    HG3  GLN  53           2HG      GLN  53  -2.772   3.731  -9.267
  417   HE21  GLN  53          2HE2      GLN  53  -0.800   2.222 -10.811
  418   HE22  GLN  53          1HE2      GLN  53  -1.500   0.667 -11.084
  419    H    ALA  54           H        ALA  54   0.719   3.581  -6.171
  420    HA   ALA  54           HA       ALA  54  -1.295   2.853  -4.410
  421    HB1  ALA  54           3HB      ALA  54   1.586   3.416  -3.714
  422    HB2  ALA  54           1HB      ALA  54   0.977   1.911  -4.402
  423    HB3  ALA  54           2HB      ALA  54   0.458   2.418  -2.795
  424    H    LEU  55           H        LEU  55   0.783   5.748  -4.309
  425    HA   LEU  55           HA       LEU  55  -0.273   6.805  -1.923
  426    HB2  LEU  55           1HB      LEU  55   1.275   7.912  -4.207
  427    HB3  LEU  55           2HB      LEU  55   0.471   9.053  -3.149
  428    HG   LEU  55           HG       LEU  55   1.700   8.173  -1.227
  429   HD11  LEU  55          1HD1      LEU  55   1.943   5.860  -1.971
  430   HD12  LEU  55          2HD1      LEU  55   3.496   6.563  -1.515
  431   HD13  LEU  55          3HD1      LEU  55   3.076   6.381  -3.217
  432   HD21  LEU  55          3HD2      LEU  55   3.926   8.960  -1.850
  433   HD22  LEU  55          1HD2      LEU  55   2.666  10.010  -2.501
  434   HD23  LEU  55          2HD2      LEU  55   3.487   8.858  -3.555
  435    H    ARG  56           H        ARG  56  -1.179   7.327  -5.305
  436    HA   ARG  56           HA       ARG  56  -3.183   9.240  -4.847
  437    HB2  ARG  56           1HB      ARG  56  -2.467   9.031  -7.070
  438    HB3  ARG  56           2HB      ARG  56  -2.650   7.285  -7.063
  439    HG2  ARG  56           1HG      ARG  56  -5.025   7.455  -7.170
  440    HG3  ARG  56           2HG      ARG  56  -4.963   9.199  -6.918
  441    HD2  ARG  56           1HD      ARG  56  -5.339   8.363  -9.299
  442    HD3  ARG  56           2HD      ARG  56  -4.100   9.591  -9.055
  443    HE   ARG  56           HE       ARG  56  -2.435   7.948  -9.413
  444   HH11  ARG  56          1HH1      ARG  56  -5.682   6.698  -9.882
  445   HH12  ARG  56          2HH1      ARG  56  -5.148   5.347 -10.840
  446   HH21  ARG  56          1HH2      ARG  56  -1.745   6.222 -10.677
  447   HH22  ARG  56          2HH2      ARG  56  -2.901   5.089 -11.325
  448    H    LEU  57           H        LEU  57  -3.352   5.709  -5.090
  449    HA   LEU  57           HA       LEU  57  -6.112   5.387  -4.806
  450    HB2  LEU  57           1HB      LEU  57  -3.892   3.592  -3.821
  451    HB3  LEU  57           2HB      LEU  57  -5.570   3.119  -3.986
  452    HG   LEU  57           HG       LEU  57  -3.850   4.001  -6.300
  453   HD11  LEU  57          1HD1      LEU  57  -4.527   1.219  -5.357
  454   HD12  LEU  57          2HD1      LEU  57  -2.935   1.979  -5.305
  455   HD13  LEU  57          3HD1      LEU  57  -3.693   1.625  -6.857
  456   HD21  LEU  57          3HD2      LEU  57  -5.610   2.983  -7.651
  457   HD22  LEU  57          1HD2      LEU  57  -6.264   4.264  -6.629
  458   HD23  LEU  57          2HD2      LEU  57  -6.508   2.575  -6.188
  459    H    CYS  58           H        CYS  58  -3.572   5.433  -2.334
  460    HA   CYS  58           HA       CYS  58  -5.303   4.935  -0.166
  461    HB2  CYS  58           1HB      CYS  58  -2.577   6.237  -0.187
  462    HB3  CYS  58           2HB      CYS  58  -3.404   5.615   1.237
  463    HG   CYS  58           HG       CYS  58  -2.055   3.853  -1.345
  464    H    ARG  59           H        ARG  59  -4.078   7.949  -1.590
  465    HA   ARG  59           HA       ARG  59  -5.187   9.638   0.406
  466    HB2  ARG  59           1HB      ARG  59  -3.382  10.258  -1.281
  467    HB3  ARG  59           2HB      ARG  59  -4.680  10.438  -2.457
  468    HG2  ARG  59           1HG      ARG  59  -5.736  12.097  -0.934
  469    HG3  ARG  59           2HG      ARG  59  -4.305  11.997   0.091
  470    HD2  ARG  59           1HD      ARG  59  -2.958  12.612  -1.960
  471    HD3  ARG  59           2HD      ARG  59  -4.493  12.984  -2.745
  472    HE   ARG  59           HE       ARG  59  -3.231  14.453  -0.549
  473   HH11  ARG  59          1HH1      ARG  59  -5.983  14.090  -2.699
  474   HH12  ARG  59          2HH1      ARG  59  -6.562  15.709  -2.442
  475   HH21  ARG  59          1HH2      ARG  59  -3.976  16.560  -0.210
  476   HH22  ARG  59          2HH2      ARG  59  -5.412  17.125  -1.015
  477    H    ALA  60           H        ALA  60  -6.369   8.441  -2.703
  478    HA   ALA  60           HA       ALA  60  -8.760   9.945  -2.750
  479    HB1  ALA  60           3HB      ALA  60  -8.198   7.274  -4.033
  480    HB2  ALA  60           1HB      ALA  60  -7.835   8.848  -4.738
  481    HB3  ALA  60           2HB      ALA  60  -9.509   8.376  -4.452
  482    H    SER  61           H        SER  61  -7.880   6.899  -1.261
  483    HA   SER  61           HA       SER  61 -10.492   6.117  -0.500
  484    HB2  SER  61           1HB      SER  61  -7.856   5.478   0.845
  485    HB3  SER  61           2HB      SER  61  -9.372   4.604   1.062
  486    HG   SER  61           HG       SER  61  -7.800   4.802  -1.295
  487    H    LEU  62           H        LEU  62  -8.006   8.114   1.022
  488    HA   LEU  62           HA       LEU  62  -9.362   8.580   3.461
  489    HB2  LEU  62           1HB      LEU  62  -7.362  10.299   1.984
  490    HB3  LEU  62           2HB      LEU  62  -7.883  10.576   3.635
  491    HG   LEU  62           HG       LEU  62  -6.430   8.104   2.690
  492   HD11  LEU  62          1HD1      LEU  62  -4.495   9.024   3.855
  493   HD12  LEU  62          2HD1      LEU  62  -5.398  10.497   4.207
  494   HD13  LEU  62          3HD1      LEU  62  -5.008  10.080   2.538
  495   HD21  LEU  62          3HD2      LEU  62  -7.841   7.701   4.627
  496   HD22  LEU  62          1HD2      LEU  62  -7.126   9.086   5.455
  497   HD23  LEU  62          2HD2      LEU  62  -6.138   7.674   5.084
  498    H    MET  63           H        MET  63  -9.611   9.928   0.276
  499    HA   MET  63           HA       MET  63 -11.301  12.135   1.051
  500    HB2  MET  63           1HB      MET  63 -10.668  10.974  -1.671
  501    HB3  MET  63           2HB      MET  63 -11.561  12.462  -1.394
  502    HG2  MET  63           1HG      MET  63  -9.635  13.519  -0.451
  503    HG3  MET  63           2HG      MET  63  -8.729  12.008  -0.490
  504    HE1  MET  63           3HE      MET  63 -10.004  14.347  -4.263
  505    HE2  MET  63           1HE      MET  63 -10.323  14.897  -2.617
  506    HE3  MET  63           2HE      MET  63 -11.143  13.465  -3.245
  507    H    GLY  64           H        GLY  64 -11.805   8.923   1.009
  508    HA2  GLY  64           1HA      GLY  64 -13.740   7.704   1.248
  509    HA3  GLY  64           2HA      GLY  64 -14.650   9.196   1.070
  510    H    ASP  65           H        ASP  65 -12.427   8.579  -1.439
  511    HA   ASP  65           HA       ASP  65 -14.646   8.299  -3.291
  512    HB2  ASP  65           1HB      ASP  65 -12.658   9.857  -3.626
  513    HB3  ASP  65           2HB      ASP  65 -11.702   8.417  -3.961
  514    H    VAL  66           H        VAL  66 -11.745   6.508  -2.357
  515    HA   VAL  66           HA       VAL  66 -12.700   4.175  -3.851
  516    HB   VAL  66           HB       VAL  66 -10.037   4.610  -2.487
  517   HG11  VAL  66          1HG1      VAL  66 -10.955   2.436  -4.360
  518   HG12  VAL  66          2HG1      VAL  66 -10.635   2.258  -2.634
  519   HG13  VAL  66          3HG1      VAL  66  -9.316   2.639  -3.743
  520   HG21  VAL  66          3HG2      VAL  66 -10.306   6.124  -4.371
  521   HG22  VAL  66          1HG2      VAL  66 -10.775   4.775  -5.407
  522   HG23  VAL  66          2HG2      VAL  66  -9.137   4.861  -4.761
  523    H    ALA  67           H        ALA  67 -13.887   2.749  -2.777
  524    HA   ALA  67           HA       ALA  67 -13.942   2.847   0.122
  525    HB1  ALA  67           3HB      ALA  67 -16.031   2.866  -1.174
  526    HB2  ALA  67           1HB      ALA  67 -15.945   1.516  -0.042
  527    HB3  ALA  67           2HB      ALA  67 -15.657   1.242  -1.759
  528    H    GLY  68           H        GLY  68 -11.906   1.864   0.568
  529    HA2  GLY  68           1HA      GLY  68 -10.910   0.112   1.651
  530    HA3  GLY  68           2HA      GLY  68 -12.434  -0.736   1.507
  531    H    GLU  69           H        GLU  69 -12.778  -2.111  -0.318
  532    HA   GLU  69           HA       GLU  69 -10.447  -3.687  -0.639
  533    HB2  GLU  69           1HB      GLU  69 -13.244  -3.962  -1.691
  534    HB3  GLU  69           2HB      GLU  69 -11.976  -5.119  -2.089
  535    HG2  GLU  69           1HG      GLU  69 -11.634  -5.391   0.403
  536    HG3  GLU  69           2HG      GLU  69 -13.135  -4.490   0.608
  537    H    ILE  70           H        ILE  70 -12.074  -1.443  -2.795
  538    HA   ILE  70           HA       ILE  70 -10.843  -2.184  -5.194
  539    HB   ILE  70           HB       ILE  70 -11.459   0.632  -4.271
  540   HG12  ILE  70          1HG1      ILE  70 -13.142  -1.341  -5.833
  541   HG13  ILE  70          2HG1      ILE  70 -13.422  -0.841  -4.168
  542   HG21  ILE  70          1HG2      ILE  70 -11.079  -0.478  -7.051
  543   HG22  ILE  70          2HG2      ILE  70  -9.961   0.582  -6.194
  544   HG23  ILE  70          3HG2      ILE  70 -11.558   1.173  -6.655
  545   HD11  ILE  70          3HD1      ILE  70 -13.560   0.930  -6.596
  546   HD12  ILE  70          1HD1      ILE  70 -13.823   1.446  -4.930
  547   HD13  ILE  70          2HD1      ILE  70 -14.928   0.295  -5.681
  548    H    ALA  71           H        ALA  71  -9.739   0.077  -2.684
  549    HA   ALA  71           HA       ALA  71  -7.197   0.562  -3.849
  550    HB1  ALA  71           3HB      ALA  71  -8.219   2.100  -2.233
  551    HB2  ALA  71           1HB      ALA  71  -6.616   1.577  -1.711
  552    HB3  ALA  71           2HB      ALA  71  -8.057   0.876  -0.973
  553    H    ARG  72           H        ARG  72  -8.435  -1.752  -1.517
  554    HA   ARG  72           HA       ARG  72  -6.044  -2.789  -0.537
  555    HB2  ARG  72           1HB      ARG  72  -8.372  -3.309   0.291
  556    HB3  ARG  72           2HB      ARG  72  -8.547  -4.394  -1.082
  557    HG2  ARG  72           1HG      ARG  72  -6.563  -5.649  -0.260
  558    HG3  ARG  72           2HG      ARG  72  -6.581  -4.627   1.176
  559    HD2  ARG  72           1HD      ARG  72  -9.033  -5.385   1.415
  560    HD3  ARG  72           2HD      ARG  72  -8.588  -6.669   0.290
  561    HE   ARG  72           HE       ARG  72  -7.379  -6.247   2.949
  562   HH11  ARG  72          1HH1      ARG  72  -8.200  -8.358   0.261
  563   HH12  ARG  72          2HH1      ARG  72  -7.661  -9.793   1.081
  564   HH21  ARG  72          1HH2      ARG  72  -6.673  -8.143   4.006
  565   HH22  ARG  72          2HH2      ARG  72  -6.804  -9.674   3.189
  566    H    THR  73           H        THR  73  -8.010  -3.966  -3.256
  567    HA   THR  73           HA       THR  73  -6.288  -6.071  -3.965
  568    HB   THR  73           HB       THR  73  -8.162  -4.619  -5.834
  569    HG1  THR  73           HG1      THR  73  -9.508  -5.147  -4.212
  570   HG21  THR  73          3HG2      THR  73  -7.236  -7.492  -5.714
  571   HG22  THR  73          1HG2      THR  73  -6.709  -6.285  -6.888
  572   HG23  THR  73          2HG2      THR  73  -8.387  -6.829  -6.871
  573    H    ALA  74           H        ALA  74  -6.499  -2.713  -5.090
  574    HA   ALA  74           HA       ALA  74  -4.544  -2.998  -7.131
  575    HB1  ALA  74           3HB      ALA  74  -5.438  -0.507  -5.691
  576    HB2  ALA  74           1HB      ALA  74  -6.187  -1.190  -7.133
  577    HB3  ALA  74           2HB      ALA  74  -4.539  -0.565  -7.206
  578    H    PHE  75           H        PHE  75  -4.406  -2.198  -3.723
  579    HA   PHE  75           HA       PHE  75  -1.708  -1.362  -3.636
  580    HB2  PHE  75           1HB      PHE  75  -3.411  -0.954  -1.845
  581    HB3  PHE  75           2HB      PHE  75  -3.321  -2.659  -1.428
  582    HD1  PHE  75           HD2      PHE  75  -1.288   0.431  -1.668
  583    HD2  PHE  75           HD1      PHE  75  -1.718  -3.425   0.077
  584    HE1  PHE  75           HE2      PHE  75   0.583   0.914  -0.146
  585    HE2  PHE  75           HE1      PHE  75   0.149  -2.949   1.603
  586    HZ   PHE  75           HZ       PHE  75   1.301  -0.777   1.493
  587    H    VAL  76           H        VAL  76  -3.274  -4.507  -3.335
  588    HA   VAL  76           HA       VAL  76  -0.997  -6.009  -2.631
  589    HB   VAL  76           HB       VAL  76  -3.431  -6.886  -4.205
  590   HG11  VAL  76          1HG1      VAL  76  -1.562  -8.437  -4.502
  591   HG12  VAL  76          2HG1      VAL  76  -2.837  -9.160  -3.519
  592   HG13  VAL  76          3HG1      VAL  76  -1.369  -8.548  -2.754
  593   HG21  VAL  76          3HG2      VAL  76  -4.019  -6.013  -2.020
  594   HG22  VAL  76          1HG2      VAL  76  -2.806  -7.045  -1.259
  595   HG23  VAL  76          2HG2      VAL  76  -4.211  -7.767  -2.043
  596    H    ALA  77           H        ALA  77  -2.352  -5.088  -5.770
  597    HA   ALA  77           HA       ALA  77  -0.545  -6.513  -7.393
  598    HB1  ALA  77           3HB      ALA  77  -2.639  -5.535  -8.228
  599    HB2  ALA  77           1HB      ALA  77  -1.245  -5.034  -9.186
  600    HB3  ALA  77           2HB      ALA  77  -1.957  -3.921  -8.017
  601    H    ALA  78           H        ALA  78  -0.388  -3.315  -5.923
  602    HA   ALA  78           HA       ALA  78   2.069  -2.548  -7.141
  603    HB1  ALA  78           3HB      ALA  78   0.813  -1.544  -4.587
  604    HB2  ALA  78           1HB      ALA  78   0.500  -0.909  -6.202
  605    HB3  ALA  78           2HB      ALA  78   2.106  -0.758  -5.491
  606    H    SER  79           H        SER  79   1.191  -4.161  -4.138
  607    HA   SER  79           HA       SER  79   3.770  -4.218  -2.990
  608    HB2  SER  79           1HB      SER  79   1.477  -6.156  -2.578
  609    HB3  SER  79           2HB      SER  79   2.865  -5.950  -1.510
  610    HG   SER  79           HG       SER  79   0.915  -3.967  -2.121
  611    H    ARG  80           H        ARG  80   2.323  -6.029  -5.540
  612    HA   ARG  80           HA       ARG  80   3.950  -8.345  -5.389
  613    HB2  ARG  80           1HB      ARG  80   1.817  -8.120  -6.724
  614    HB3  ARG  80           2HB      ARG  80   2.731  -7.182  -7.898
  615    HG2  ARG  80           1HG      ARG  80   4.229  -9.109  -8.229
  616    HG3  ARG  80           2HG      ARG  80   3.237 -10.044  -7.111
  617    HD2  ARG  80           1HD      ARG  80   1.286  -9.605  -8.617
  618    HD3  ARG  80           2HD      ARG  80   2.415  -8.894  -9.771
  619    HE   ARG  80           HE       ARG  80   2.954 -11.620  -8.869
  620   HH11  ARG  80          1HH1      ARG  80   1.766  -9.497 -11.400
  621   HH12  ARG  80          2HH1      ARG  80   1.842 -10.712 -12.640
  622   HH21  ARG  80          1HH2      ARG  80   3.008 -13.237 -10.482
  623   HH22  ARG  80          2HH2      ARG  80   2.519 -12.850 -12.105
  624    H    GLN  81           H        GLN  81   4.518  -5.126  -6.476
  625    HA   GLN  81           HA       GLN  81   6.688  -5.713  -8.239
  626    HB2  GLN  81           1HB      GLN  81   5.242  -3.541  -8.025
  627    HB3  GLN  81           2HB      GLN  81   6.420  -3.096  -6.797
  628    HG2  GLN  81           1HG      GLN  81   8.216  -3.276  -8.417
  629    HG3  GLN  81           2HG      GLN  81   7.069  -3.797  -9.654
  630   HE21  GLN  81          2HE2      GLN  81   7.399  -2.112 -11.037
  631   HE22  GLN  81          1HE2      GLN  81   6.940  -0.484 -10.680
  632    H    ALA  82           H        ALA  82   6.308  -5.312  -4.822
  633    HA   ALA  82           HA       ALA  82   9.116  -5.114  -4.230
  634    HB1  ALA  82           3HB      ALA  82   8.449  -5.397  -1.907
  635    HB2  ALA  82           1HB      ALA  82   6.822  -5.854  -2.411
  636    HB3  ALA  82           2HB      ALA  82   7.406  -4.216  -2.702
  637    H    HIS  83           H        HIS  83   7.116  -7.541  -5.289
  638    HA   HIS  83           HA       HIS  83   7.393  -9.746  -5.694
  639    HB2  HIS  83           1HB      HIS  83  10.206  -9.336  -4.657
  640    HB3  HIS  83           2HB      HIS  83   9.635 -10.736  -5.559
  641    HD1  HIS  83           HD1      HIS  83   8.286  -9.669  -7.935
  642    HD2  HIS  83           HD2      HIS  83  11.649  -7.802  -6.345
  643    HE1  HIS  83           HE1      HIS  83   9.234  -8.270  -9.798
  644    HE2  HIS  83           HE2      HIS  83  11.365  -7.313  -8.873
  645    H    CYS  84           H        CYS  84   6.660  -8.624  -3.007
  646    HA   CYS  84           HA       CYS  84   6.845 -11.148  -1.550
  647    HB2  CYS  84           1HB      CYS  84   7.221  -8.437  -0.255
  648    HB3  CYS  84           2HB      CYS  84   7.269  -9.998   0.551
  649    HG   CYS  84           HG       CYS  84   9.551  -8.911  -1.760
  650    H    LEU  85           H        LEU  85   4.739 -11.512  -2.281
  651    HA   LEU  85           HA       LEU  85   2.620  -9.663  -1.680
  652    HB2  LEU  85           1HB      LEU  85   2.665 -12.499  -2.691
  653    HB3  LEU  85           2HB      LEU  85   1.164 -11.686  -2.297
  654    HG   LEU  85           HG       LEU  85   1.475 -11.558  -4.655
  655   HD11  LEU  85          1HD1      LEU  85   2.180  -8.907  -3.416
  656   HD12  LEU  85          2HD1      LEU  85   0.557  -9.571  -3.603
  657   HD13  LEU  85          3HD1      LEU  85   1.508  -9.152  -5.028
  658   HD21  LEU  85          3HD2      LEU  85   3.873 -11.963  -4.759
  659   HD22  LEU  85          1HD2      LEU  85   4.183 -10.353  -4.106
  660   HD23  LEU  85          2HD2      LEU  85   3.433 -10.532  -5.693
  661    H    MET  86           H        MET  86   0.727 -10.326  -0.378
  662    HA   MET  86           HA       MET  86   1.168 -10.879   2.257
  663    HB2  MET  86           1HB      MET  86  -1.254 -11.606   0.598
  664    HB3  MET  86           2HB      MET  86  -1.215 -11.636   2.356
  665    HG2  MET  86           1HG      MET  86  -0.757  -9.254   2.401
  666    HG3  MET  86           2HG      MET  86  -0.768  -9.210   0.637
  667    HE1  MET  86           3HE      MET  86  -3.217 -11.291   0.063
  668    HE2  MET  86           1HE      MET  86  -2.915  -9.799  -0.825
  669    HE3  MET  86           2HE      MET  86  -4.513 -10.114  -0.151
  670    H    GLU  87           H        GLU  87   1.501 -12.624   3.495
  671    HA   GLU  87           HA       GLU  87   2.414 -15.017   2.292
  672    HB2  GLU  87           1HB      GLU  87   3.273 -14.097   4.428
  673    HB3  GLU  87           2HB      GLU  87   1.735 -14.480   5.186
  674    HG2  GLU  87           1HG      GLU  87   2.115 -16.855   4.744
  675    HG3  GLU  87           2HG      GLU  87   3.666 -16.461   4.003
  676    H    ASP  88           H        ASP  88  -0.408 -14.248   4.270
  677    HA   ASP  88           HA       ASP  88  -2.408 -15.263   4.612
  678    HB2  ASP  88           1HB      ASP  88  -1.906 -15.949   1.719
  679    HB3  ASP  88           2HB      ASP  88  -3.403 -16.382   2.538
  680    H    LYS  89           H        LYS  89  -0.100 -16.710   5.415
  681    HA   LYS  89           HA       LYS  89   0.493 -18.688   6.322
  682    HB2  LYS  89           1HB      LYS  89  -2.306 -19.541   5.574
  683    HB3  LYS  89           2HB      LYS  89  -1.198 -20.489   6.557
  684    HG2  LYS  89           1HG      LYS  89  -1.162 -18.706   8.232
  685    HG3  LYS  89           2HG      LYS  89  -2.275 -17.762   7.245
  686    HD2  LYS  89           1HD      LYS  89  -2.917 -20.519   8.270
  687    HD3  LYS  89           2HD      LYS  89  -3.305 -19.048   9.160
  688    HE2  LYS  89           1HE      LYS  89  -5.266 -19.644   7.985
  689    HE3  LYS  89           2HE      LYS  89  -4.565 -18.281   7.120
  690    HZ1  LYS  89           3HZ      LYS  89  -5.325 -19.986   5.599
  691    HZ2  LYS  89           1HZ      LYS  89  -4.323 -21.138   6.340
  692    HZ3  LYS  89           2HZ      LYS  89  -3.643 -19.831   5.505
  693    H    ALA  90           H        ALA  90   2.100 -19.358   5.089
  694    HA   ALA  90           HA       ALA  90   1.503 -21.360   3.053
  695    HB1  ALA  90           3HB      ALA  90   3.361 -19.030   2.552
  696    HB2  ALA  90           1HB      ALA  90   1.778 -19.264   1.808
  697    HB3  ALA  90           2HB      ALA  90   3.089 -20.393   1.466
  698    H    GLU  91           H        GLU  91   3.090 -22.932   2.859
  699    HA   GLU  91           HA       GLU  91   4.898 -23.092   5.127
  700    HB2  GLU  91           1HB      GLU  91   4.333 -25.080   2.922
  701    HB3  GLU  91           2HB      GLU  91   5.267 -25.398   4.376
  702    HG2  GLU  91           1HG      GLU  91   3.313 -25.076   5.752
  703    HG3  GLU  91           2HG      GLU  91   2.361 -24.621   4.340
  704    H    ALA  92           H        ALA  92   7.053 -22.887   5.063
  705    HA   ALA  92           HA       ALA  92   8.392 -22.854   2.455
  706    HB1  ALA  92           3HB      ALA  92   9.645 -20.857   3.032
  707    HB2  ALA  92           1HB      ALA  92   8.795 -20.748   4.573
  708    HB3  ALA  92           2HB      ALA  92   7.913 -20.524   3.061
  709    HA   PRO  93           HA       PRO  93  10.976 -25.498   5.068
  710    HB2  PRO  93           1HB      PRO  93  12.296 -26.668   3.019
  711    HB3  PRO  93           2HB      PRO  93  10.666 -27.157   3.494
  712    HG2  PRO  93           1HG      PRO  93  11.534 -25.369   1.258
  713    HG3  PRO  93           2HG      PRO  93  10.297 -26.640   1.259
  714    HD2  PRO  93           1HD      PRO  93   9.707 -23.994   1.471
  715    HD3  PRO  93           2HD      PRO  93   8.713 -25.269   2.204
  716    H    ASN  94           H        ASN  94  11.582 -22.772   3.364
  717    HA   ASN  94           HA       ASN  94  14.480 -22.843   3.531
  718    HB2  ASN  94           1HB      ASN  94  13.445 -21.702   1.630
  719    HB3  ASN  94           2HB      ASN  94  12.571 -20.635   2.722
  720   HD21  ASN  94          2HD2      ASN  94  13.630 -18.932   3.686
  721   HD22  ASN  94          1HD2      ASN  94  15.229 -18.442   3.226
  722    H    THR  95           H        THR  95  11.739 -21.719   5.320
  723    HA   THR  95           HA       THR  95  13.171 -19.857   6.960
  724    HB   THR  95           HB       THR  95  10.525 -21.118   7.647
  725    HG1  THR  95           HG1      THR  95  11.185 -19.292   5.599
  726   HG21  THR  95          3HG2      THR  95  11.675 -18.360   8.110
  727   HG22  THR  95          1HG2      THR  95  11.531 -19.637   9.319
  728   HG23  THR  95          2HG2      THR  95  10.081 -18.911   8.626
  729    H    ILE  96           H        ILE  96  12.068 -23.190   7.255
  730    HA   ILE  96           HA       ILE  96  13.504 -23.408   9.818
  731    HB   ILE  96           HB       ILE  96  11.264 -25.175   8.804
  732   HG12  ILE  96          1HG1      ILE  96  11.206 -23.057  10.966
  733   HG13  ILE  96          2HG1      ILE  96  10.519 -22.867   9.357
  734   HG21  ILE  96          1HG2      ILE  96  12.807 -26.341  10.284
  735   HG22  ILE  96          2HG2      ILE  96  11.259 -26.077  11.087
  736   HG23  ILE  96          3HG2      ILE  96  12.643 -25.061  11.485
  737   HD11  ILE  96          3HD1      ILE  96   8.961 -24.690   9.812
  738   HD12  ILE  96          1HD1      ILE  96   8.803 -23.385  10.987
  739   HD13  ILE  96          2HD1      ILE  96   9.647 -24.870  11.426
  740    H    ALA  97           H        ALA  97  15.356 -24.459   9.682
  741    HA   ALA  97           HA       ALA  97  16.302 -25.788   7.413
  742    HB1  ALA  97           3HB      ALA  97  18.149 -26.530   8.814
  743    HB2  ALA  97           1HB      ALA  97  17.244 -26.086  10.263
  744    HB3  ALA  97           2HB      ALA  97  17.766 -24.837   9.131
  745    H    SER  98           H        SER  98  16.168 -27.826   6.702
  746    HA   SER  98           HA       SER  98  14.894 -29.819   8.457
  747    HB2  SER  98           1HB      SER  98  14.320 -29.424   5.508
  748    HB3  SER  98           2HB      SER  98  13.575 -30.622   6.565
  749    HG   SER  98           HG       SER  98  13.415 -27.832   7.054
  750    H    GLY  99           H        GLY  99  16.627 -31.089   8.890
  751    HA2  GLY  99           1HA      GLY  99  18.494 -31.812   6.787
  752    HA3  GLY  99           2HA      GLY  99  18.586 -32.288   8.478
  753    H    SER 100           H        SER 100  17.501 -33.125   5.334
  754    HA   SER 100           HA       SER 100  16.436 -35.659   6.383
  755    HB2  SER 100           1HB      SER 100  15.669 -34.286   3.794
  756    HB3  SER 100           2HB      SER 100  14.960 -35.762   4.449
  757    HG   SER 100           HG       SER 100  14.312 -34.461   6.291
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1  -0.931  23.932   7.815
    2    H2   MET   1           2H       MET   1   0.005  24.566   9.075
    3    H3   MET   1           3H       MET   1  -1.472  23.804   9.419
    4    HA   MET   1           HA       MET   1  -0.576  21.714   8.546
    5    HB2  MET   1           1HB      MET   1   1.986  23.319   8.474
    6    HB3  MET   1           2HB      MET   1   1.905  21.570   8.318
    7    HG2  MET   1           1HG      MET   1   0.588  21.802   6.282
    8    HG3  MET   1           2HG      MET   1   0.638  23.557   6.445
    9    HE1  MET   1           3HE      MET   1   1.565  23.766   3.950
   10    HE2  MET   1           1HE      MET   1   1.488  22.010   3.799
   11    HE3  MET   1           2HE      MET   1   2.963  22.869   3.357
   12    H    GLU   2           H        GLU   2  -0.096  24.039  10.961
   13    HA   GLU   2           HA       GLU   2   1.296  22.231  12.772
   14    HB2  GLU   2           1HB      GLU   2   0.330  25.077  13.114
   15    HB3  GLU   2           2HB      GLU   2   1.121  24.155  14.384
   16    HG2  GLU   2           1HG      GLU   2   2.710  25.624  13.346
   17    HG3  GLU   2           2HG      GLU   2   3.119  23.954  12.964
   18    H    VAL   3           H        VAL   3  -1.780  23.997  12.633
   19    HA   VAL   3           HA       VAL   3  -2.825  22.512  14.889
   20    HB   VAL   3           HB       VAL   3  -4.236  24.491  13.087
   21   HG11  VAL   3          1HG1      VAL   3  -5.006  23.394  15.791
   22   HG12  VAL   3          2HG1      VAL   3  -5.783  23.013  14.254
   23   HG13  VAL   3          3HG1      VAL   3  -5.871  24.651  14.905
   24   HG21  VAL   3          3HG2      VAL   3  -2.356  25.532  14.223
   25   HG22  VAL   3          1HG2      VAL   3  -2.919  24.903  15.770
   26   HG23  VAL   3          2HG2      VAL   3  -3.879  26.103  14.905
   27    H    GLN   4           H        GLN   4  -3.891  20.662  14.744
   28    HA   GLN   4           HA       GLN   4  -4.592  19.663  12.092
   29    HB2  GLN   4           1HB      GLN   4  -4.647  18.248  14.764
   30    HB3  GLN   4           2HB      GLN   4  -4.880  17.497  13.191
   31    HG2  GLN   4           1HG      GLN   4  -2.580  18.190  12.577
   32    HG3  GLN   4           2HG      GLN   4  -2.368  18.793  14.219
   33   HE21  GLN   4          2HE2      GLN   4  -0.906  16.714  12.828
   34   HE22  GLN   4          1HE2      GLN   4  -1.092  15.269  13.770
   35    H    SER   5           H        SER   5  -6.671  18.746  11.653
   36    HA   SER   5           HA       SER   5  -8.808  20.288  12.814
   37    HB2  SER   5           1HB      SER   5  -8.902  18.132  10.689
   38    HB3  SER   5           2HB      SER   5 -10.196  19.263  11.081
   39    HG   SER   5           HG       SER   5  -8.461  20.922  10.589
   40    H    MET   6           H        MET   6 -10.638  19.455  13.851
   41    HA   MET   6           HA       MET   6 -10.169  17.326  15.664
   42    HB2  MET   6           1HB      MET   6 -11.638  19.192  16.220
   43    HB3  MET   6           2HB      MET   6 -12.731  18.750  14.917
   44    HG2  MET   6           1HG      MET   6 -13.232  16.646  16.055
   45    HG3  MET   6           2HG      MET   6 -12.144  17.100  17.365
   46    HE1  MET   6           3HE      MET   6 -16.016  19.413  16.363
   47    HE2  MET   6           1HE      MET   6 -15.468  18.000  15.462
   48    HE3  MET   6           2HE      MET   6 -14.554  19.505  15.381
   49    H    LEU   7           H        LEU   7 -11.851  17.582  12.604
   50    HA   LEU   7           HA       LEU   7 -12.926  14.913  12.733
   51    HB2  LEU   7           1HB      LEU   7 -12.743  16.872  10.442
   52    HB3  LEU   7           2HB      LEU   7 -13.603  15.345  10.389
   53    HG   LEU   7           HG       LEU   7 -14.277  17.661  12.206
   54   HD11  LEU   7          1HD1      LEU   7 -14.755  18.139   9.860
   55   HD12  LEU   7          2HD1      LEU   7 -16.242  17.928  10.787
   56   HD13  LEU   7          3HD1      LEU   7 -15.666  16.634   9.735
   57   HD21  LEU   7          3HD2      LEU   7 -15.700  15.045  11.722
   58   HD22  LEU   7          1HD2      LEU   7 -16.292  16.376  12.717
   59   HD23  LEU   7          2HD2      LEU   7 -14.836  15.501  13.190
   60    H    LEU   8           H        LEU   8 -11.589  13.243  12.586
   61    HA   LEU   8           HA       LEU   8  -9.190  13.451  10.927
   62    HB2  LEU   8           1HB      LEU   8 -10.058  11.279  12.839
   63    HB3  LEU   8           2HB      LEU   8  -8.518  11.349  12.005
   64    HG   LEU   8           HG       LEU   8  -9.478  13.328  14.076
   65   HD11  LEU   8          1HD1      LEU   8  -8.958  11.163  15.050
   66   HD12  LEU   8          2HD1      LEU   8  -7.730  12.351  15.483
   67   HD13  LEU   8          3HD1      LEU   8  -7.396  11.154  14.232
   68   HD21  LEU   8          3HD2      LEU   8  -8.022  14.362  12.410
   69   HD22  LEU   8          1HD2      LEU   8  -6.823  13.094  12.663
   70   HD23  LEU   8          2HD2      LEU   8  -7.204  14.219  13.966
   71    H    ASN   9           H        ASN   9  -8.908  12.330   9.078
   72    HA   ASN   9           HA       ASN   9 -11.190  10.818   8.076
   73    HB2  ASN   9           1HB      ASN   9  -9.965  10.877   5.890
   74    HB3  ASN   9           2HB      ASN   9 -10.376  12.465   6.534
   75   HD21  ASN   9          2HD2      ASN   9  -7.836  10.261   5.754
   76   HD22  ASN   9          1HD2      ASN   9  -6.523  11.364   5.979
   77    H    ASP  10           H        ASP  10  -9.842   9.512  10.106
   78    HA   ASP  10           HA       ASP  10  -8.084   7.533   9.082
   79    HB2  ASP  10           1HB      ASP  10  -9.884   7.569  11.506
   80    HB3  ASP  10           2HB      ASP  10  -8.889   6.179  11.093
   81    H    VAL  11           H        VAL  11  -8.887   6.753   7.189
   82    HA   VAL  11           HA       VAL  11 -11.574   5.657   7.118
   83    HB   VAL  11           HB       VAL  11  -9.515   5.685   4.900
   84   HG11  VAL  11          1HG1      VAL  11 -11.467   5.457   3.438
   85   HG12  VAL  11          2HG1      VAL  11 -12.510   5.363   4.856
   86   HG13  VAL  11          3HG1      VAL  11 -11.318   4.097   4.552
   87   HG21  VAL  11          3HG2      VAL  11 -10.671   7.677   4.051
   88   HG22  VAL  11          1HG2      VAL  11  -9.940   7.966   5.629
   89   HG23  VAL  11          2HG2      VAL  11 -11.679   7.701   5.498
   90    H    LYS  12           H        LYS  12 -11.754   3.744   8.053
   91    HA   LYS  12           HA       LYS  12  -9.633   1.940   8.447
   92    HB2  LYS  12           1HB      LYS  12 -11.578   1.950   9.921
   93    HB3  LYS  12           2HB      LYS  12 -12.624   1.488   8.585
   94    HG2  LYS  12           1HG      LYS  12 -11.201  -0.607   8.395
   95    HG3  LYS  12           2HG      LYS  12 -10.524  -0.153   9.958
   96    HD2  LYS  12           1HD      LYS  12 -12.674  -0.291  11.000
   97    HD3  LYS  12           2HD      LYS  12 -13.468  -0.526   9.438
   98    HE2  LYS  12           1HE      LYS  12 -12.208  -2.628   9.155
   99    HE3  LYS  12           2HE      LYS  12 -11.504  -2.399  10.754
  100    HZ1  LYS  12           3HZ      LYS  12 -14.393  -2.747  10.161
  101    HZ2  LYS  12           1HZ      LYS  12 -13.727  -2.503  11.703
  102    HZ3  LYS  12           2HZ      LYS  12 -13.365  -3.915  10.837
  103    H    TRP  13           H        TRP  13  -9.057   0.071   7.425
  104    HA   TRP  13           HA       TRP  13 -10.088  -0.349   4.741
  105    HB2  TRP  13           1HB      TRP  13  -7.601  -0.785   5.954
  106    HB3  TRP  13           2HB      TRP  13  -8.265  -2.399   5.700
  107    HD1  TRP  13           HD1      TRP  13  -9.592  -2.283   2.972
  108    HE1  TRP  13           HE1      TRP  13  -8.290  -1.764   0.819
  109    HE3  TRP  13           HE3      TRP  13  -5.539   0.063   5.026
  110    HZ2  TRP  13           HZ2      TRP  13  -5.851  -0.537   0.086
  111    HZ3  TRP  13           HZ3      TRP  13  -3.765   0.877   3.529
  112    HH2  TRP  13           HH2      TRP  13  -3.919   0.582   1.109
  113    H    GLU  14           H        GLU  14 -11.791  -1.601   4.418
  114    HA   GLU  14           HA       GLU  14 -13.128  -2.873   6.520
  115    HB2  GLU  14           1HB      GLU  14 -13.479  -3.220   3.541
  116    HB3  GLU  14           2HB      GLU  14 -14.612  -3.794   4.762
  117    HG2  GLU  14           1HG      GLU  14 -14.840  -1.441   5.551
  118    HG3  GLU  14           2HG      GLU  14 -13.858  -0.941   4.176
  119    H    LYS  15           H        LYS  15 -10.935  -4.165   4.084
  120    HA   LYS  15           HA       LYS  15 -10.660  -6.486   5.861
  121    HB2  LYS  15           1HB      LYS  15 -11.621  -6.958   3.493
  122    HB3  LYS  15           2HB      LYS  15  -9.978  -6.658   2.934
  123    HG2  LYS  15           1HG      LYS  15  -9.159  -8.422   4.424
  124    HG3  LYS  15           2HG      LYS  15 -10.811  -8.733   4.951
  125    HD2  LYS  15           1HD      LYS  15 -11.352  -9.186   2.515
  126    HD3  LYS  15           2HD      LYS  15  -9.609  -9.181   2.230
  127    HE2  LYS  15           1HE      LYS  15 -11.135 -11.009   4.086
  128    HE3  LYS  15           2HE      LYS  15 -10.373 -11.454   2.560
  129    HZ1  LYS  15           3HZ      LYS  15  -8.787 -10.317   4.782
  130    HZ2  LYS  15           1HZ      LYS  15  -8.252 -11.250   3.470
  131    HZ3  LYS  15           2HZ      LYS  15  -9.139 -11.971   4.721
  132    HA   PRO  16           HA       PRO  16  -6.946  -4.052   6.571
  133    HB2  PRO  16           1HB      PRO  16  -6.325  -6.613   7.980
  134    HB3  PRO  16           2HB      PRO  16  -6.121  -4.947   8.534
  135    HG2  PRO  16           1HG      PRO  16  -8.162  -6.397   9.404
  136    HG3  PRO  16           2HG      PRO  16  -8.382  -4.685   8.999
  137    HD2  PRO  16           1HD      PRO  16  -9.220  -7.114   7.491
  138    HD3  PRO  16           2HD      PRO  16 -10.010  -5.529   7.612
  139    H    VAL  17           H        VAL  17  -4.990  -3.940   5.643
  140    HA   VAL  17           HA       VAL  17  -4.255  -6.135   3.843
  141    HB   VAL  17           HB       VAL  17  -3.381  -3.239   3.829
  142   HG11  VAL  17          1HG1      VAL  17  -2.763  -5.443   1.860
  143   HG12  VAL  17          2HG1      VAL  17  -1.616  -4.703   2.978
  144   HG13  VAL  17          3HG1      VAL  17  -2.327  -3.743   1.679
  145   HG21  VAL  17          3HG2      VAL  17  -5.227  -4.765   1.995
  146   HG22  VAL  17          1HG2      VAL  17  -4.701  -3.098   1.763
  147   HG23  VAL  17          2HG2      VAL  17  -5.698  -3.522   3.154
  148    H    THR  18           H        THR  18  -2.565  -7.347   4.261
  149    HA   THR  18           HA       THR  18  -0.640  -6.507   6.319
  150    HB   THR  18           HB       THR  18  -1.012  -9.273   5.160
  151    HG1  THR  18           HG1      THR  18  -2.756  -7.956   6.594
  152   HG21  THR  18          3HG2      THR  18   0.071  -9.975   7.246
  153   HG22  THR  18          1HG2      THR  18   0.230  -8.288   7.730
  154   HG23  THR  18          2HG2      THR  18   1.104  -8.885   6.320
  155    H    ILE  19           H        ILE  19   1.231  -5.727   5.589
  156    HA   ILE  19           HA       ILE  19   2.079  -6.495   2.876
  157    HB   ILE  19           HB       ILE  19   1.587  -4.036   3.437
  158   HG12  ILE  19          1HG1      ILE  19   4.336  -4.658   2.352
  159   HG13  ILE  19          2HG1      ILE  19   2.845  -4.870   1.439
  160   HG21  ILE  19          1HG2      ILE  19   4.243  -4.319   4.834
  161   HG22  ILE  19          2HG2      ILE  19   2.700  -3.901   5.579
  162   HG23  ILE  19          3HG2      ILE  19   3.459  -2.788   4.441
  163   HD11  ILE  19          3HD1      ILE  19   3.926  -2.279   2.516
  164   HD12  ILE  19          1HD1      ILE  19   2.398  -2.471   1.656
  165   HD13  ILE  19          2HD1      ILE  19   3.921  -2.803   0.830
  166    H    SER  20           H        SER  20   4.297  -6.975   2.501
  167    HA   SER  20           HA       SER  20   5.610  -8.052   4.896
  168    HB2  SER  20           1HB      SER  20   5.018  -9.666   3.085
  169    HB3  SER  20           2HB      SER  20   6.091  -8.788   1.997
  170    HG   SER  20           HG       SER  20   7.629  -9.976   2.771
  171    H    LEU  21           H        LEU  21   6.988  -6.585   5.672
  172    HA   LEU  21           HA       LEU  21   8.355  -4.680   4.042
  173    HB2  LEU  21           1HB      LEU  21   8.688  -5.501   6.925
  174    HB3  LEU  21           2HB      LEU  21   9.689  -4.278   6.173
  175    HG   LEU  21           HG       LEU  21   7.550  -3.006   5.674
  176   HD11  LEU  21          1HD1      LEU  21   5.613  -3.512   7.061
  177   HD12  LEU  21          2HD1      LEU  21   6.415  -4.959   7.670
  178   HD13  LEU  21          3HD1      LEU  21   5.975  -4.846   5.965
  179   HD21  LEU  21          3HD2      LEU  21   9.098  -2.365   7.438
  180   HD22  LEU  21          1HD2      LEU  21   8.312  -3.484   8.550
  181   HD23  LEU  21          2HD2      LEU  21   7.428  -2.087   7.935
  182    H    GLN  22           H        GLN  22  10.775  -4.457   4.122
  183    HA   GLN  22           HA       GLN  22  12.055  -6.738   3.062
  184    HB2  GLN  22           1HB      GLN  22  12.725  -4.413   2.556
  185    HB3  GLN  22           2HB      GLN  22  13.280  -4.220   4.212
  186    HG2  GLN  22           1HG      GLN  22  14.985  -5.905   3.866
  187    HG3  GLN  22           2HG      GLN  22  14.406  -6.179   2.224
  188   HE21  GLN  22          2HE2      GLN  22  17.018  -5.296   3.221
  189   HE22  GLN  22          1HE2      GLN  22  17.342  -3.794   2.425
  190    H    ASN  23           H        ASN  23  11.483  -5.664   6.237
  191    HA   ASN  23           HA       ASN  23  13.528  -6.930   7.684
  192    HB2  ASN  23           1HB      ASN  23  10.642  -6.449   8.475
  193    HB3  ASN  23           2HB      ASN  23  11.939  -6.866   9.586
  194   HD21  ASN  23          2HD2      ASN  23  11.528  -4.991  10.761
  195   HD22  ASN  23          1HD2      ASN  23  12.034  -3.432  10.193
  196    H    GLY  24           H        GLY  24  10.859  -8.195   5.937
  197    HA2  GLY  24           1HA      GLY  24  10.220 -10.410   5.616
  198    HA3  GLY  24           2HA      GLY  24  11.380 -10.896   6.850
  199    H    ALA  25           H        ALA  25   8.933  -8.427   7.207
  200    HA   ALA  25           HA       ALA  25   7.536 -10.117   9.151
  201    HB1  ALA  25           3HB      ALA  25   7.360  -8.222  10.675
  202    HB2  ALA  25           1HB      ALA  25   8.295  -7.228   9.557
  203    HB3  ALA  25           2HB      ALA  25   9.047  -8.613  10.347
  204    HA   PRO  26           HA       PRO  26   3.995  -8.424   6.976
  205    HB2  PRO  26           1HB      PRO  26   2.226  -9.889   8.635
  206    HB3  PRO  26           2HB      PRO  26   2.826 -10.354   7.045
  207    HG2  PRO  26           1HG      PRO  26   3.406 -11.640   9.450
  208    HG3  PRO  26           2HG      PRO  26   4.286 -11.840   7.926
  209    HD2  PRO  26           1HD      PRO  26   4.967 -10.190  10.312
  210    HD3  PRO  26           2HD      PRO  26   6.033 -11.061   9.188
  211    H    ARG  27           H        ARG  27   3.393  -6.403   7.403
  212    HA   ARG  27           HA       ARG  27   2.479  -5.756  10.123
  213    HB2  ARG  27           1HB      ARG  27   4.293  -4.327   9.260
  214    HB3  ARG  27           2HB      ARG  27   3.292  -3.893   7.881
  215    HG2  ARG  27           1HG      ARG  27   1.756  -2.714   9.265
  216    HG3  ARG  27           2HG      ARG  27   2.521  -3.328  10.731
  217    HD2  ARG  27           1HD      ARG  27   3.829  -1.512   8.709
  218    HD3  ARG  27           2HD      ARG  27   3.143  -0.994  10.247
  219    HE   ARG  27           HE       ARG  27   4.948  -2.961  10.900
  220   HH11  ARG  27          1HH1      ARG  27   5.060   0.148   9.277
  221   HH12  ARG  27          2HH1      ARG  27   6.736   0.430   9.664
  222   HH21  ARG  27          1HH2      ARG  27   7.129  -2.559  11.463
  223   HH22  ARG  27          2HH2      ARG  27   7.891  -1.081  10.955
  224    H    ILE  28           H        ILE  28   0.396  -5.418  10.484
  225    HA   ILE  28           HA       ILE  28  -1.420  -5.581   8.189
  226    HB   ILE  28           HB       ILE  28  -2.074  -5.831  11.130
  227   HG12  ILE  28          1HG1      ILE  28  -1.641  -8.021   9.083
  228   HG13  ILE  28          2HG1      ILE  28  -0.498  -7.589  10.350
  229   HG21  ILE  28          1HG2      ILE  28  -3.978  -5.209   9.747
  230   HG22  ILE  28          2HG2      ILE  28  -4.145  -6.870  10.317
  231   HG23  ILE  28          3HG2      ILE  28  -3.643  -6.554   8.656
  232   HD11  ILE  28          3HD1      ILE  28  -1.770  -9.559  10.954
  233   HD12  ILE  28          1HD1      ILE  28  -3.278  -8.662  10.766
  234   HD13  ILE  28          2HD1      ILE  28  -2.142  -8.221  12.041
  235    H    PHE  29           H        PHE  29  -2.204  -3.749   7.413
  236    HA   PHE  29           HA       PHE  29  -2.447  -1.400   9.125
  237    HB2  PHE  29           1HB      PHE  29  -3.078  -1.698   6.178
  238    HB3  PHE  29           2HB      PHE  29  -2.977  -0.188   7.076
  239    HD1  PHE  29           HD2      PHE  29  -0.644   0.121   8.346
  240    HD2  PHE  29           HD1      PHE  29  -1.290  -2.290   4.899
  241    HE1  PHE  29           HE2      PHE  29   1.746   0.284   7.790
  242    HE2  PHE  29           HE1      PHE  29   1.099  -2.133   4.338
  243    HZ   PHE  29           HZ       PHE  29   2.620  -0.845   5.781
  244    H    ASN  30           H        ASN  30  -4.289  -0.876  10.104
  245    HA   ASN  30           HA       ASN  30  -6.698  -2.393   9.454
  246    HB2  ASN  30           1HB      ASN  30  -6.108  -0.483  11.728
  247    HB3  ASN  30           2HB      ASN  30  -7.608  -1.383  11.534
  248   HD21  ASN  30          2HD2      ASN  30  -6.296  -3.790  10.573
  249   HD22  ASN  30          1HD2      ASN  30  -5.523  -4.506  11.948
  250    H    GLY  31           H        GLY  31  -5.282   0.684   9.024
  251    HA2  GLY  31           1HA      GLY  31  -7.753   1.604   7.719
  252    HA3  GLY  31           2HA      GLY  31  -6.903   2.669   8.832
  253    H    VAL  32           H        VAL  32  -7.429   3.182   6.078
  254    HA   VAL  32           HA       VAL  32  -5.231   2.609   4.417
  255    HB   VAL  32           HB       VAL  32  -7.065   5.007   4.253
  256   HG11  VAL  32          1HG1      VAL  32  -6.487   5.060   1.907
  257   HG12  VAL  32          2HG1      VAL  32  -5.445   3.651   2.104
  258   HG13  VAL  32          3HG1      VAL  32  -5.026   5.176   2.885
  259   HG21  VAL  32          3HG2      VAL  32  -8.337   2.929   4.317
  260   HG22  VAL  32          1HG2      VAL  32  -7.345   2.271   3.016
  261   HG23  VAL  32          2HG2      VAL  32  -8.400   3.652   2.710
  262    H    TYR  33           H        TYR  33  -5.759   5.094   6.819
  263    HA   TYR  33           HA       TYR  33  -3.785   6.915   6.015
  264    HB2  TYR  33           1HB      TYR  33  -5.473   7.516   7.668
  265    HB3  TYR  33           2HB      TYR  33  -4.821   6.330   8.796
  266    HD1  TYR  33           HD2      TYR  33  -3.901   9.413   6.926
  267    HD2  TYR  33           HD1      TYR  33  -3.156   6.950  10.316
  268    HE1  TYR  33           HE2      TYR  33  -2.351  11.102   7.808
  269    HE2  TYR  33           HE1      TYR  33  -1.604   8.634  11.205
  270    HH   TYR  33           HH       TYR  33  -0.210  10.463  10.378
  271    H    GLU  34           H        GLU  34  -3.604   4.102   8.159
  272    HA   GLU  34           HA       GLU  34  -0.974   4.436   9.055
  273    HB2  GLU  34           1HB      GLU  34  -2.498   1.872   8.558
  274    HB3  GLU  34           2HB      GLU  34  -1.016   1.998   9.493
  275    HG2  GLU  34           1HG      GLU  34  -2.139   3.396  11.125
  276    HG3  GLU  34           2HG      GLU  34  -3.619   3.348  10.169
  277    H    ALA  35           H        ALA  35  -2.266   2.838   6.197
  278    HA   ALA  35           HA       ALA  35   0.239   1.825   5.292
  279    HB1  ALA  35           3HB      ALA  35  -2.300   2.257   3.722
  280    HB2  ALA  35           1HB      ALA  35  -1.947   0.830   4.698
  281    HB3  ALA  35           2HB      ALA  35  -0.954   1.203   3.287
  282    H    PHE  36           H        PHE  36  -1.746   4.637   4.458
  283    HA   PHE  36           HA       PHE  36  -0.236   5.568   2.295
  284    HB2  PHE  36           1HB      PHE  36  -2.513   6.361   2.881
  285    HB3  PHE  36           2HB      PHE  36  -1.842   7.206   4.271
  286    HD1  PHE  36           HD1      PHE  36  -1.194   6.957   0.597
  287    HD2  PHE  36           HD2      PHE  36  -1.527   9.459   4.025
  288    HE1  PHE  36           HE1      PHE  36  -0.805   8.935  -0.812
  289    HE2  PHE  36           HE2      PHE  36  -1.137  11.441   2.620
  290    HZ   PHE  36           HZ       PHE  36  -0.778  11.181   0.197
  291    H    ASP  37           H        ASP  37   0.137   6.070   5.763
  292    HA   ASP  37           HA       ASP  37   2.209   8.010   5.577
  293    HB2  ASP  37           1HB      ASP  37   0.823   7.545   7.627
  294    HB3  ASP  37           2HB      ASP  37   1.726   6.049   7.833
  295    H    PHE  38           H        PHE  38   2.189   4.492   5.970
  296    HA   PHE  38           HA       PHE  38   4.942   4.079   6.230
  297    HB2  PHE  38           1HB      PHE  38   3.351   2.333   6.764
  298    HB3  PHE  38           2HB      PHE  38   2.789   2.280   5.098
  299    HD1  PHE  38           HD2      PHE  38   5.937   1.877   7.059
  300    HD2  PHE  38           HD1      PHE  38   3.610   0.627   3.721
  301    HE1  PHE  38           HE2      PHE  38   7.594   0.129   6.560
  302    HE2  PHE  38           HE1      PHE  38   5.264  -1.120   3.217
  303    HZ   PHE  38           HZ       PHE  38   7.259  -1.372   4.638
  304    H    LEU  39           H        LEU  39   2.912   4.254   3.348
  305    HA   LEU  39           HA       LEU  39   4.854   3.364   1.503
  306    HB2  LEU  39           1HB      LEU  39   2.477   5.156   1.030
  307    HB3  LEU  39           2HB      LEU  39   3.371   4.292  -0.205
  308    HG   LEU  39           HG       LEU  39   1.741   3.029   1.997
  309   HD11  LEU  39          1HD1      LEU  39   1.250   3.269  -0.967
  310   HD12  LEU  39          2HD1      LEU  39   0.361   4.097   0.314
  311   HD13  LEU  39          3HD1      LEU  39   0.267   2.341   0.167
  312   HD21  LEU  39          3HD2      LEU  39   3.244   1.781  -0.300
  313   HD22  LEU  39          1HD2      LEU  39   2.159   0.932   0.802
  314   HD23  LEU  39          2HD2      LEU  39   3.652   1.650   1.411
  315    H    GLN  40           H        GLN  40   4.470   6.379   3.088
  316    HA   GLN  40           HA       GLN  40   6.166   7.738   1.116
  317    HB2  GLN  40           1HB      GLN  40   4.702   8.841   3.522
  318    HB3  GLN  40           2HB      GLN  40   5.628   9.794   2.373
  319    HG2  GLN  40           1HG      GLN  40   4.076   9.269   0.613
  320    HG3  GLN  40           2HG      GLN  40   3.192   8.173   1.677
  321   HE21  GLN  40          2HE2      GLN  40   1.918   9.014   3.315
  322   HE22  GLN  40          1HE2      GLN  40   1.429  10.674   3.344
  323    H    HIS  41           H        HIS  41   6.540   5.833   3.694
  324    HA   HIS  41           HA       HIS  41   8.810   7.346   4.788
  325    HB2  HIS  41           1HB      HIS  41   6.894   5.404   5.994
  326    HB3  HIS  41           2HB      HIS  41   8.536   5.452   6.624
  327    HD1  HIS  41           HD1      HIS  41   8.707   6.881   8.594
  328    HD2  HIS  41           HD2      HIS  41   5.865   8.312   5.915
  329    HE1  HIS  41           HE1      HIS  41   7.747   8.950   9.658
  330    HE2  HIS  41           HE2      HIS  41   5.883   9.659   8.125
  331    H    GLU  42           H        GLU  42   7.837   3.961   4.173
  332    HA   GLU  42           HA       GLU  42  10.609   3.390   3.433
  333    HB2  GLU  42           1HB      GLU  42   9.084   1.914   5.588
  334    HB3  GLU  42           2HB      GLU  42  10.646   1.427   4.943
  335    HG2  GLU  42           1HG      GLU  42  11.699   3.375   5.824
  336    HG3  GLU  42           2HG      GLU  42  10.147   4.073   6.279
  337    H    TRP  43           H        TRP  43   8.845   3.463   1.464
  338    HA   TRP  43           HA       TRP  43   7.883   0.774   0.950
  339    HB2  TRP  43           1HB      TRP  43   6.761   2.740  -0.063
  340    HB3  TRP  43           2HB      TRP  43   8.233   3.111  -0.952
  341    HD1  TRP  43           HD1      TRP  43   8.329   2.182  -3.325
  342    HE1  TRP  43           HE1      TRP  43   7.090   0.365  -4.653
  343    HE3  TRP  43           HE3      TRP  43   5.472   0.221   0.441
  344    HZ2  TRP  43           HZ2      TRP  43   5.153  -1.623  -4.181
  345    HZ3  TRP  43           HZ3      TRP  43   3.952  -1.634  -0.094
  346    HH2  TRP  43           HH2      TRP  43   3.795  -2.536  -2.353
  347    HA   PRO  44           HA       PRO  44  12.163  -0.259   0.560
  348    HB2  PRO  44           1HB      PRO  44  11.860  -2.937   0.159
  349    HB3  PRO  44           2HB      PRO  44  11.688  -2.155   1.734
  350    HG2  PRO  44           1HG      PRO  44   9.568  -3.005  -0.200
  351    HG3  PRO  44           2HG      PRO  44   9.609  -3.177   1.564
  352    HD2  PRO  44           1HD      PRO  44   8.196  -1.234   0.336
  353    HD3  PRO  44           2HD      PRO  44   8.963  -0.993   1.918
  354    H    ALA  45           H        ALA  45   9.914  -1.428  -1.926
  355    HA   ALA  45           HA       ALA  45  12.171  -1.923  -3.711
  356    HB1  ALA  45           3HB      ALA  45   9.251  -2.570  -4.073
  357    HB2  ALA  45           1HB      ALA  45  10.489  -3.680  -3.484
  358    HB3  ALA  45           2HB      ALA  45  10.568  -3.067  -5.137
  359    H    ARG  46           H        ARG  46  12.379  -0.982  -5.718
  360    HA   ARG  46           HA       ARG  46  11.239   1.649  -5.995
  361    HB2  ARG  46           1HB      ARG  46  13.224   0.049  -7.594
  362    HB3  ARG  46           2HB      ARG  46  12.619   1.596  -8.163
  363    HG2  ARG  46           1HG      ARG  46  13.479   2.686  -6.162
  364    HG3  ARG  46           2HG      ARG  46  14.067   1.133  -5.563
  365    HD2  ARG  46           1HD      ARG  46  14.922   2.349  -8.181
  366    HD3  ARG  46           2HD      ARG  46  15.794   2.584  -6.666
  367    HE   ARG  46           HE       ARG  46  16.079   0.118  -6.631
  368   HH11  ARG  46          1HH1      ARG  46  15.416   1.717  -9.675
  369   HH12  ARG  46          2HH1      ARG  46  16.218   0.510 -10.630
  370   HH21  ARG  46          1HH2      ARG  46  17.141  -1.450  -7.854
  371   HH22  ARG  46          2HH2      ARG  46  17.217  -1.304  -9.593
  372    H    GLY  47           H        GLY  47  10.952   1.941  -8.724
  373    HA2  GLY  47           1HA      GLY  47   9.611   0.454 -10.390
  374    HA3  GLY  47           2HA      GLY  47   8.417   0.506  -9.099
  375    H    ASP  48           H        ASP  48   9.489   3.304  -8.518
  376    HA   ASP  48           HA       ASP  48   8.970   5.456  -8.957
  377    HB2  ASP  48           1HB      ASP  48  10.280   5.078 -11.012
  378    HB3  ASP  48           2HB      ASP  48   8.817   4.558 -11.841
  379    H    ARG  49           H        ARG  49   6.980   4.144 -11.598
  380    HA   ARG  49           HA       ARG  49   4.683   5.527 -10.592
  381    HB2  ARG  49           1HB      ARG  49   5.004   3.564 -12.863
  382    HB3  ARG  49           2HB      ARG  49   3.477   4.340 -12.458
  383    HG2  ARG  49           1HG      ARG  49   4.584   6.542 -12.772
  384    HG3  ARG  49           2HG      ARG  49   6.017   5.686 -13.340
  385    HD2  ARG  49           1HD      ARG  49   4.715   6.449 -15.223
  386    HD3  ARG  49           2HD      ARG  49   4.683   4.690 -15.145
  387    HE   ARG  49           HE       ARG  49   2.418   4.792 -14.928
  388   HH11  ARG  49          1HH1      ARG  49   3.733   7.875 -13.904
  389   HH12  ARG  49          2HH1      ARG  49   2.185   8.656 -13.834
  390   HH21  ARG  49          1HH2      ARG  49   0.369   5.826 -14.847
  391   HH22  ARG  49          2HH2      ARG  49   0.278   7.504 -14.400
  392    H    ALA  50           H        ALA  50   6.021   2.372 -10.194
  393    HA   ALA  50           HA       ALA  50   3.718   1.078  -9.165
  394    HB1  ALA  50           3HB      ALA  50   5.734  -0.161  -9.793
  395    HB2  ALA  50           1HB      ALA  50   5.287  -0.482  -8.117
  396    HB3  ALA  50           2HB      ALA  50   6.623   0.611  -8.479
  397    H    HIS  51           H        HIS  51   6.249   3.061  -7.723
  398    HA   HIS  51           HA       HIS  51   5.268   2.946  -5.051
  399    HB2  HIS  51           1HB      HIS  51   7.615   3.592  -5.744
  400    HB3  HIS  51           2HB      HIS  51   6.962   5.117  -6.324
  401    HD1  HIS  51           HD1      HIS  51   8.877   4.085  -3.673
  402    HD2  HIS  51           HD2      HIS  51   5.277   6.172  -3.825
  403    HE1  HIS  51           HE1      HIS  51   8.712   5.330  -1.497
  404    HE2  HIS  51           HE2      HIS  51   6.436   6.384  -1.521
  405    H    GLU  52           H        GLU  52   4.903   5.189  -7.758
  406    HA   GLU  52           HA       GLU  52   3.396   7.153  -6.445
  407    HB2  GLU  52           1HB      GLU  52   4.490   7.386  -8.689
  408    HB3  GLU  52           2HB      GLU  52   3.200   6.403  -9.365
  409    HG2  GLU  52           1HG      GLU  52   1.569   8.092  -8.550
  410    HG3  GLU  52           2HG      GLU  52   2.928   9.098  -8.058
  411    H    GLN  53           H        GLN  53   2.359   4.264  -8.241
  412    HA   GLN  53           HA       GLN  53  -0.399   4.768  -8.187
  413    HB2  GLN  53           1HB      GLN  53   0.724   3.027  -9.581
  414    HB3  GLN  53           2HB      GLN  53   0.942   2.057  -8.129
  415    HG2  GLN  53           1HG      GLN  53  -1.507   1.995  -7.840
  416    HG3  GLN  53           2HG      GLN  53  -1.682   2.892  -9.347
  417   HE21  GLN  53          2HE2      GLN  53   0.589   1.457 -10.568
  418   HE22  GLN  53          1HE2      GLN  53  -0.019  -0.106 -10.976
  419    H    ALA  54           H        ALA  54   1.704   3.128  -5.870
  420    HA   ALA  54           HA       ALA  54  -0.238   2.145  -4.129
  421    HB1  ALA  54           3HB      ALA  54   2.128   1.532  -4.001
  422    HB2  ALA  54           1HB      ALA  54   1.522   2.094  -2.443
  423    HB3  ALA  54           2HB      ALA  54   2.519   3.157  -3.437
  424    H    LEU  55           H        LEU  55   1.460   5.271  -4.088
  425    HA   LEU  55           HA       LEU  55  -0.005   6.291  -1.866
  426    HB2  LEU  55           1HB      LEU  55   1.764   7.539  -3.944
  427    HB3  LEU  55           2HB      LEU  55   0.853   8.547  -2.839
  428    HG   LEU  55           HG       LEU  55   1.998   7.480  -0.928
  429   HD11  LEU  55          1HD1      LEU  55   2.471   5.311  -1.921
  430   HD12  LEU  55          2HD1      LEU  55   3.944   6.063  -1.310
  431   HD13  LEU  55          3HD1      LEU  55   3.608   6.060  -3.042
  432   HD21  LEU  55          3HD2      LEU  55   2.897   9.534  -1.851
  433   HD22  LEU  55          1HD2      LEU  55   3.834   8.617  -3.031
  434   HD23  LEU  55          2HD2      LEU  55   4.206   8.479  -1.313
  435    H    ARG  56           H        ARG  56  -0.378   6.465  -5.347
  436    HA   ARG  56           HA       ARG  56  -2.376   8.355  -5.635
  437    HB2  ARG  56           1HB      ARG  56  -1.232   7.261  -7.510
  438    HB3  ARG  56           2HB      ARG  56  -2.018   5.741  -7.120
  439    HG2  ARG  56           1HG      ARG  56  -3.320   6.466  -8.845
  440    HG3  ARG  56           2HG      ARG  56  -4.207   7.129  -7.472
  441    HD2  ARG  56           1HD      ARG  56  -4.013   8.810  -9.187
  442    HD3  ARG  56           2HD      ARG  56  -3.036   9.278  -7.796
  443    HE   ARG  56           HE       ARG  56  -1.083   8.817  -9.040
  444   HH11  ARG  56          1HH1      ARG  56  -3.992   8.266 -10.902
  445   HH12  ARG  56          2HH1      ARG  56  -3.186   8.351 -12.440
  446   HH21  ARG  56          1HH2      ARG  56   0.001   8.928 -11.070
  447   HH22  ARG  56          2HH2      ARG  56  -0.937   8.763 -12.532
  448    H    LEU  57           H        LEU  57  -2.735   4.868  -5.090
  449    HA   LEU  57           HA       LEU  57  -5.555   4.858  -5.083
  450    HB2  LEU  57           1HB      LEU  57  -3.631   2.900  -3.832
  451    HB3  LEU  57           2HB      LEU  57  -5.327   2.598  -4.159
  452    HG   LEU  57           HG       LEU  57  -3.282   3.202  -6.295
  453   HD11  LEU  57          1HD1      LEU  57  -4.399   0.551  -5.399
  454   HD12  LEU  57          2HD1      LEU  57  -2.739   1.108  -5.188
  455   HD13  LEU  57          3HD1      LEU  57  -3.372   0.813  -6.808
  456   HD21  LEU  57          3HD2      LEU  57  -5.009   2.358  -7.810
  457   HD22  LEU  57          1HD2      LEU  57  -5.574   3.765  -6.909
  458   HD23  LEU  57          2HD2      LEU  57  -6.105   2.149  -6.444
  459    H    CYS  58           H        CYS  58  -3.201   4.844  -2.416
  460    HA   CYS  58           HA       CYS  58  -5.127   4.681  -0.359
  461    HB2  CYS  58           1HB      CYS  58  -2.321   5.797  -0.239
  462    HB3  CYS  58           2HB      CYS  58  -3.295   5.304   1.143
  463    HG   CYS  58           HG       CYS  58  -1.689   3.387  -1.140
  464    H    ARG  59           H        ARG  59  -3.673   7.412  -2.027
  465    HA   ARG  59           HA       ARG  59  -4.601   9.457  -0.329
  466    HB2  ARG  59           1HB      ARG  59  -2.890   9.829  -2.039
  467    HB3  ARG  59           2HB      ARG  59  -4.064   9.508  -3.305
  468    HG2  ARG  59           1HG      ARG  59  -5.329  11.496  -2.633
  469    HG3  ARG  59           2HG      ARG  59  -4.129  11.823  -1.379
  470    HD2  ARG  59           1HD      ARG  59  -2.406  12.112  -3.036
  471    HD3  ARG  59           2HD      ARG  59  -3.506  11.619  -4.320
  472    HE   ARG  59           HE       ARG  59  -4.107  14.023  -2.736
  473   HH11  ARG  59          1HH1      ARG  59  -3.218  12.550  -5.788
  474   HH12  ARG  59          2HH1      ARG  59  -3.577  13.965  -6.730
  475   HH21  ARG  59          1HH2      ARG  59  -4.556  15.892  -3.962
  476   HH22  ARG  59          2HH2      ARG  59  -4.330  15.866  -5.683
  477    H    ALA  60           H        ALA  60  -6.068   7.871  -3.136
  478    HA   ALA  60           HA       ALA  60  -8.420   9.511  -3.091
  479    HB1  ALA  60           3HB      ALA  60  -7.933   6.877  -4.475
  480    HB2  ALA  60           1HB      ALA  60  -7.618   8.473  -5.156
  481    HB3  ALA  60           2HB      ALA  60  -9.272   7.982  -4.789
  482    H    SER  61           H        SER  61  -7.420   6.559  -1.574
  483    HA   SER  61           HA       SER  61 -10.037   5.665  -0.875
  484    HB2  SER  61           1HB      SER  61  -7.358   4.920   0.312
  485    HB3  SER  61           2HB      SER  61  -8.873   4.051   0.563
  486    HG   SER  61           HG       SER  61  -7.435   4.383  -1.862
  487    H    LEU  62           H        LEU  62  -7.584   7.660   0.681
  488    HA   LEU  62           HA       LEU  62  -8.919   7.865   3.186
  489    HB2  LEU  62           1HB      LEU  62  -6.803   9.529   1.845
  490    HB3  LEU  62           2HB      LEU  62  -7.486   9.983   3.395
  491    HG   LEU  62           HG       LEU  62  -6.061   7.379   2.840
  492   HD11  LEU  62          1HD1      LEU  62  -5.127   9.859   4.278
  493   HD12  LEU  62          2HD1      LEU  62  -4.534   9.269   2.725
  494   HD13  LEU  62          3HD1      LEU  62  -4.254   8.329   4.192
  495   HD21  LEU  62          3HD2      LEU  62  -7.739   7.205   4.608
  496   HD22  LEU  62          1HD2      LEU  62  -7.040   8.607   5.419
  497   HD23  LEU  62          2HD2      LEU  62  -6.107   7.117   5.273
  498    H    MET  63           H        MET  63  -9.594   9.151   0.140
  499    HA   MET  63           HA       MET  63 -11.031  11.473   1.083
  500    HB2  MET  63           1HB      MET  63 -11.005  10.110  -1.619
  501    HB3  MET  63           2HB      MET  63 -11.820  11.627  -1.270
  502    HG2  MET  63           1HG      MET  63  -9.684  12.667  -0.748
  503    HG3  MET  63           2HG      MET  63  -8.858  11.142  -1.066
  504    HE1  MET  63           3HE      MET  63  -7.803  13.382  -4.114
  505    HE2  MET  63           1HE      MET  63  -7.232  12.384  -2.775
  506    HE3  MET  63           2HE      MET  63  -8.063  13.906  -2.450
  507    H    GLY  64           H        GLY  64 -11.585   8.146   0.876
  508    HA2  GLY  64           1HA      GLY  64 -13.446   7.005   1.694
  509    HA3  GLY  64           2HA      GLY  64 -14.356   8.508   1.657
  510    H    ASP  65           H        ASP  65 -12.775   8.128  -1.255
  511    HA   ASP  65           HA       ASP  65 -15.264   7.504  -2.577
  512    HB2  ASP  65           1HB      ASP  65 -12.527   8.201  -3.644
  513    HB3  ASP  65           2HB      ASP  65 -13.906   7.839  -4.677
  514    H    VAL  66           H        VAL  66 -12.112   5.986  -2.149
  515    HA   VAL  66           HA       VAL  66 -12.987   3.635  -3.627
  516    HB   VAL  66           HB       VAL  66 -10.374   4.062  -2.164
  517   HG11  VAL  66          1HG1      VAL  66  -9.567   2.240  -3.597
  518   HG12  VAL  66          2HG1      VAL  66 -11.190   2.056  -4.263
  519   HG13  VAL  66          3HG1      VAL  66 -10.894   1.722  -2.557
  520   HG21  VAL  66          3HG2      VAL  66 -10.638   5.745  -3.902
  521   HG22  VAL  66          1HG2      VAL  66 -11.029   4.489  -5.078
  522   HG23  VAL  66          2HG2      VAL  66  -9.416   4.561  -4.368
  523    H    ALA  67           H        ALA  67 -13.850   1.889  -2.676
  524    HA   ALA  67           HA       ALA  67 -14.223   2.051   0.215
  525    HB1  ALA  67           3HB      ALA  67 -16.129   0.594  -0.109
  526    HB2  ALA  67           1HB      ALA  67 -15.714   0.398  -1.812
  527    HB3  ALA  67           2HB      ALA  67 -16.217   1.975  -1.202
  528    H    GLY  68           H        GLY  68 -12.391   1.125   1.052
  529    HA2  GLY  68           1HA      GLY  68 -11.249  -0.599   2.028
  530    HA3  GLY  68           2HA      GLY  68 -12.753  -1.478   1.859
  531    H    GLU  69           H        GLU  69 -12.939  -3.060   0.334
  532    HA   GLU  69           HA       GLU  69 -10.539  -4.400  -0.247
  533    HB2  GLU  69           1HB      GLU  69 -13.384  -4.869  -1.095
  534    HB3  GLU  69           2HB      GLU  69 -12.071  -5.926  -1.600
  535    HG2  GLU  69           1HG      GLU  69 -11.542  -6.409   0.724
  536    HG3  GLU  69           2HG      GLU  69 -12.826  -5.322   1.250
  537    H    ILE  70           H        ILE  70 -12.486  -2.240  -2.187
  538    HA   ILE  70           HA       ILE  70 -11.425  -2.815  -4.717
  539    HB   ILE  70           HB       ILE  70 -12.200  -0.089  -3.646
  540   HG12  ILE  70          1HG1      ILE  70 -13.883  -2.121  -5.134
  541   HG13  ILE  70          2HG1      ILE  70 -13.989  -1.803  -3.407
  542   HG21  ILE  70          1HG2      ILE  70 -11.998  -1.120  -6.477
  543   HG22  ILE  70          2HG2      ILE  70 -10.918   0.045  -5.709
  544   HG23  ILE  70          3HG2      ILE  70 -12.605   0.468  -6.004
  545   HD11  ILE  70          3HD1      ILE  70 -15.768  -0.691  -4.629
  546   HD12  ILE  70          1HD1      ILE  70 -14.576   0.174  -5.600
  547   HD13  ILE  70          2HD1      ILE  70 -14.694   0.484  -3.867
  548    H    ALA  71           H        ALA  71 -10.286  -0.650  -2.158
  549    HA   ALA  71           HA       ALA  71  -7.950   0.218  -3.517
  550    HB1  ALA  71           3HB      ALA  71  -8.935   1.486  -1.666
  551    HB2  ALA  71           1HB      ALA  71  -7.244   1.090  -1.353
  552    HB3  ALA  71           2HB      ALA  71  -8.525   0.178  -0.555
  553    H    ARG  72           H        ARG  72  -8.687  -2.434  -1.341
  554    HA   ARG  72           HA       ARG  72  -6.074  -3.235  -0.729
  555    HB2  ARG  72           1HB      ARG  72  -7.777  -4.191   0.581
  556    HB3  ARG  72           2HB      ARG  72  -8.690  -4.715  -0.827
  557    HG2  ARG  72           1HG      ARG  72  -7.006  -6.400  -1.317
  558    HG3  ARG  72           2HG      ARG  72  -6.044  -5.854   0.056
  559    HD2  ARG  72           1HD      ARG  72  -7.522  -6.721   1.605
  560    HD3  ARG  72           2HD      ARG  72  -8.876  -6.706   0.475
  561    HE   ARG  72           HE       ARG  72  -7.723  -8.590  -0.678
  562   HH11  ARG  72          1HH1      ARG  72  -7.026  -7.951   2.706
  563   HH12  ARG  72          2HH1      ARG  72  -6.616  -9.600   3.064
  564   HH21  ARG  72          1HH2      ARG  72  -7.191 -10.764  -0.195
  565   HH22  ARG  72          2HH2      ARG  72  -6.735 -11.206   1.427
  566    H    THR  73           H        THR  73  -8.274  -4.564  -3.215
  567    HA   THR  73           HA       THR  73  -6.380  -6.348  -4.280
  568    HB   THR  73           HB       THR  73  -8.745  -5.149  -5.729
  569    HG1  THR  73           HG1      THR  73  -9.964  -6.732  -4.749
  570   HG21  THR  73          3HG2      THR  73  -7.326  -7.800  -6.037
  571   HG22  THR  73          1HG2      THR  73  -7.223  -6.439  -7.154
  572   HG23  THR  73          2HG2      THR  73  -8.755  -7.284  -6.934
  573    H    ALA  74           H        ALA  74  -7.205  -3.015  -5.125
  574    HA   ALA  74           HA       ALA  74  -5.597  -2.855  -7.449
  575    HB1  ALA  74           3HB      ALA  74  -7.361  -1.239  -6.965
  576    HB2  ALA  74           1HB      ALA  74  -5.810  -0.433  -7.200
  577    HB3  ALA  74           2HB      ALA  74  -6.453  -0.654  -5.571
  578    H    PHE  75           H        PHE  75  -4.975  -2.126  -4.035
  579    HA   PHE  75           HA       PHE  75  -2.346  -1.166  -4.344
  580    HB2  PHE  75           1HB      PHE  75  -3.679  -0.892  -2.272
  581    HB3  PHE  75           2HB      PHE  75  -3.546  -2.621  -1.973
  582    HD1  PHE  75           HD2      PHE  75  -1.599   0.504  -2.269
  583    HD2  PHE  75           HD1      PHE  75  -1.659  -3.521  -0.887
  584    HE1  PHE  75           HE2      PHE  75   0.505   0.892  -1.058
  585    HE2  PHE  75           HE1      PHE  75   0.446  -3.139   0.326
  586    HZ   PHE  75           HZ       PHE  75   1.531  -0.930   0.242
  587    H    VAL  76           H        VAL  76  -3.654  -4.408  -3.903
  588    HA   VAL  76           HA       VAL  76  -1.240  -5.805  -3.631
  589    HB   VAL  76           HB       VAL  76  -3.852  -6.731  -4.847
  590   HG11  VAL  76          1HG1      VAL  76  -1.500  -8.372  -3.903
  591   HG12  VAL  76          2HG1      VAL  76  -2.002  -8.158  -5.579
  592   HG13  VAL  76          3HG1      VAL  76  -3.052  -9.007  -4.446
  593   HG21  VAL  76          3HG2      VAL  76  -4.057  -6.032  -2.528
  594   HG22  VAL  76          1HG2      VAL  76  -2.699  -7.063  -2.079
  595   HG23  VAL  76          2HG2      VAL  76  -4.201  -7.784  -2.656
  596    H    ALA  77           H        ALA  77  -2.993  -4.721  -6.499
  597    HA   ALA  77           HA       ALA  77  -1.413  -6.072  -8.409
  598    HB1  ALA  77           3HB      ALA  77  -2.345  -4.513 -10.029
  599    HB2  ALA  77           1HB      ALA  77  -2.928  -3.480  -8.723
  600    HB3  ALA  77           2HB      ALA  77  -3.599  -5.098  -8.936
  601    H    ALA  78           H        ALA  78  -1.091  -2.939  -6.834
  602    HA   ALA  78           HA       ALA  78   1.150  -2.077  -8.378
  603    HB1  ALA  78           3HB      ALA  78   1.347  -0.290  -6.732
  604    HB2  ALA  78           1HB      ALA  78   0.200  -1.119  -5.680
  605    HB3  ALA  78           2HB      ALA  78  -0.330  -0.492  -7.240
  606    H    SER  79           H        SER  79   0.796  -3.450  -5.116
  607    HA   SER  79           HA       SER  79   3.575  -3.474  -4.544
  608    HB2  SER  79           1HB      SER  79   2.820  -5.163  -2.749
  609    HB3  SER  79           2HB      SER  79   2.166  -3.526  -2.668
  610    HG   SER  79           HG       SER  79   0.247  -4.244  -3.462
  611    H    ARG  80           H        ARG  80   1.473  -5.619  -6.269
  612    HA   ARG  80           HA       ARG  80   3.001  -7.954  -6.352
  613    HB2  ARG  80           1HB      ARG  80   0.765  -7.891  -7.254
  614    HB3  ARG  80           2HB      ARG  80   1.223  -6.670  -8.430
  615    HG2  ARG  80           1HG      ARG  80   2.777  -8.371  -9.433
  616    HG3  ARG  80           2HG      ARG  80   2.020  -9.565  -8.374
  617    HD2  ARG  80           1HD      ARG  80   1.000  -9.558 -10.607
  618    HD3  ARG  80           2HD      ARG  80  -0.155  -9.089  -9.358
  619    HE   ARG  80           HE       ARG  80   1.197  -6.893 -10.672
  620   HH11  ARG  80          1HH1      ARG  80  -1.603  -8.982 -10.654
  621   HH12  ARG  80          2HH1      ARG  80  -2.596  -7.867 -11.549
  622   HH21  ARG  80          1HH2      ARG  80  -0.105  -5.432 -11.871
  623   HH22  ARG  80          2HH2      ARG  80  -1.745  -5.868 -12.234
  624    H    GLN  81           H        GLN  81   3.123  -5.050  -8.354
  625    HA   GLN  81           HA       GLN  81   5.065  -5.927 -10.190
  626    HB2  GLN  81           1HB      GLN  81   3.570  -3.988 -10.535
  627    HB3  GLN  81           2HB      GLN  81   4.436  -3.110  -9.284
  628    HG2  GLN  81           1HG      GLN  81   6.448  -3.121 -10.627
  629    HG3  GLN  81           2HG      GLN  81   5.643  -4.091 -11.860
  630   HE21  GLN  81          2HE2      GLN  81   6.871  -1.440 -12.053
  631   HE22  GLN  81          1HE2      GLN  81   5.622  -0.391 -12.633
  632    H    ALA  82           H        ALA  82   5.297  -4.407  -7.039
  633    HA   ALA  82           HA       ALA  82   8.180  -4.127  -7.227
  634    HB1  ALA  82           3HB      ALA  82   8.013  -3.114  -5.016
  635    HB2  ALA  82           1HB      ALA  82   6.307  -3.554  -4.935
  636    HB3  ALA  82           2HB      ALA  82   6.860  -2.385  -6.134
  637    H    HIS  83           H        HIS  83   6.130  -6.615  -6.596
  638    HA   HIS  83           HA       HIS  83   6.271  -8.652  -5.633
  639    HB2  HIS  83           1HB      HIS  83   9.212  -7.995  -5.754
  640    HB3  HIS  83           2HB      HIS  83   8.609  -9.544  -5.173
  641    HD1  HIS  83           HD1      HIS  83   7.843 -11.242  -6.910
  642    HD2  HIS  83           HD2      HIS  83   8.772  -7.520  -8.534
  643    HE1  HIS  83           HE1      HIS  83   7.841 -11.563  -9.404
  644    HE2  HIS  83           HE2      HIS  83   8.312  -9.282 -10.373
  645    H    CYS  84           H        CYS  84   5.300  -7.007  -3.936
  646    HA   CYS  84           HA       CYS  84   6.475  -7.855  -1.392
  647    HB2  CYS  84           1HB      CYS  84   7.108  -5.495  -1.746
  648    HB3  CYS  84           2HB      CYS  84   5.415  -5.077  -1.974
  649    HG   CYS  84           HG       CYS  84   6.853  -6.162   0.941
  650    H    LEU  85           H        LEU  85   4.874  -9.498  -1.490
  651    HA   LEU  85           HA       LEU  85   2.127  -8.541  -1.031
  652    HB2  LEU  85           1HB      LEU  85   2.995 -10.834  -2.787
  653    HB3  LEU  85           2HB      LEU  85   1.337 -10.547  -2.300
  654    HG   LEU  85           HG       LEU  85   3.005  -8.651  -3.949
  655   HD11  LEU  85          1HD1      LEU  85   0.769 -10.507  -4.760
  656   HD12  LEU  85          2HD1      LEU  85   2.474 -10.703  -5.167
  657   HD13  LEU  85          3HD1      LEU  85   1.568  -9.331  -5.804
  658   HD21  LEU  85          3HD2      LEU  85   1.315  -7.535  -2.583
  659   HD22  LEU  85          1HD2      LEU  85   0.079  -8.611  -3.234
  660   HD23  LEU  85          2HD2      LEU  85   0.905  -7.471  -4.297
  661    H    MET  86           H        MET  86   1.114  -9.420   0.638
  662    HA   MET  86           HA       MET  86   2.102 -11.985   1.697
  663    HB2  MET  86           1HB      MET  86   0.728  -9.692   3.095
  664    HB3  MET  86           2HB      MET  86   0.806 -11.302   3.796
  665    HG2  MET  86           1HG      MET  86   3.176  -9.612   3.038
  666    HG3  MET  86           2HG      MET  86   2.535  -9.809   4.667
  667    HE1  MET  86           3HE      MET  86   2.542 -12.154   5.979
  668    HE2  MET  86           1HE      MET  86   3.188 -13.645   5.292
  669    HE3  MET  86           2HE      MET  86   1.731 -12.920   4.613
  670    H    GLU  87           H        GLU  87   0.882 -13.572   0.967
  671    HA   GLU  87           HA       GLU  87  -1.730 -13.076  -0.089
  672    HB2  GLU  87           1HB      GLU  87  -0.165 -15.635   0.265
  673    HB3  GLU  87           2HB      GLU  87  -1.706 -15.518  -0.577
  674    HG2  GLU  87           1HG      GLU  87  -0.755 -14.079  -2.241
  675    HG3  GLU  87           2HG      GLU  87   0.764 -13.990  -1.354
  676    H    ASP  88           H        ASP  88  -3.677 -13.777   0.648
  677    HA   ASP  88           HA       ASP  88  -4.044 -13.872   3.455
  678    HB2  ASP  88           1HB      ASP  88  -5.655 -13.396   1.238
  679    HB3  ASP  88           2HB      ASP  88  -6.280 -14.910   1.883
  680    H    LYS  89           H        LYS  89  -4.741 -15.622   4.763
  681    HA   LYS  89           HA       LYS  89  -3.535 -18.114   3.978
  682    HB2  LYS  89           1HB      LYS  89  -4.995 -17.334   6.504
  683    HB3  LYS  89           2HB      LYS  89  -4.212 -18.889   6.252
  684    HG2  LYS  89           1HG      LYS  89  -2.078 -17.596   5.832
  685    HG3  LYS  89           2HG      LYS  89  -2.934 -16.180   6.446
  686    HD2  LYS  89           1HD      LYS  89  -3.353 -17.349   8.555
  687    HD3  LYS  89           2HD      LYS  89  -2.500 -18.766   7.940
  688    HE2  LYS  89           1HE      LYS  89  -0.477 -17.318   7.657
  689    HE3  LYS  89           2HE      LYS  89  -1.354 -16.034   8.490
  690    HZ1  LYS  89           3HZ      LYS  89  -0.625 -18.693   9.594
  691    HZ2  LYS  89           1HZ      LYS  89  -1.601 -17.561  10.397
  692    HZ3  LYS  89           2HZ      LYS  89   0.019 -17.193  10.055
  693    H    ALA  90           H        ALA  90  -6.265 -16.919   2.973
  694    HA   ALA  90           HA       ALA  90  -7.982 -19.221   3.314
  695    HB1  ALA  90           3HB      ALA  90  -9.504 -18.040   1.805
  696    HB2  ALA  90           1HB      ALA  90  -8.268 -16.819   1.507
  697    HB3  ALA  90           2HB      ALA  90  -8.967 -16.990   3.117
  698    H    GLU  91           H        GLU  91  -5.370 -18.345   1.383
  699    HA   GLU  91           HA       GLU  91  -6.163 -20.076  -0.842
  700    HB2  GLU  91           1HB      GLU  91  -3.804 -18.211  -0.544
  701    HB3  GLU  91           2HB      GLU  91  -4.181 -19.146  -1.984
  702    HG2  GLU  91           1HG      GLU  91  -6.308 -17.927  -2.189
  703    HG3  GLU  91           2HG      GLU  91  -5.864 -16.957  -0.783
  704    H    ALA  92           H        ALA  92  -5.785 -22.139  -0.364
  705    HA   ALA  92           HA       ALA  92  -4.777 -24.065   0.281
  706    HB1  ALA  92           3HB      ALA  92  -2.299 -22.649  -0.690
  707    HB2  ALA  92           1HB      ALA  92  -3.451 -23.518  -1.703
  708    HB3  ALA  92           2HB      ALA  92  -2.502 -24.391  -0.501
  709    HA   PRO  93           HA       PRO  93  -3.125 -22.408   4.269
  710    HB2  PRO  93           1HB      PRO  93  -5.169 -22.946   5.878
  711    HB3  PRO  93           2HB      PRO  93  -5.235 -21.564   4.777
  712    HG2  PRO  93           1HG      PRO  93  -6.510 -24.252   4.522
  713    HG3  PRO  93           2HG      PRO  93  -7.165 -22.657   4.114
  714    HD2  PRO  93           1HD      PRO  93  -6.026 -24.450   2.310
  715    HD3  PRO  93           2HD      PRO  93  -6.265 -22.715   2.026
  716    H    ASN  94           H        ASN  94  -3.177 -23.620   6.507
  717    HA   ASN  94           HA       ASN  94  -2.886 -26.512   6.029
  718    HB2  ASN  94           1HB      ASN  94  -1.343 -24.712   7.910
  719    HB3  ASN  94           2HB      ASN  94  -1.275 -26.470   7.974
  720   HD21  ASN  94          2HD2      ASN  94   0.825 -24.505   7.436
  721   HD22  ASN  94          1HD2      ASN  94   1.484 -24.917   5.891
  722    H    THR  95           H        THR  95  -4.286 -27.738   7.101
  723    HA   THR  95           HA       THR  95  -6.237 -26.644   8.825
  724    HB   THR  95           HB       THR  95  -5.482 -29.560   8.525
  725    HG1  THR  95           HG1      THR  95  -6.868 -29.582   6.770
  726   HG21  THR  95          3HG2      THR  95  -7.002 -29.114  10.393
  727   HG22  THR  95          1HG2      THR  95  -7.837 -29.968   9.094
  728   HG23  THR  95          2HG2      THR  95  -8.084 -28.235   9.311
  729    H    ILE  96           H        ILE  96  -3.343 -28.599   9.399
  730    HA   ILE  96           HA       ILE  96  -3.650 -28.268  12.279
  731    HB   ILE  96           HB       ILE  96  -2.991 -30.476  11.596
  732   HG12  ILE  96          1HG1      ILE  96  -0.614 -29.014  12.768
  733   HG13  ILE  96          2HG1      ILE  96  -1.990 -29.636  13.676
  734   HG21  ILE  96          1HG2      ILE  96  -0.904 -30.926  10.387
  735   HG22  ILE  96          2HG2      ILE  96  -0.654 -29.191  10.195
  736   HG23  ILE  96          3HG2      ILE  96  -2.037 -29.972   9.429
  737   HD11  ILE  96          3HD1      ILE  96  -1.378 -31.913  13.017
  738   HD12  ILE  96          1HD1      ILE  96  -0.078 -31.100  13.890
  739   HD13  ILE  96          2HD1      ILE  96   0.012 -31.273  12.138
  740    H    ALA  97           H        ALA  97  -2.594 -26.776  13.427
  741    HA   ALA  97           HA       ALA  97  -1.193 -24.685  12.114
  742    HB1  ALA  97           3HB      ALA  97  -1.402 -25.273  15.063
  743    HB2  ALA  97           1HB      ALA  97  -2.544 -24.322  14.116
  744    HB3  ALA  97           2HB      ALA  97  -0.893 -23.748  14.341
  745    H    SER  98           H        SER  98  -0.182 -27.640  13.531
  746    HA   SER  98           HA       SER  98   2.611 -26.804  13.660
  747    HB2  SER  98           1HB      SER  98   1.454 -29.525  14.301
  748    HB3  SER  98           2HB      SER  98   3.009 -28.869  14.813
  749    HG   SER  98           HG       SER  98   0.876 -28.807  16.210
  750    H    GLY  99           H        GLY  99   0.821 -27.326  11.195
  751    HA2  GLY  99           1HA      GLY  99   1.950 -29.620   9.900
  752    HA3  GLY  99           2HA      GLY  99   0.923 -28.401   9.160
  753    H    SER 100           H        SER 100   4.077 -29.569   9.560
  754    HA   SER 100           HA       SER 100   5.080 -27.755   7.548
  755    HB2  SER 100           1HB      SER 100   6.489 -27.920  10.228
  756    HB3  SER 100           2HB      SER 100   6.984 -26.961   8.834
  757    HG   SER 100           HG       SER 100   4.500 -26.274   9.378
  Start of MODEL   11
    1    H1   MET   1           1H       MET   1  -8.855  12.048   6.078
    2    H2   MET   1           2H       MET   1  -7.668  12.645   5.036
    3    H3   MET   1           3H       MET   1  -9.293  13.023   4.758
    4    HA   MET   1           HA       MET   1  -8.266  14.931   5.704
    5    HB2  MET   1           1HB      MET   1  -9.761  13.508   7.919
    6    HB3  MET   1           2HB      MET   1  -9.623  15.243   7.681
    7    HG2  MET   1           1HG      MET   1 -10.948  15.090   5.653
    8    HG3  MET   1           2HG      MET   1 -11.056  13.342   5.840
    9    HE1  MET   1           3HE      MET   1 -13.652  14.956   5.391
   10    HE2  MET   1           1HE      MET   1 -14.712  14.335   6.657
   11    HE3  MET   1           2HE      MET   1 -13.661  13.231   5.770
   12    H    GLU   2           H        GLU   2  -7.720  15.595   8.240
   13    HA   GLU   2           HA       GLU   2  -5.348  14.002   8.920
   14    HB2  GLU   2           1HB      GLU   2  -6.045  16.865   9.613
   15    HB3  GLU   2           2HB      GLU   2  -4.589  16.029  10.136
   16    HG2  GLU   2           1HG      GLU   2  -3.855  15.809   7.840
   17    HG3  GLU   2           2HG      GLU   2  -5.348  16.551   7.269
   18    H    VAL   3           H        VAL   3  -5.116  13.167  10.963
   19    HA   VAL   3           HA       VAL   3  -7.636  13.092  12.476
   20    HB   VAL   3           HB       VAL   3  -5.374  11.100  12.627
   21   HG11  VAL   3          1HG1      VAL   3  -8.257  10.956  13.495
   22   HG12  VAL   3          2HG1      VAL   3  -6.856  11.110  14.554
   23   HG13  VAL   3          3HG1      VAL   3  -7.085   9.642  13.602
   24   HG21  VAL   3          3HG2      VAL   3  -6.244  11.149  10.349
   25   HG22  VAL   3          1HG2      VAL   3  -7.887  10.966  10.965
   26   HG23  VAL   3          2HG2      VAL   3  -6.718   9.662  11.172
   27    H    GLN   4           H        GLN   4  -7.746  13.739  14.517
   28    HA   GLN   4           HA       GLN   4  -5.557  15.082  15.761
   29    HB2  GLN   4           1HB      GLN   4  -8.209  14.249  16.974
   30    HB3  GLN   4           2HB      GLN   4  -7.095  15.437  17.633
   31    HG2  GLN   4           1HG      GLN   4  -8.607  16.814  16.641
   32    HG3  GLN   4           2HG      GLN   4  -7.473  16.605  15.310
   33   HE21  GLN   4          2HE2      GLN   4 -10.262  17.332  15.200
   34   HE22  GLN   4          1HE2      GLN   4 -11.045  16.125  14.227
   35    H    SER   5           H        SER   5  -7.483  12.297  16.891
   36    HA   SER   5           HA       SER   5  -5.091  11.293  18.263
   37    HB2  SER   5           1HB      SER   5  -8.003  10.523  18.604
   38    HB3  SER   5           2HB      SER   5  -6.657   9.854  19.526
   39    HG   SER   5           HG       SER   5  -6.229  11.991  20.280
   40    H    MET   6           H        MET   6  -3.971   9.810  17.203
   41    HA   MET   6           HA       MET   6  -4.932   8.771  14.733
   42    HB2  MET   6           1HB      MET   6  -2.388   8.208  16.255
   43    HB3  MET   6           2HB      MET   6  -2.715   7.651  14.620
   44    HG2  MET   6           1HG      MET   6  -2.928   9.988  13.888
   45    HG3  MET   6           2HG      MET   6  -2.539  10.516  15.523
   46    HE1  MET   6           3HE      MET   6  -1.216   8.732  12.287
   47    HE2  MET   6           1HE      MET   6  -1.002   7.494  13.526
   48    HE3  MET   6           2HE      MET   6   0.406   8.253  12.783
   49    H    LEU   7           H        LEU   7  -5.591   7.729  17.775
   50    HA   LEU   7           HA       LEU   7  -5.549   4.921  17.450
   51    HB2  LEU   7           1HB      LEU   7  -7.367   6.708  19.067
   52    HB3  LEU   7           2HB      LEU   7  -7.408   4.957  19.148
   53    HG   LEU   7           HG       LEU   7  -5.035   6.679  19.877
   54   HD11  LEU   7          1HD1      LEU   7  -5.531   6.018  22.174
   55   HD12  LEU   7          2HD1      LEU   7  -6.973   5.165  21.622
   56   HD13  LEU   7          3HD1      LEU   7  -6.869   6.919  21.463
   57   HD21  LEU   7          3HD2      LEU   7  -5.482   3.706  20.144
   58   HD22  LEU   7          1HD2      LEU   7  -4.084   4.599  20.744
   59   HD23  LEU   7          2HD2      LEU   7  -4.385   4.492  19.012
   60    H    LEU   8           H        LEU   8  -7.644   7.445  16.319
   61    HA   LEU   8           HA       LEU   8  -9.469   5.509  15.092
   62    HB2  LEU   8           1HB      LEU   8 -10.507   7.412  16.217
   63    HB3  LEU   8           2HB      LEU   8  -9.554   8.528  15.260
   64    HG   LEU   8           HG       LEU   8 -10.735   7.717  13.219
   65   HD11  LEU   8          1HD1      LEU   8 -11.392   5.515  14.017
   66   HD12  LEU   8          2HD1      LEU   8 -12.799   6.439  13.488
   67   HD13  LEU   8          3HD1      LEU   8 -12.462   6.254  15.208
   68   HD21  LEU   8          3HD2      LEU   8 -11.433   9.751  14.349
   69   HD22  LEU   8          1HD2      LEU   8 -12.475   8.815  15.423
   70   HD23  LEU   8          2HD2      LEU   8 -12.827   8.893  13.696
   71    H    ASN   9           H        ASN   9  -9.347   5.047  12.953
   72    HA   ASN   9           HA       ASN   9  -7.178   6.305  11.466
   73    HB2  ASN   9           1HB      ASN   9  -7.706   3.746  11.553
   74    HB3  ASN   9           2HB      ASN   9  -8.930   4.136  10.348
   75   HD21  ASN   9          2HD2      ASN   9  -5.568   3.819  11.013
   76   HD22  ASN   9          1HD2      ASN   9  -5.009   4.004   9.390
   77    H    ASP  10           H        ASP  10  -7.443   7.635   9.763
   78    HA   ASP  10           HA       ASP  10  -9.691   9.192   9.455
   79    HB2  ASP  10           1HB      ASP  10  -7.459   9.785   8.596
   80    HB3  ASP  10           2HB      ASP  10  -7.633   8.570   7.334
   81    H    VAL  11           H        VAL  11  -8.648   6.630   7.255
   82    HA   VAL  11           HA       VAL  11 -11.468   5.973   6.839
   83    HB   VAL  11           HB       VAL  11 -10.872   7.069   4.806
   84   HG11  VAL  11          1HG1      VAL  11  -8.436   5.300   4.684
   85   HG12  VAL  11          2HG1      VAL  11  -8.458   7.035   5.009
   86   HG13  VAL  11          3HG1      VAL  11  -8.950   6.427   3.428
   87   HG21  VAL  11          3HG2      VAL  11 -12.187   5.055   4.506
   88   HG22  VAL  11          1HG2      VAL  11 -10.720   4.085   4.390
   89   HG23  VAL  11          2HG2      VAL  11 -11.093   5.275   3.139
   90    H    LYS  12           H        LYS  12 -11.502   4.280   8.178
   91    HA   LYS  12           HA       LYS  12  -9.306   2.454   8.406
   92    HB2  LYS  12           1HB      LYS  12 -10.894   3.191  10.263
   93    HB3  LYS  12           2HB      LYS  12 -12.070   2.099   9.550
   94    HG2  LYS  12           1HG      LYS  12 -10.902   0.214  10.167
   95    HG3  LYS  12           2HG      LYS  12  -9.364   1.076  10.260
   96    HD2  LYS  12           1HD      LYS  12 -10.205   2.283  12.251
   97    HD3  LYS  12           2HD      LYS  12 -11.680   1.319  12.178
   98    HE2  LYS  12           1HE      LYS  12  -8.938   0.099  12.411
   99    HE3  LYS  12           2HE      LYS  12  -9.906   0.548  13.814
  100    HZ1  LYS  12           3HZ      LYS  12 -11.621  -0.963  13.099
  101    HZ2  LYS  12           1HZ      LYS  12 -10.149  -1.794  13.227
  102    HZ3  LYS  12           2HZ      LYS  12 -10.754  -1.364  11.700
  103    H    TRP  13           H        TRP  13  -9.225   0.313   7.780
  104    HA   TRP  13           HA       TRP  13 -10.537  -0.130   5.266
  105    HB2  TRP  13           1HB      TRP  13  -8.178  -1.091   6.604
  106    HB3  TRP  13           2HB      TRP  13  -9.122  -2.449   5.997
  107    HD1  TRP  13           HD1      TRP  13 -10.195  -1.179   3.323
  108    HE1  TRP  13           HE1      TRP  13  -8.590  -0.746   1.367
  109    HE3  TRP  13           HE3      TRP  13  -5.792  -1.083   5.906
  110    HZ2  TRP  13           HZ2      TRP  13  -5.821  -0.417   0.965
  111    HZ3  TRP  13           HZ3      TRP  13  -3.706  -0.709   4.660
  112    HH2  TRP  13           HH2      TRP  13  -3.719  -0.383   2.240
  113    H    GLU  14           H        GLU  14 -12.167  -1.440   4.811
  114    HA   GLU  14           HA       GLU  14 -13.752  -2.678   6.785
  115    HB2  GLU  14           1HB      GLU  14 -14.824  -3.836   4.848
  116    HB3  GLU  14           2HB      GLU  14 -14.729  -2.090   4.662
  117    HG2  GLU  14           1HG      GLU  14 -12.885  -2.283   3.153
  118    HG3  GLU  14           2HG      GLU  14 -12.757  -4.013   3.460
  119    H    LYS  15           H        LYS  15 -11.229  -3.819   4.645
  120    HA   LYS  15           HA       LYS  15 -11.009  -6.264   6.246
  121    HB2  LYS  15           1HB      LYS  15 -10.563  -6.076   3.255
  122    HB3  LYS  15           2HB      LYS  15 -10.418  -7.523   4.241
  123    HG2  LYS  15           1HG      LYS  15 -12.842  -7.335   4.768
  124    HG3  LYS  15           2HG      LYS  15 -12.939  -5.992   3.628
  125    HD2  LYS  15           1HD      LYS  15 -12.170  -7.471   1.831
  126    HD3  LYS  15           2HD      LYS  15 -12.077  -8.811   2.972
  127    HE2  LYS  15           1HE      LYS  15 -14.125  -9.116   1.885
  128    HE3  LYS  15           2HE      LYS  15 -14.552  -8.372   3.423
  129    HZ1  LYS  15           3HZ      LYS  15 -14.642  -6.205   2.235
  130    HZ2  LYS  15           1HZ      LYS  15 -15.785  -7.328   1.678
  131    HZ3  LYS  15           2HZ      LYS  15 -14.386  -7.034   0.775
  132    HA   PRO  16           HA       PRO  16  -7.136  -4.021   7.031
  133    HB2  PRO  16           1HB      PRO  16  -6.747  -6.665   8.375
  134    HB3  PRO  16           2HB      PRO  16  -6.387  -5.037   8.967
  135    HG2  PRO  16           1HG      PRO  16  -8.552  -6.319   9.810
  136    HG3  PRO  16           2HG      PRO  16  -8.611  -4.582   9.457
  137    HD2  PRO  16           1HD      PRO  16  -9.692  -6.873   7.889
  138    HD3  PRO  16           2HD      PRO  16 -10.318  -5.219   8.048
  139    H    VAL  17           H        VAL  17  -4.920  -4.339   6.526
  140    HA   VAL  17           HA       VAL  17  -4.455  -6.423   4.493
  141    HB   VAL  17           HB       VAL  17  -3.592  -3.532   4.282
  142   HG11  VAL  17          1HG1      VAL  17  -2.884  -4.141   2.012
  143   HG12  VAL  17          2HG1      VAL  17  -3.299  -5.824   2.342
  144   HG13  VAL  17          3HG1      VAL  17  -1.999  -5.041   3.242
  145   HG21  VAL  17          3HG2      VAL  17  -5.756  -5.062   2.853
  146   HG22  VAL  17          1HG2      VAL  17  -5.168  -3.471   2.359
  147   HG23  VAL  17          2HG2      VAL  17  -5.956  -3.675   3.923
  148    H    THR  18           H        THR  18  -2.661  -7.558   4.790
  149    HA   THR  18           HA       THR  18  -0.573  -6.502   6.582
  150    HB   THR  18           HB       THR  18  -0.973  -9.367   5.711
  151    HG1  THR  18           HG1      THR  18  -2.210  -7.857   7.725
  152   HG21  THR  18          3HG2      THR  18   0.536  -8.144   8.026
  153   HG22  THR  18          1HG2      THR  18   1.256  -8.830   6.571
  154   HG23  THR  18          2HG2      THR  18   0.380  -9.870   7.695
  155    H    ILE  19           H        ILE  19   1.324  -5.950   5.695
  156    HA   ILE  19           HA       ILE  19   1.967  -7.006   3.014
  157    HB   ILE  19           HB       ILE  19   1.430  -4.586   3.014
  158   HG12  ILE  19          1HG1      ILE  19   4.369  -5.067   2.504
  159   HG13  ILE  19          2HG1      ILE  19   3.086  -5.578   1.413
  160   HG21  ILE  19          1HG2      ILE  19   2.148  -4.035   5.264
  161   HG22  ILE  19          2HG2      ILE  19   2.955  -2.999   4.087
  162   HG23  ILE  19          3HG2      ILE  19   3.826  -4.345   4.823
  163   HD11  ILE  19          3HD1      ILE  19   3.714  -2.749   2.208
  164   HD12  ILE  19          1HD1      ILE  19   2.416  -3.250   1.123
  165   HD13  ILE  19          2HD1      ILE  19   4.101  -3.515   0.664
  166    H    SER  20           H        SER  20   4.073  -7.696   2.643
  167    HA   SER  20           HA       SER  20   5.773  -7.917   5.025
  168    HB2  SER  20           1HB      SER  20   5.196 -10.064   4.004
  169    HB3  SER  20           2HB      SER  20   5.826  -9.516   2.450
  170    HG   SER  20           HG       SER  20   7.880  -9.504   3.294
  171    H    LEU  21           H        LEU  21   7.686  -6.901   5.113
  172    HA   LEU  21           HA       LEU  21   8.607  -5.372   2.839
  173    HB2  LEU  21           1HB      LEU  21   9.629  -5.700   5.651
  174    HB3  LEU  21           2HB      LEU  21  10.550  -4.843   4.431
  175    HG   LEU  21           HG       LEU  21   8.520  -3.334   4.146
  176   HD11  LEU  21          1HD1      LEU  21   6.983  -3.200   6.034
  177   HD12  LEU  21          2HD1      LEU  21   7.730  -4.633   6.744
  178   HD13  LEU  21          3HD1      LEU  21   6.866  -4.756   5.209
  179   HD21  LEU  21          3HD2      LEU  21  10.539  -2.623   5.302
  180   HD22  LEU  21          1HD2      LEU  21   9.948  -3.343   6.800
  181   HD23  LEU  21          2HD2      LEU  21   9.101  -1.968   6.086
  182    H    GLN  22           H        GLN  22  11.182  -5.495   2.594
  183    HA   GLN  22           HA       GLN  22  11.625  -7.820   1.114
  184    HB2  GLN  22           1HB      GLN  22  12.764  -5.693   0.670
  185    HB3  GLN  22           2HB      GLN  22  13.660  -5.851   2.174
  186    HG2  GLN  22           1HG      GLN  22  14.585  -8.009   1.247
  187    HG3  GLN  22           2HG      GLN  22  13.884  -7.537  -0.299
  188   HE21  GLN  22          2HE2      GLN  22  16.663  -7.951   0.509
  189   HE22  GLN  22          1HE2      GLN  22  17.490  -6.475   0.123
  190    H    ASN  23           H        ASN  23  12.324  -7.127   4.457
  191    HA   ASN  23           HA       ASN  23  14.151  -9.395   4.651
  192    HB2  ASN  23           1HB      ASN  23  14.744  -7.229   5.719
  193    HB3  ASN  23           2HB      ASN  23  13.338  -7.382   6.766
  194   HD21  ASN  23          2HD2      ASN  23  13.474  -8.603   8.568
  195   HD22  ASN  23          1HD2      ASN  23  14.900  -9.456   9.067
  196    H    GLY  24           H        GLY  24  10.935  -9.040   4.648
  197    HA2  GLY  24           1HA      GLY  24   9.320 -10.622   5.176
  198    HA3  GLY  24           2HA      GLY  24  10.523 -11.505   6.106
  199    H    ALA  25           H        ALA  25   8.583  -8.553   6.162
  200    HA   ALA  25           HA       ALA  25   8.159  -8.954   9.028
  201    HB1  ALA  25           3HB      ALA  25   9.956  -7.306   8.822
  202    HB2  ALA  25           1HB      ALA  25   8.488  -6.576   9.475
  203    HB3  ALA  25           2HB      ALA  25   8.928  -6.315   7.786
  204    HA   PRO  26           HA       PRO  26   4.084  -8.278   7.238
  205    HB2  PRO  26           1HB      PRO  26   3.078  -9.249   9.787
  206    HB3  PRO  26           2HB      PRO  26   2.951  -9.984   8.189
  207    HG2  PRO  26           1HG      PRO  26   4.474 -11.029  10.175
  208    HG3  PRO  26           2HG      PRO  26   4.871 -11.210   8.457
  209    HD2  PRO  26           1HD      PRO  26   6.005  -9.302  10.475
  210    HD3  PRO  26           2HD      PRO  26   6.842 -10.238   9.215
  211    H    ARG  27           H        ARG  27   3.724  -6.139   7.204
  212    HA   ARG  27           HA       ARG  27   3.059  -4.803   9.732
  213    HB2  ARG  27           1HB      ARG  27   3.544  -3.700   6.964
  214    HB3  ARG  27           2HB      ARG  27   2.930  -2.728   8.294
  215    HG2  ARG  27           1HG      ARG  27   5.014  -3.433   9.566
  216    HG3  ARG  27           2HG      ARG  27   5.620  -4.018   8.015
  217    HD2  ARG  27           1HD      ARG  27   5.339  -1.783   7.063
  218    HD3  ARG  27           2HD      ARG  27   4.731  -1.200   8.613
  219    HE   ARG  27           HE       ARG  27   7.413  -2.368   8.498
  220   HH11  ARG  27          1HH1      ARG  27   5.354   0.438   8.928
  221   HH12  ARG  27          2HH1      ARG  27   6.645   1.436   9.537
  222   HH21  ARG  27          1HH2      ARG  27   9.104  -1.053   9.291
  223   HH22  ARG  27          2HH2      ARG  27   8.763   0.594   9.738
  224    H    ILE  28           H        ILE  28   1.007  -4.656  10.314
  225    HA   ILE  28           HA       ILE  28  -1.033  -5.193   8.257
  226    HB   ILE  28           HB       ILE  28  -1.285  -5.483  11.260
  227   HG12  ILE  28          1HG1      ILE  28  -0.924  -7.603   9.128
  228   HG13  ILE  28          2HG1      ILE  28   0.296  -7.115  10.299
  229   HG21  ILE  28          1HG2      ILE  28  -3.360  -6.680  10.734
  230   HG22  ILE  28          2HG2      ILE  28  -3.124  -6.327   9.021
  231   HG23  ILE  28          3HG2      ILE  28  -3.402  -5.011  10.163
  232   HD11  ILE  28          3HD1      ILE  28  -1.125  -7.927  12.108
  233   HD12  ILE  28          1HD1      ILE  28  -0.759  -9.196  10.941
  234   HD13  ILE  28          2HD1      ILE  28  -2.340  -8.418  10.928
  235    H    PHE  29           H        PHE  29  -2.327  -3.599   7.698
  236    HA   PHE  29           HA       PHE  29  -2.299  -1.148   9.311
  237    HB2  PHE  29           1HB      PHE  29  -3.266  -1.488   6.466
  238    HB3  PHE  29           2HB      PHE  29  -2.956   0.024   7.310
  239    HD1  PHE  29           HD2      PHE  29  -0.443   0.142   8.296
  240    HD2  PHE  29           HD1      PHE  29  -1.709  -2.144   4.934
  241    HE1  PHE  29           HE2      PHE  29   1.861   0.139   7.433
  242    HE2  PHE  29           HE1      PHE  29   0.590  -2.151   4.072
  243    HZ   PHE  29           HZ       PHE  29   2.380  -1.009   5.317
  244    H    ASN  30           H        ASN  30  -4.121  -0.334  10.183
  245    HA   ASN  30           HA       ASN  30  -6.485  -2.017  10.171
  246    HB2  ASN  30           1HB      ASN  30  -6.031   0.638  11.561
  247    HB3  ASN  30           2HB      ASN  30  -7.356  -0.481  11.858
  248   HD21  ASN  30          2HD2      ASN  30  -3.997   0.185  12.338
  249   HD22  ASN  30          1HD2      ASN  30  -3.713  -1.045  13.527
  250    H    GLY  31           H        GLY  31  -5.266   0.696   8.529
  251    HA2  GLY  31           1HA      GLY  31  -7.710   0.955   7.022
  252    HA3  GLY  31           2HA      GLY  31  -7.313   2.363   7.993
  253    H    VAL  32           H        VAL  32  -7.475   2.969   5.553
  254    HA   VAL  32           HA       VAL  32  -5.367   2.371   3.796
  255    HB   VAL  32           HB       VAL  32  -7.125   4.823   3.781
  256   HG11  VAL  32          1HG1      VAL  32  -6.610   4.894   1.393
  257   HG12  VAL  32          2HG1      VAL  32  -5.539   3.507   1.579
  258   HG13  VAL  32          3HG1      VAL  32  -5.147   5.037   2.365
  259   HG21  VAL  32          3HG2      VAL  32  -8.530   3.565   2.213
  260   HG22  VAL  32          1HG2      VAL  32  -8.459   2.780   3.791
  261   HG23  VAL  32          2HG2      VAL  32  -7.510   2.144   2.444
  262    H    TYR  33           H        TYR  33  -5.789   4.896   6.189
  263    HA   TYR  33           HA       TYR  33  -3.858   6.676   5.223
  264    HB2  TYR  33           1HB      TYR  33  -5.611   7.225   6.919
  265    HB3  TYR  33           2HB      TYR  33  -4.683   6.319   8.112
  266    HD1  TYR  33           HD2      TYR  33  -4.593   9.263   5.869
  267    HD2  TYR  33           HD1      TYR  33  -2.847   7.305   9.216
  268    HE1  TYR  33           HE2      TYR  33  -3.264  11.278   6.343
  269    HE2  TYR  33           HE1      TYR  33  -1.509   9.309   9.701
  270    HH   TYR  33           HH       TYR  33  -0.643  11.280   8.477
  271    H    GLU  34           H        GLU  34  -3.547   3.978   7.536
  272    HA   GLU  34           HA       GLU  34  -0.853   4.481   8.228
  273    HB2  GLU  34           1HB      GLU  34  -2.418   1.899   8.167
  274    HB3  GLU  34           2HB      GLU  34  -0.800   2.046   8.831
  275    HG2  GLU  34           1HG      GLU  34  -1.604   3.595  10.511
  276    HG3  GLU  34           2HG      GLU  34  -3.229   3.515   9.826
  277    H    ALA  35           H        ALA  35  -2.364   2.665   5.614
  278    HA   ALA  35           HA       ALA  35  -0.022   1.521   4.529
  279    HB1  ALA  35           3HB      ALA  35  -2.283   0.751   3.969
  280    HB2  ALA  35           1HB      ALA  35  -1.355   1.151   2.522
  281    HB3  ALA  35           2HB      ALA  35  -2.586   2.266   3.119
  282    H    PHE  36           H        PHE  36  -1.732   4.528   3.904
  283    HA   PHE  36           HA       PHE  36  -0.154   5.480   1.780
  284    HB2  PHE  36           1HB      PHE  36  -2.370   6.396   2.355
  285    HB3  PHE  36           2HB      PHE  36  -1.716   7.039   3.856
  286    HD1  PHE  36           HD1      PHE  36  -1.304   7.241   0.166
  287    HD2  PHE  36           HD2      PHE  36  -0.874   9.199   3.922
  288    HE1  PHE  36           HE1      PHE  36  -0.729   9.332  -0.994
  289    HE2  PHE  36           HE2      PHE  36  -0.295  11.294   2.766
  290    HZ   PHE  36           HZ       PHE  36  -0.223  11.362   0.307
  291    H    ASP  37           H        ASP  37   0.059   5.921   5.274
  292    HA   ASP  37           HA       ASP  37   2.263   7.690   5.250
  293    HB2  ASP  37           1HB      ASP  37   0.822   7.482   7.206
  294    HB3  ASP  37           2HB      ASP  37   1.297   5.799   7.405
  295    H    PHE  38           H        PHE  38   2.018   4.156   5.515
  296    HA   PHE  38           HA       PHE  38   4.751   3.586   5.811
  297    HB2  PHE  38           1HB      PHE  38   3.040   1.871   6.129
  298    HB3  PHE  38           2HB      PHE  38   2.586   1.981   4.432
  299    HD1  PHE  38           HD1      PHE  38   5.684   1.416   6.446
  300    HD2  PHE  38           HD2      PHE  38   3.349   0.302   3.065
  301    HE1  PHE  38           HE1      PHE  38   7.309  -0.348   5.905
  302    HE2  PHE  38           HE2      PHE  38   4.973  -1.461   2.522
  303    HZ   PHE  38           HZ       PHE  38   6.956  -1.787   3.942
  304    H    LEU  39           H        LEU  39   2.761   3.954   2.893
  305    HA   LEU  39           HA       LEU  39   4.642   3.372   0.941
  306    HB2  LEU  39           1HB      LEU  39   2.425   5.415   0.894
  307    HB3  LEU  39           2HB      LEU  39   3.323   4.907  -0.522
  308    HG   LEU  39           HG       LEU  39   1.663   3.052   1.183
  309   HD11  LEU  39          1HD1      LEU  39   0.040   3.134  -0.648
  310   HD12  LEU  39          2HD1      LEU  39   1.009   4.372  -1.446
  311   HD13  LEU  39          3HD1      LEU  39   0.251   4.713   0.109
  312   HD21  LEU  39          3HD2      LEU  39   1.911   1.527  -0.716
  313   HD22  LEU  39          1HD2      LEU  39   3.473   1.949  -0.014
  314   HD23  LEU  39          2HD2      LEU  39   2.951   2.703  -1.521
  315    H    GLN  40           H        GLN  40   4.268   6.288   2.832
  316    HA   GLN  40           HA       GLN  40   6.239   7.719   1.261
  317    HB2  GLN  40           1HB      GLN  40   4.792   8.450   3.812
  318    HB3  GLN  40           2HB      GLN  40   5.894   9.516   2.953
  319    HG2  GLN  40           1HG      GLN  40   4.418   9.506   1.023
  320    HG3  GLN  40           2HG      GLN  40   3.325   8.401   1.855
  321   HE21  GLN  40          2HE2      GLN  40   2.968  11.156   0.818
  322   HE22  GLN  40          1HE2      GLN  40   2.369  12.069   2.161
  323    H    HIS  41           H        HIS  41   6.054   5.924   4.235
  324    HA   HIS  41           HA       HIS  41   8.577   6.977   5.189
  325    HB2  HIS  41           1HB      HIS  41   6.546   5.100   6.368
  326    HB3  HIS  41           2HB      HIS  41   8.121   5.341   7.114
  327    HD1  HIS  41           HD1      HIS  41   6.955   6.360   9.208
  328    HD2  HIS  41           HD2      HIS  41   6.344   8.487   5.687
  329    HE1  HIS  41           HE1      HIS  41   6.026   8.589   9.912
  330    HE2  HIS  41           HE2      HIS  41   5.426   9.739   7.755
  331    H    GLU  42           H        GLU  42   7.637   3.586   5.467
  332    HA   GLU  42           HA       GLU  42  10.411   2.967   4.784
  333    HB2  GLU  42           1HB      GLU  42   8.348   1.613   6.484
  334    HB3  GLU  42           2HB      GLU  42   9.721   0.704   5.875
  335    HG2  GLU  42           1HG      GLU  42  10.131   1.495   8.124
  336    HG3  GLU  42           2HG      GLU  42  11.248   2.242   6.985
  337    H    TRP  43           H        TRP  43   8.133   3.304   2.800
  338    HA   TRP  43           HA       TRP  43   7.836   0.698   1.630
  339    HB2  TRP  43           1HB      TRP  43   6.182   2.456   1.219
  340    HB3  TRP  43           2HB      TRP  43   7.414   3.453   0.457
  341    HD1  TRP  43           HD1      TRP  43   7.939   3.029  -2.054
  342    HE1  TRP  43           HE1      TRP  43   6.898   1.525  -3.863
  343    HE3  TRP  43           HE3      TRP  43   5.053   0.047   0.937
  344    HZ2  TRP  43           HZ2      TRP  43   5.085  -0.643  -4.000
  345    HZ3  TRP  43           HZ3      TRP  43   3.699  -1.713  -0.114
  346    HH2  TRP  43           HH2      TRP  43   3.714  -2.052  -2.530
  347    HA   PRO  44           HA       PRO  44  11.994   1.069  -0.007
  348    HB2  PRO  44           1HB      PRO  44  12.581  -1.527  -0.007
  349    HB3  PRO  44           2HB      PRO  44  12.379  -0.640   1.509
  350    HG2  PRO  44           1HG      PRO  44  10.542  -2.566   0.185
  351    HG3  PRO  44           2HG      PRO  44  10.792  -2.252   1.909
  352    HD2  PRO  44           1HD      PRO  44   8.719  -1.223   0.263
  353    HD3  PRO  44           2HD      PRO  44   9.087  -0.764   1.937
  354    H    ALA  45           H        ALA  45   9.281   0.051  -1.637
  355    HA   ALA  45           HA       ALA  45  10.611  -1.278  -3.830
  356    HB1  ALA  45           3HB      ALA  45   8.381  -1.998  -3.143
  357    HB2  ALA  45           1HB      ALA  45   8.402  -1.465  -4.824
  358    HB3  ALA  45           2HB      ALA  45   7.737  -0.415  -3.573
  359    H    ARG  46           H        ARG  46  11.828  -0.059  -5.066
  360    HA   ARG  46           HA       ARG  46  11.175   2.670  -5.699
  361    HB2  ARG  46           1HB      ARG  46  13.368   0.839  -6.692
  362    HB3  ARG  46           2HB      ARG  46  13.242   2.551  -7.081
  363    HG2  ARG  46           1HG      ARG  46  13.568   3.163  -4.792
  364    HG3  ARG  46           2HG      ARG  46  13.483   1.476  -4.282
  365    HD2  ARG  46           1HD      ARG  46  15.591   2.660  -6.084
  366    HD3  ARG  46           2HD      ARG  46  15.792   2.314  -4.367
  367    HE   ARG  46           HE       ARG  46  15.417   0.292  -6.481
  368   HH11  ARG  46          1HH1      ARG  46  16.495   1.207  -3.276
  369   HH12  ARG  46          2HH1      ARG  46  17.265  -0.322  -2.959
  370   HH21  ARG  46          1HH2      ARG  46  16.412  -1.703  -6.082
  371   HH22  ARG  46          2HH2      ARG  46  17.232  -1.983  -4.571
  372    H    GLY  47           H        GLY  47  10.832   3.466  -7.846
  373    HA2  GLY  47           1HA      GLY  47  10.473   2.213 -10.201
  374    HA3  GLY  47           2HA      GLY  47   9.032   1.721  -9.318
  375    H    ASP  48           H        ASP  48   8.975   4.245  -7.838
  376    HA   ASP  48           HA       ASP  48   8.333   6.406  -7.914
  377    HB2  ASP  48           1HB      ASP  48  10.098   6.345  -9.950
  378    HB3  ASP  48           2HB      ASP  48   8.634   6.774 -10.832
  379    H    ARG  49           H        ARG  49   7.290   5.285 -11.161
  380    HA   ARG  49           HA       ARG  49   4.782   6.544 -10.958
  381    HB2  ARG  49           1HB      ARG  49   5.789   4.358 -12.761
  382    HB3  ARG  49           2HB      ARG  49   4.137   4.953 -12.859
  383    HG2  ARG  49           1HG      ARG  49   5.034   7.231 -13.232
  384    HG3  ARG  49           2HG      ARG  49   6.656   6.538 -13.277
  385    HD2  ARG  49           1HD      ARG  49   4.397   5.754 -15.110
  386    HD3  ARG  49           2HD      ARG  49   5.672   6.898 -15.522
  387    HE   ARG  49           HE       ARG  49   7.071   4.709 -14.820
  388   HH11  ARG  49          1HH1      ARG  49   4.332   5.131 -16.972
  389   HH12  ARG  49          2HH1      ARG  49   4.832   3.877 -18.059
  390   HH21  ARG  49          1HH2      ARG  49   7.731   3.053 -16.264
  391   HH22  ARG  49          2HH2      ARG  49   6.763   2.715 -17.675
  392    H    ALA  50           H        ALA  50   5.618   3.091 -10.605
  393    HA   ALA  50           HA       ALA  50   3.087   2.186  -9.842
  394    HB1  ALA  50           3HB      ALA  50   5.768   1.137  -8.929
  395    HB2  ALA  50           1HB      ALA  50   4.935   0.681 -10.415
  396    HB3  ALA  50           2HB      ALA  50   4.234   0.268  -8.849
  397    H    HIS  51           H        HIS  51   5.594   3.786  -8.012
  398    HA   HIS  51           HA       HIS  51   4.476   3.373  -5.436
  399    HB2  HIS  51           1HB      HIS  51   6.811   3.989  -5.670
  400    HB3  HIS  51           2HB      HIS  51   6.375   5.495  -6.467
  401    HD1  HIS  51           HD1      HIS  51   6.457   7.460  -4.984
  402    HD2  HIS  51           HD2      HIS  51   5.696   3.961  -2.868
  403    HE1  HIS  51           HE1      HIS  51   6.348   8.138  -2.561
  404    HE2  HIS  51           HE2      HIS  51   6.136   5.968  -1.296
  405    H    GLU  52           H        GLU  52   4.279   6.045  -7.778
  406    HA   GLU  52           HA       GLU  52   2.650   7.724  -6.209
  407    HB2  GLU  52           1HB      GLU  52   2.963   7.542  -9.205
  408    HB3  GLU  52           2HB      GLU  52   2.027   8.794  -8.400
  409    HG2  GLU  52           1HG      GLU  52   4.139   9.375  -7.140
  410    HG3  GLU  52           2HG      GLU  52   4.986   8.313  -8.265
  411    H    GLN  53           H        GLN  53   1.844   5.137  -8.474
  412    HA   GLN  53           HA       GLN  53  -0.909   5.561  -8.643
  413    HB2  GLN  53           1HB      GLN  53   0.627   2.959  -8.683
  414    HB3  GLN  53           2HB      GLN  53  -1.072   3.110  -9.112
  415    HG2  GLN  53           1HG      GLN  53  -0.410   4.696 -10.908
  416    HG3  GLN  53           2HG      GLN  53   1.275   4.348 -10.523
  417   HE21  GLN  53          2HE2      GLN  53  -0.210   3.901 -12.990
  418   HE22  GLN  53          1HE2      GLN  53  -0.089   2.203 -13.315
  419    H    ALA  54           H        ALA  54   0.962   3.691  -6.280
  420    HA   ALA  54           HA       ALA  54  -1.199   2.726  -4.777
  421    HB1  ALA  54           3HB      ALA  54   1.082   1.864  -4.576
  422    HB2  ALA  54           1HB      ALA  54   0.427   2.333  -3.008
  423    HB3  ALA  54           2HB      ALA  54   1.587   3.376  -3.827
  424    H    LEU  55           H        LEU  55   0.641   5.741  -4.537
  425    HA   LEU  55           HA       LEU  55  -0.638   6.683  -2.188
  426    HB2  LEU  55           1HB      LEU  55   1.031   7.934  -4.319
  427    HB3  LEU  55           2HB      LEU  55   0.114   8.982  -3.256
  428    HG   LEU  55           HG       LEU  55   1.251   7.924  -1.305
  429   HD11  LEU  55          1HD1      LEU  55   3.270   6.623  -1.679
  430   HD12  LEU  55          2HD1      LEU  55   2.962   6.631  -3.415
  431   HD13  LEU  55          3HD1      LEU  55   1.849   5.801  -2.327
  432   HD21  LEU  55          3HD2      LEU  55   3.366   9.079  -1.622
  433   HD22  LEU  55          1HD2      LEU  55   2.021  10.039  -2.234
  434   HD23  LEU  55          2HD2      LEU  55   3.067   9.172  -3.359
  435    H    ARG  56           H        ARG  56  -1.279   7.146  -5.637
  436    HA   ARG  56           HA       ARG  56  -3.372   8.984  -5.432
  437    HB2  ARG  56           1HB      ARG  56  -2.347   8.481  -7.557
  438    HB3  ARG  56           2HB      ARG  56  -2.859   6.804  -7.458
  439    HG2  ARG  56           1HG      ARG  56  -4.203   8.111  -9.035
  440    HG3  ARG  56           2HG      ARG  56  -5.172   7.455  -7.716
  441    HD2  ARG  56           1HD      ARG  56  -5.221   9.592  -6.620
  442    HD3  ARG  56           2HD      ARG  56  -4.086  10.266  -7.791
  443    HE   ARG  56           HE       ARG  56  -5.814  10.121  -9.462
  444   HH11  ARG  56          1HH1      ARG  56  -6.869   9.624  -6.163
  445   HH12  ARG  56          2HH1      ARG  56  -8.527  10.032  -6.489
  446   HH21  ARG  56          1HH2      ARG  56  -7.999  10.643  -9.907
  447   HH22  ARG  56          2HH2      ARG  56  -9.168  10.621  -8.615
  448    H    LEU  57           H        LEU  57  -3.400   5.457  -5.302
  449    HA   LEU  57           HA       LEU  57  -6.198   5.118  -5.171
  450    HB2  LEU  57           1HB      LEU  57  -4.010   3.369  -4.040
  451    HB3  LEU  57           2HB      LEU  57  -5.671   2.877  -4.316
  452    HG   LEU  57           HG       LEU  57  -3.838   3.792  -6.528
  453   HD11  LEU  57          1HD1      LEU  57  -4.431   0.979  -5.620
  454   HD12  LEU  57          2HD1      LEU  57  -2.888   1.817  -5.468
  455   HD13  LEU  57          3HD1      LEU  57  -3.527   1.433  -7.065
  456   HD21  LEU  57          3HD2      LEU  57  -5.472   2.667  -7.960
  457   HD22  LEU  57          1HD2      LEU  57  -6.224   3.953  -7.014
  458   HD23  LEU  57          2HD2      LEU  57  -6.444   2.267  -6.544
  459    H    CYS  58           H        CYS  58  -3.721   5.433  -2.664
  460    HA   CYS  58           HA       CYS  58  -5.490   5.119  -0.476
  461    HB2  CYS  58           1HB      CYS  58  -2.794   6.478  -0.620
  462    HB3  CYS  58           2HB      CYS  58  -3.628   6.030   0.866
  463    HG   CYS  58           HG       CYS  58  -2.182   3.987  -1.446
  464    H    ARG  59           H        ARG  59  -4.215   7.958  -2.172
  465    HA   ARG  59           HA       ARG  59  -5.374   9.914  -0.517
  466    HB2  ARG  59           1HB      ARG  59  -3.602  10.445  -2.097
  467    HB3  ARG  59           2HB      ARG  59  -4.643  10.027  -3.450
  468    HG2  ARG  59           1HG      ARG  59  -6.062  11.911  -3.016
  469    HG3  ARG  59           2HG      ARG  59  -5.190  12.275  -1.524
  470    HD2  ARG  59           1HD      ARG  59  -3.951  12.298  -4.274
  471    HD3  ARG  59           2HD      ARG  59  -4.555  13.731  -3.442
  472    HE   ARG  59           HE       ARG  59  -2.853  12.798  -1.626
  473   HH11  ARG  59          1HH1      ARG  59  -2.444  13.174  -5.093
  474   HH12  ARG  59          2HH1      ARG  59  -0.726  13.425  -4.988
  475   HH21  ARG  59          1HH2      ARG  59  -0.603  13.141  -1.491
  476   HH22  ARG  59          2HH2      ARG  59   0.320  13.427  -2.938
  477    H    ALA  60           H        ALA  60  -6.604   8.187  -3.335
  478    HA   ALA  60           HA       ALA  60  -9.018   9.614  -3.633
  479    HB1  ALA  60           3HB      ALA  60  -8.451   6.722  -4.285
  480    HB2  ALA  60           1HB      ALA  60  -8.132   8.097  -5.345
  481    HB3  ALA  60           2HB      ALA  60  -9.789   7.686  -4.907
  482    H    SER  61           H        SER  61  -8.091   6.893  -1.617
  483    HA   SER  61           HA       SER  61 -10.702   6.354  -0.623
  484    HB2  SER  61           1HB      SER  61  -8.026   5.678   0.611
  485    HB3  SER  61           2HB      SER  61  -9.572   4.925   0.995
  486    HG   SER  61           HG       SER  61  -8.093   4.766  -1.421
  487    H    LEU  62           H        LEU  62  -8.017   8.381   0.394
  488    HA   LEU  62           HA       LEU  62  -9.078   9.158   2.902
  489    HB2  LEU  62           1HB      LEU  62  -7.167  10.612   1.067
  490    HB3  LEU  62           2HB      LEU  62  -7.496  11.063   2.728
  491    HG   LEU  62           HG       LEU  62  -6.263   8.442   1.872
  492   HD11  LEU  62          1HD1      LEU  62  -4.770  10.308   1.422
  493   HD12  LEU  62          2HD1      LEU  62  -4.185   9.347   2.780
  494   HD13  LEU  62          3HD1      LEU  62  -4.983  10.892   3.072
  495   HD21  LEU  62          3HD2      LEU  62  -7.505   8.288   3.971
  496   HD22  LEU  62          1HD2      LEU  62  -6.614   9.671   4.608
  497   HD23  LEU  62          2HD2      LEU  62  -5.768   8.166   4.247
  498    H    MET  63           H        MET  63  -9.626  10.217  -0.374
  499    HA   MET  63           HA       MET  63 -11.112  12.562   0.250
  500    HB2  MET  63           1HB      MET  63 -11.269  10.754  -2.175
  501    HB3  MET  63           2HB      MET  63 -12.036  12.330  -2.046
  502    HG2  MET  63           1HG      MET  63  -9.853  13.387  -1.838
  503    HG3  MET  63           2HG      MET  63  -9.073  11.810  -1.925
  504    HE1  MET  63           3HE      MET  63 -11.126  14.531  -3.845
  505    HE2  MET  63           1HE      MET  63 -12.180  13.126  -3.973
  506    HE3  MET  63           2HE      MET  63 -11.384  13.764  -5.410
  507    H    GLY  64           H        GLY  64 -11.792   9.176   0.230
  508    HA2  GLY  64           1HA      GLY  64 -13.481   8.252   1.594
  509    HA3  GLY  64           2HA      GLY  64 -14.382   9.752   1.452
  510    H    ASP  65           H        ASP  65 -13.238   8.772  -1.576
  511    HA   ASP  65           HA       ASP  65 -15.962   7.838  -2.195
  512    HB2  ASP  65           1HB      ASP  65 -15.058   9.976  -3.262
  513    HB3  ASP  65           2HB      ASP  65 -13.980   8.938  -4.191
  514    H    VAL  66           H        VAL  66 -13.640   6.225  -1.246
  515    HA   VAL  66           HA       VAL  66 -13.737   4.217  -3.389
  516    HB   VAL  66           HB       VAL  66 -11.285   4.978  -1.784
  517   HG11  VAL  66          1HG1      VAL  66 -10.135   3.151  -2.946
  518   HG12  VAL  66          2HG1      VAL  66 -11.664   2.653  -3.669
  519   HG13  VAL  66          3HG1      VAL  66 -11.438   2.549  -1.922
  520   HG21  VAL  66          3HG2      VAL  66 -11.691   6.377  -3.738
  521   HG22  VAL  66          1HG2      VAL  66 -11.805   4.937  -4.751
  522   HG23  VAL  66          2HG2      VAL  66 -10.274   5.350  -3.978
  523    H    ALA  67           H        ALA  67 -14.333   2.252  -2.719
  524    HA   ALA  67           HA       ALA  67 -14.869   1.735   0.051
  525    HB1  ALA  67           3HB      ALA  67 -16.309   0.824  -1.708
  526    HB2  ALA  67           1HB      ALA  67 -15.619  -0.459  -0.714
  527    HB3  ALA  67           2HB      ALA  67 -14.959  -0.135  -2.316
  528    H    GLY  68           H        GLY  68 -13.886   0.080   1.317
  529    HA2  GLY  68           1HA      GLY  68 -11.119   0.376   1.422
  530    HA3  GLY  68           2HA      GLY  68 -12.039  -0.823   2.314
  531    H    GLU  69           H        GLU  69 -12.977  -2.480   0.340
  532    HA   GLU  69           HA       GLU  69 -10.669  -4.065  -0.058
  533    HB2  GLU  69           1HB      GLU  69 -12.869  -5.044   0.274
  534    HB3  GLU  69           2HB      GLU  69 -13.426  -4.358  -1.247
  535    HG2  GLU  69           1HG      GLU  69 -12.314  -5.884  -2.509
  536    HG3  GLU  69           2HG      GLU  69 -11.036  -6.107  -1.314
  537    H    ILE  70           H        ILE  70 -12.240  -1.723  -2.106
  538    HA   ILE  70           HA       ILE  70 -11.136  -2.512  -4.580
  539    HB   ILE  70           HB       ILE  70 -11.786   0.289  -3.628
  540   HG12  ILE  70          1HG1      ILE  70 -13.424  -1.696  -5.220
  541   HG13  ILE  70          2HG1      ILE  70 -13.715  -1.230  -3.548
  542   HG21  ILE  70          1HG2      ILE  70 -11.905   0.848  -6.017
  543   HG22  ILE  70          2HG2      ILE  70 -11.366  -0.782  -6.418
  544   HG23  ILE  70          3HG2      ILE  70 -10.290   0.313  -5.550
  545   HD11  ILE  70          3HD1      ILE  70 -13.894   0.579  -5.947
  546   HD12  ILE  70          1HD1      ILE  70 -14.177   1.057  -4.272
  547   HD13  ILE  70          2HD1      ILE  70 -15.251  -0.107  -5.049
  548    H    ALA  71           H        ALA  71 -10.031  -0.102  -2.211
  549    HA   ALA  71           HA       ALA  71  -7.496   0.345  -3.320
  550    HB1  ALA  71           3HB      ALA  71  -8.338   0.539  -0.429
  551    HB2  ALA  71           1HB      ALA  71  -8.519   1.807  -1.643
  552    HB3  ALA  71           2HB      ALA  71  -6.909   1.281  -1.148
  553    H    ARG  72           H        ARG  72  -8.652  -2.111  -1.051
  554    HA   ARG  72           HA       ARG  72  -6.170  -3.104  -0.212
  555    HB2  ARG  72           1HB      ARG  72  -8.280  -3.734   0.883
  556    HB3  ARG  72           2HB      ARG  72  -8.761  -4.635  -0.551
  557    HG2  ARG  72           1HG      ARG  72  -6.929  -6.175  -0.248
  558    HG3  ARG  72           2HG      ARG  72  -6.327  -5.239   1.115
  559    HD2  ARG  72           1HD      ARG  72  -7.460  -6.970   2.150
  560    HD3  ARG  72           2HD      ARG  72  -8.653  -5.677   2.148
  561    HE   ARG  72           HE       ARG  72  -9.839  -6.820   0.438
  562   HH11  ARG  72          1HH1      ARG  72  -7.093  -8.593   1.683
  563   HH12  ARG  72          2HH1      ARG  72  -7.646 -10.131   1.098
  564   HH21  ARG  72          1HH2      ARG  72 -10.620  -8.859  -0.293
  565   HH22  ARG  72          2HH2      ARG  72  -9.654 -10.287  -0.007
  566    H    THR  73           H        THR  73  -8.237  -4.129  -2.905
  567    HA   THR  73           HA       THR  73  -6.640  -6.273  -3.764
  568    HB   THR  73           HB       THR  73  -8.421  -4.583  -5.532
  569    HG1  THR  73           HG1      THR  73  -9.675  -5.193  -3.781
  570   HG21  THR  73          3HG2      THR  73  -8.742  -6.677  -6.755
  571   HG22  THR  73          1HG2      THR  73  -7.655  -7.505  -5.638
  572   HG23  THR  73          2HG2      THR  73  -7.034  -6.239  -6.699
  573    H    ALA  74           H        ALA  74  -6.729  -2.875  -4.751
  574    HA   ALA  74           HA       ALA  74  -4.788  -3.142  -6.805
  575    HB1  ALA  74           3HB      ALA  74  -5.681  -0.673  -5.330
  576    HB2  ALA  74           1HB      ALA  74  -6.434  -1.342  -6.777
  577    HB3  ALA  74           2HB      ALA  74  -4.789  -0.711  -6.851
  578    H    PHE  75           H        PHE  75  -4.591  -2.592  -3.368
  579    HA   PHE  75           HA       PHE  75  -1.916  -1.630  -3.315
  580    HB2  PHE  75           1HB      PHE  75  -3.658  -1.463  -1.447
  581    HB3  PHE  75           2HB      PHE  75  -3.271  -3.141  -1.076
  582    HD1  PHE  75           HD2      PHE  75  -1.834   0.257  -1.329
  583    HD2  PHE  75           HD1      PHE  75  -1.385  -3.684   0.218
  584    HE1  PHE  75           HE2      PHE  75   0.052   1.020   0.050
  585    HE2  PHE  75           HE1      PHE  75   0.506  -2.925   1.601
  586    HZ   PHE  75           HZ       PHE  75   1.226  -0.569   1.518
  587    H    VAL  76           H        VAL  76  -3.386  -4.816  -3.253
  588    HA   VAL  76           HA       VAL  76  -1.010  -6.287  -2.763
  589    HB   VAL  76           HB       VAL  76  -3.510  -7.157  -4.234
  590   HG11  VAL  76          1HG1      VAL  76  -1.326  -8.809  -2.965
  591   HG12  VAL  76          2HG1      VAL  76  -1.628  -8.638  -4.694
  592   HG13  VAL  76          3HG1      VAL  76  -2.817  -9.438  -3.666
  593   HG21  VAL  76          3HG2      VAL  76  -4.179  -8.147  -2.093
  594   HG22  VAL  76          1HG2      VAL  76  -4.009  -6.395  -1.982
  595   HG23  VAL  76          2HG2      VAL  76  -2.751  -7.446  -1.331
  596    H    ALA  77           H        ALA  77  -2.583  -5.055  -5.661
  597    HA   ALA  77           HA       ALA  77  -0.870  -6.270  -7.550
  598    HB1  ALA  77           3HB      ALA  77  -2.354  -3.652  -7.770
  599    HB2  ALA  77           1HB      ALA  77  -3.007  -5.244  -8.159
  600    HB3  ALA  77           2HB      ALA  77  -1.679  -4.580  -9.109
  601    H    ALA  78           H        ALA  78  -0.650  -3.257  -5.731
  602    HA   ALA  78           HA       ALA  78   1.641  -2.233  -7.038
  603    HB1  ALA  78           3HB      ALA  78   0.140  -0.829  -5.716
  604    HB2  ALA  78           1HB      ALA  78   1.807  -0.699  -5.153
  605    HB3  ALA  78           2HB      ALA  78   0.643  -1.668  -4.249
  606    H    SER  79           H        SER  79   1.228  -4.237  -4.140
  607    HA   SER  79           HA       SER  79   3.999  -4.208  -3.465
  608    HB2  SER  79           1HB      SER  79   3.245  -6.229  -2.012
  609    HB3  SER  79           2HB      SER  79   2.604  -4.628  -1.644
  610    HG   SER  79           HG       SER  79   0.677  -5.189  -2.426
  611    H    ARG  80           H        ARG  80   2.150  -5.947  -5.748
  612    HA   ARG  80           HA       ARG  80   3.790  -8.242  -6.021
  613    HB2  ARG  80           1HB      ARG  80   1.548  -8.149  -6.987
  614    HB3  ARG  80           2HB      ARG  80   2.044  -6.849  -8.061
  615    HG2  ARG  80           1HG      ARG  80   3.667  -8.401  -9.110
  616    HG3  ARG  80           2HG      ARG  80   3.024  -9.694  -8.095
  617    HD2  ARG  80           1HD      ARG  80   0.848  -9.467  -9.101
  618    HD3  ARG  80           2HD      ARG  80   1.382  -8.062 -10.025
  619    HE   ARG  80           HE       ARG  80   2.389 -10.812 -10.441
  620   HH11  ARG  80          1HH1      ARG  80   1.567  -7.627 -11.626
  621   HH12  ARG  80          2HH1      ARG  80   1.930  -7.993 -13.285
  622   HH21  ARG  80          1HH2      ARG  80   2.832 -11.328 -12.631
  623   HH22  ARG  80          2HH2      ARG  80   2.647 -10.113 -13.860
  624    H    GLN  81           H        GLN  81   3.959  -4.974  -7.278
  625    HA   GLN  81           HA       GLN  81   6.014  -5.379  -9.173
  626    HB2  GLN  81           1HB      GLN  81   4.627  -3.366  -9.151
  627    HB3  GLN  81           2HB      GLN  81   5.257  -2.921  -7.577
  628    HG2  GLN  81           1HG      GLN  81   7.173  -3.245  -9.825
  629    HG3  GLN  81           2HG      GLN  81   6.144  -1.816  -9.787
  630   HE21  GLN  81          2HE2      GLN  81   9.022  -1.983  -9.528
  631   HE22  GLN  81          1HE2      GLN  81   9.409  -1.281  -7.994
  632    H    ALA  82           H        ALA  82   6.008  -4.713  -5.724
  633    HA   ALA  82           HA       ALA  82   8.868  -4.573  -5.498
  634    HB1  ALA  82           3HB      ALA  82   7.408  -3.417  -3.910
  635    HB2  ALA  82           1HB      ALA  82   8.461  -4.570  -3.090
  636    HB3  ALA  82           2HB      ALA  82   6.766  -4.967  -3.370
  637    H    HIS  83           H        HIS  83   6.733  -7.046  -6.042
  638    HA   HIS  83           HA       HIS  83   6.782  -9.306  -5.964
  639    HB2  HIS  83           1HB      HIS  83   9.746  -8.932  -5.475
  640    HB3  HIS  83           2HB      HIS  83   8.967 -10.438  -5.944
  641    HD1  HIS  83           HD1      HIS  83   7.674 -10.268  -8.388
  642    HD2  HIS  83           HD2      HIS  83  10.646  -7.469  -7.569
  643    HE1  HIS  83           HE1      HIS  83   8.348  -9.315 -10.614
  644    HE2  HIS  83           HE2      HIS  83  10.175  -7.656 -10.111
  645    H    CYS  84           H        CYS  84   6.429  -7.693  -3.509
  646    HA   CYS  84           HA       CYS  84   7.228  -9.702  -1.514
  647    HB2  CYS  84           1HB      CYS  84   6.830  -6.731  -1.091
  648    HB3  CYS  84           2HB      CYS  84   7.261  -7.897   0.155
  649    HG   CYS  84           HG       CYS  84   9.258  -7.388  -2.568
  650    H    LEU  85           H        LEU  85   5.229 -10.735  -2.196
  651    HA   LEU  85           HA       LEU  85   2.774  -9.444  -1.290
  652    HB2  LEU  85           1HB      LEU  85   3.231 -12.088  -2.679
  653    HB3  LEU  85           2HB      LEU  85   1.658 -11.432  -2.266
  654    HG   LEU  85           HG       LEU  85   3.617 -10.171  -4.186
  655   HD11  LEU  85          1HD1      LEU  85   2.019 -10.839  -5.909
  656   HD12  LEU  85          2HD1      LEU  85   1.047 -11.666  -4.691
  657   HD13  LEU  85          3HD1      LEU  85   2.673 -12.240  -5.061
  658   HD21  LEU  85          3HD2      LEU  85   1.756  -8.686  -4.739
  659   HD22  LEU  85          1HD2      LEU  85   2.229  -8.525  -3.048
  660   HD23  LEU  85          2HD2      LEU  85   0.781  -9.437  -3.475
  661    H    MET  86           H        MET  86   1.447 -10.323   0.323
  662    HA   MET  86           HA       MET  86   2.845 -11.890   2.321
  663    HB2  MET  86           1HB      MET  86   1.333  -9.898   2.827
  664    HB3  MET  86           2HB      MET  86  -0.022 -10.949   2.440
  665    HG2  MET  86           1HG      MET  86   0.361 -10.820   4.838
  666    HG3  MET  86           2HG      MET  86   0.604 -12.458   4.232
  667    HE1  MET  86           3HE      MET  86   1.865 -13.180   6.416
  668    HE2  MET  86           1HE      MET  86   1.643 -11.572   7.111
  669    HE3  MET  86           2HE      MET  86   3.242 -12.316   7.098
  670    H    GLU  87           H        GLU  87   1.109 -12.548  -0.385
  671    HA   GLU  87           HA       GLU  87  -0.184 -14.977   0.526
  672    HB2  GLU  87           1HB      GLU  87   0.257 -13.923  -2.280
  673    HB3  GLU  87           2HB      GLU  87  -0.780 -15.272  -1.840
  674    HG2  GLU  87           1HG      GLU  87  -1.184 -12.445  -0.896
  675    HG3  GLU  87           2HG      GLU  87  -1.989 -13.155  -2.293
  676    H    ASP  88           H        ASP  88   0.521 -17.080  -0.016
  677    HA   ASP  88           HA       ASP  88   3.396 -17.209  -0.585
  678    HB2  ASP  88           1HB      ASP  88   2.594 -18.284   1.497
  679    HB3  ASP  88           2HB      ASP  88   1.582 -19.356   0.533
  680    H    LYS  89           H        LYS  89   4.162 -18.023  -2.407
  681    HA   LYS  89           HA       LYS  89   2.574 -19.865  -4.003
  682    HB2  LYS  89           1HB      LYS  89   1.926 -17.586  -4.777
  683    HB3  LYS  89           2HB      LYS  89   3.612 -17.262  -5.148
  684    HG2  LYS  89           1HG      LYS  89   3.590 -19.064  -6.812
  685    HG3  LYS  89           2HG      LYS  89   1.889 -19.369  -6.446
  686    HD2  LYS  89           1HD      LYS  89   1.322 -17.098  -7.156
  687    HD3  LYS  89           2HD      LYS  89   3.022 -16.773  -7.493
  688    HE2  LYS  89           1HE      LYS  89   1.891 -17.266  -9.557
  689    HE3  LYS  89           2HE      LYS  89   2.997 -18.583  -9.177
  690    HZ1  LYS  89           3HZ      LYS  89   0.079 -18.624  -8.621
  691    HZ2  LYS  89           1HZ      LYS  89   1.166 -19.913  -8.415
  692    HZ3  LYS  89           2HZ      LYS  89   0.808 -19.343  -9.971
  693    H    ALA  90           H        ALA  90   4.079 -21.450  -3.796
  694    HA   ALA  90           HA       ALA  90   6.902 -20.931  -4.017
  695    HB1  ALA  90           3HB      ALA  90   5.426 -23.556  -3.850
  696    HB2  ALA  90           1HB      ALA  90   6.033 -22.629  -2.477
  697    HB3  ALA  90           2HB      ALA  90   7.162 -23.324  -3.643
  698    H    GLU  91           H        GLU  91   5.880 -20.027  -6.313
  699    HA   GLU  91           HA       GLU  91   6.686 -22.038  -8.306
  700    HB2  GLU  91           1HB      GLU  91   4.404 -20.070  -8.546
  701    HB3  GLU  91           2HB      GLU  91   4.951 -21.156  -9.815
  702    HG2  GLU  91           1HG      GLU  91   4.270 -23.073  -8.564
  703    HG3  GLU  91           2HG      GLU  91   3.912 -22.083  -7.150
  704    H    ALA  92           H        ALA  92   8.078 -19.824  -6.979
  705    HA   ALA  92           HA       ALA  92   8.360 -17.718  -8.914
  706    HB1  ALA  92           3HB      ALA  92  10.047 -18.369  -6.496
  707    HB2  ALA  92           1HB      ALA  92   8.661 -17.280  -6.521
  708    HB3  ALA  92           2HB      ALA  92  10.116 -16.878  -7.433
  709    HA   PRO  93           HA       PRO  93  11.405 -19.637 -11.516
  710    HB2  PRO  93           1HB      PRO  93  12.487 -16.949 -12.012
  711    HB3  PRO  93           2HB      PRO  93  11.703 -18.067 -13.129
  712    HG2  PRO  93           1HG      PRO  93  10.491 -15.817 -12.299
  713    HG3  PRO  93           2HG      PRO  93   9.587 -17.309 -12.619
  714    HD2  PRO  93           1HD      PRO  93  10.465 -16.148 -10.000
  715    HD3  PRO  93           2HD      PRO  93   8.916 -16.903 -10.436
  716    H    ASN  94           H        ASN  94  12.091 -19.164  -8.635
  717    HA   ASN  94           HA       ASN  94  14.932 -18.517  -8.737
  718    HB2  ASN  94           1HB      ASN  94  13.145 -19.258  -6.404
  719    HB3  ASN  94           2HB      ASN  94  14.840 -18.806  -6.270
  720   HD21  ASN  94          2HD2      ASN  94  12.412 -17.562  -5.159
  721   HD22  ASN  94          1HD2      ASN  94  12.436 -15.918  -5.710
  722    H    THR  95           H        THR  95  12.795 -21.217  -8.643
  723    HA   THR  95           HA       THR  95  15.102 -23.032  -8.491
  724    HB   THR  95           HB       THR  95  13.663 -24.673  -7.288
  725    HG1  THR  95           HG1      THR  95  11.826 -23.323  -6.165
  726   HG21  THR  95          3HG2      THR  95  13.773 -23.587  -5.086
  727   HG22  THR  95          1HG2      THR  95  14.025 -22.027  -5.872
  728   HG23  THR  95          2HG2      THR  95  15.238 -23.300  -6.026
  729    H    ILE  96           H        ILE  96  14.243 -25.347  -9.177
  730    HA   ILE  96           HA       ILE  96  13.007 -24.992 -11.788
  731    HB   ILE  96           HB       ILE  96  13.606 -27.353 -12.173
  732   HG12  ILE  96          1HG1      ILE  96  14.848 -27.218  -9.416
  733   HG13  ILE  96          2HG1      ILE  96  13.389 -28.113  -9.823
  734   HG21  ILE  96          1HG2      ILE  96  15.187 -25.612 -12.764
  735   HG22  ILE  96          2HG2      ILE  96  16.044 -27.046 -12.195
  736   HG23  ILE  96          3HG2      ILE  96  15.864 -25.647 -11.136
  737   HD11  ILE  96          3HD1      ILE  96  16.141 -28.632 -10.928
  738   HD12  ILE  96          1HD1      ILE  96  14.678 -29.534 -11.328
  739   HD13  ILE  96          2HD1      ILE  96  15.320 -29.579  -9.686
  740    H    ALA  97           H        ALA  97  11.753 -25.198  -8.883
  741    HA   ALA  97           HA       ALA  97  10.117 -27.494  -8.866
  742    HB1  ALA  97           3HB      ALA  97   8.897 -26.396  -7.070
  743    HB2  ALA  97           1HB      ALA  97   9.676 -24.862  -7.458
  744    HB3  ALA  97           2HB      ALA  97  10.636 -26.209  -6.846
  745    H    SER  98           H        SER  98   9.620 -24.226 -10.085
  746    HA   SER  98           HA       SER  98   6.869 -24.669 -10.740
  747    HB2  SER  98           1HB      SER  98   7.280 -22.466 -12.059
  748    HB3  SER  98           2HB      SER  98   7.361 -22.425 -10.298
  749    HG   SER  98           HG       SER  98   9.135 -21.358 -11.360
  750    H    GLY  99           H        GLY  99   6.380 -26.120 -12.238
  751    HA2  GLY  99           1HA      GLY  99   6.246 -26.305 -14.729
  752    HA3  GLY  99           2HA      GLY  99   8.002 -26.175 -14.714
  753    H    SER 100           H        SER 100   6.337 -27.939 -12.245
  754    HA   SER 100           HA       SER 100   7.488 -30.422 -13.301
  755    HB2  SER 100           1HB      SER 100   6.481 -29.812 -10.509
  756    HB3  SER 100           2HB      SER 100   7.320 -31.277 -11.019
  757    HG   SER 100           HG       SER 100   8.332 -28.648 -10.759
  Start of MODEL   12
    1    H1   MET   1           1H       MET   1  -7.521  11.436  23.613
    2    H2   MET   1           2H       MET   1  -6.280  12.355  24.307
    3    H3   MET   1           3H       MET   1  -7.818  12.339  25.014
    4    HA   MET   1           HA       MET   1  -6.025   9.999  24.767
    5    HB2  MET   1           1HB      MET   1  -6.618  11.842  27.077
    6    HB3  MET   1           2HB      MET   1  -5.983  10.221  27.316
    7    HG2  MET   1           1HG      MET   1  -4.211  11.863  27.392
    8    HG3  MET   1           2HG      MET   1  -4.011  10.796  26.005
    9    HE1  MET   1           3HE      MET   1  -2.477  13.564  26.392
   10    HE2  MET   1           1HE      MET   1  -2.572  14.227  24.760
   11    HE3  MET   1           2HE      MET   1  -2.239  12.511  24.998
   12    H    GLU   2           H        GLU   2  -8.802  11.286  26.634
   13    HA   GLU   2           HA       GLU   2 -10.052   8.816  27.100
   14    HB2  GLU   2           1HB      GLU   2 -10.735  10.849  28.258
   15    HB3  GLU   2           2HB      GLU   2 -11.251  11.574  26.743
   16    HG2  GLU   2           1HG      GLU   2 -13.022   9.935  26.533
   17    HG3  GLU   2           2HG      GLU   2 -12.480   9.135  28.009
   18    H    VAL   3           H        VAL   3 -10.466  11.177  24.496
   19    HA   VAL   3           HA       VAL   3 -11.444   8.982  22.789
   20    HB   VAL   3           HB       VAL   3 -12.708  10.629  21.465
   21   HG11  VAL   3          1HG1      VAL   3 -13.853   9.399  23.225
   22   HG12  VAL   3          2HG1      VAL   3 -14.517  11.025  23.068
   23   HG13  VAL   3          3HG1      VAL   3 -13.420  10.645  24.396
   24   HG21  VAL   3          3HG2      VAL   3 -13.069  12.894  22.301
   25   HG22  VAL   3          1HG2      VAL   3 -11.359  12.608  21.978
   26   HG23  VAL   3          2HG2      VAL   3 -11.957  12.589  23.636
   27    H    GLN   4           H        GLN   4 -11.130   9.756  20.368
   28    HA   GLN   4           HA       GLN   4  -8.349  10.690  20.179
   29    HB2  GLN   4           1HB      GLN   4  -9.899   8.820  18.379
   30    HB3  GLN   4           2HB      GLN   4  -8.286   9.422  18.022
   31    HG2  GLN   4           1HG      GLN   4  -9.055   7.746  20.403
   32    HG3  GLN   4           2HG      GLN   4  -8.219   7.174  18.959
   33   HE21  GLN   4          2HE2      GLN   4  -7.410   7.213  21.795
   34   HE22  GLN   4          1HE2      GLN   4  -5.902   8.061  21.842
   35    H    SER   5           H        SER   5  -7.790  12.141  18.558
   36    HA   SER   5           HA       SER   5  -9.747  14.109  18.014
   37    HB2  SER   5           1HB      SER   5  -7.823  15.042  16.553
   38    HB3  SER   5           2HB      SER   5  -7.565  14.915  18.294
   39    HG   SER   5           HG       SER   5  -5.798  14.079  17.072
   40    H    MET   6           H        MET   6  -8.350  11.505  16.118
   41    HA   MET   6           HA       MET   6  -8.983  10.501  14.185
   42    HB2  MET   6           1HB      MET   6 -11.537  12.048  14.672
   43    HB3  MET   6           2HB      MET   6 -11.343  10.831  13.417
   44    HG2  MET   6           1HG      MET   6 -10.941   9.128  15.072
   45    HG3  MET   6           2HG      MET   6 -10.993  10.327  16.362
   46    HE1  MET   6           3HE      MET   6 -13.035   8.442  13.603
   47    HE2  MET   6           1HE      MET   6 -13.363  10.127  13.191
   48    HE3  MET   6           2HE      MET   6 -14.654   9.103  13.820
   49    H    LEU   7           H        LEU   7  -7.492  12.946  14.097
   50    HA   LEU   7           HA       LEU   7  -8.561  14.549  11.934
   51    HB2  LEU   7           1HB      LEU   7  -7.250  15.521  13.813
   52    HB3  LEU   7           2HB      LEU   7  -5.841  14.644  13.248
   53    HG   LEU   7           HG       LEU   7  -5.933  15.923  11.124
   54   HD11  LEU   7          1HD1      LEU   7  -8.113  17.467  12.520
   55   HD12  LEU   7          2HD1      LEU   7  -8.309  16.438  11.101
   56   HD13  LEU   7          3HD1      LEU   7  -7.349  17.913  10.995
   57   HD21  LEU   7          3HD2      LEU   7  -5.149  18.050  12.068
   58   HD22  LEU   7          1HD2      LEU   7  -4.474  16.660  12.918
   59   HD23  LEU   7          2HD2      LEU   7  -5.793  17.580  13.641
   60    H    LEU   8           H        LEU   8  -7.107  11.626  12.076
   61    HA   LEU   8           HA       LEU   8  -5.235  11.866   9.915
   62    HB2  LEU   8           1HB      LEU   8  -6.439   9.388  11.150
   63    HB3  LEU   8           2HB      LEU   8  -5.047   9.436  10.088
   64    HG   LEU   8           HG       LEU   8  -5.197  10.589  12.874
   65   HD11  LEU   8          1HD1      LEU   8  -3.709   8.213  11.765
   66   HD12  LEU   8          2HD1      LEU   8  -5.099   8.163  12.850
   67   HD13  LEU   8          3HD1      LEU   8  -3.568   8.839  13.406
   68   HD21  LEU   8          3HD2      LEU   8  -2.908  10.511  10.912
   69   HD22  LEU   8          1HD2      LEU   8  -2.799  11.017  12.598
   70   HD23  LEU   8          2HD2      LEU   8  -3.769  11.951  11.459
   71    H    ASN   9           H        ASN   9  -8.608  11.548  10.126
   72    HA   ASN   9           HA       ASN   9 -10.283  11.045   8.658
   73    HB2  ASN   9           1HB      ASN   9  -8.085  11.526   6.626
   74    HB3  ASN   9           2HB      ASN   9  -9.777  11.288   6.206
   75   HD21  ASN   9          2HD2      ASN   9  -7.438  13.425   7.596
   76   HD22  ASN   9          1HD2      ASN   9  -8.438  14.839   7.616
   77    H    ASP  10           H        ASP  10  -8.978   8.936   9.870
   78    HA   ASP  10           HA       ASP  10  -7.903   7.069   8.032
   79    HB2  ASP  10           1HB      ASP  10  -7.805   5.529   9.924
   80    HB3  ASP  10           2HB      ASP  10  -7.214   7.118  10.391
   81    H    VAL  11           H        VAL  11  -9.121   6.188   6.516
   82    HA   VAL  11           HA       VAL  11 -11.733   5.135   7.124
   83    HB   VAL  11           HB       VAL  11 -11.393   4.073   4.769
   84   HG11  VAL  11          1HG1      VAL  11 -12.924   5.908   5.235
   85   HG12  VAL  11          2HG1      VAL  11 -12.096   6.172   3.701
   86   HG13  VAL  11          3HG1      VAL  11 -11.591   7.058   5.139
   87   HG21  VAL  11          3HG2      VAL  11  -8.963   4.478   4.667
   88   HG22  VAL  11          1HG2      VAL  11  -9.272   6.214   4.691
   89   HG23  VAL  11          2HG2      VAL  11  -9.826   5.239   3.330
   90    H    LYS  12           H        LYS  12 -11.910   3.361   8.251
   91    HA   LYS  12           HA       LYS  12  -9.606   1.766   8.826
   92    HB2  LYS  12           1HB      LYS  12 -12.488   1.477   9.680
   93    HB3  LYS  12           2HB      LYS  12 -11.157   0.520  10.316
   94    HG2  LYS  12           1HG      LYS  12 -10.128   2.476  11.260
   95    HG3  LYS  12           2HG      LYS  12 -11.327   3.519  10.497
   96    HD2  LYS  12           1HD      LYS  12 -13.088   2.487  11.837
   97    HD3  LYS  12           2HD      LYS  12 -11.901   1.427  12.595
   98    HE2  LYS  12           1HE      LYS  12 -12.491   3.356  14.009
   99    HE3  LYS  12           2HE      LYS  12 -10.779   3.320  13.586
  100    HZ1  LYS  12           3HZ      LYS  12 -11.054   5.061  12.058
  101    HZ2  LYS  12           1HZ      LYS  12 -11.932   5.536  13.426
  102    HZ3  LYS  12           2HZ      LYS  12 -12.749   4.937  12.070
  103    H    TRP  13           H        TRP  13  -9.007  -0.110   8.009
  104    HA   TRP  13           HA       TRP  13 -10.429  -1.170   5.743
  105    HB2  TRP  13           1HB      TRP  13  -7.752  -1.354   6.821
  106    HB3  TRP  13           2HB      TRP  13  -8.375  -2.956   6.443
  107    HD1  TRP  13           HD1      TRP  13 -10.039  -2.176   3.833
  108    HE1  TRP  13           HE1      TRP  13  -8.780  -1.597   1.668
  109    HE3  TRP  13           HE3      TRP  13  -5.492  -0.974   5.836
  110    HZ2  TRP  13           HZ2      TRP  13  -6.200  -0.757   0.906
  111    HZ3  TRP  13           HZ3      TRP  13  -3.681  -0.298   4.316
  112    HH2  TRP  13           HH2      TRP  13  -4.028  -0.192   1.902
  113    H    GLU  14           H        GLU  14 -11.526  -3.049   5.613
  114    HA   GLU  14           HA       GLU  14 -12.433  -4.282   8.052
  115    HB2  GLU  14           1HB      GLU  14 -13.840  -3.911   5.987
  116    HB3  GLU  14           2HB      GLU  14 -12.903  -5.174   5.205
  117    HG2  GLU  14           1HG      GLU  14 -13.661  -6.778   6.876
  118    HG3  GLU  14           2HG      GLU  14 -14.600  -5.505   7.664
  119    H    LYS  15           H        LYS  15 -11.051  -5.712   5.095
  120    HA   LYS  15           HA       LYS  15  -9.434  -7.489   6.763
  121    HB2  LYS  15           1HB      LYS  15 -10.542  -7.654   4.051
  122    HB3  LYS  15           2HB      LYS  15  -8.863  -8.167   4.157
  123    HG2  LYS  15           1HG      LYS  15 -11.111  -9.237   5.856
  124    HG3  LYS  15           2HG      LYS  15 -10.444 -10.028   4.424
  125    HD2  LYS  15           1HD      LYS  15  -8.262 -10.172   5.499
  126    HD3  LYS  15           2HD      LYS  15  -8.889  -9.331   6.917
  127    HE2  LYS  15           1HE      LYS  15 -10.456 -11.170   7.308
  128    HE3  LYS  15           2HE      LYS  15  -9.830 -12.007   5.890
  129    HZ1  LYS  15           3HZ      LYS  15  -8.889 -12.817   8.000
  130    HZ2  LYS  15           1HZ      LYS  15  -8.200 -11.292   8.269
  131    HZ3  LYS  15           2HZ      LYS  15  -7.702 -12.227   6.941
  132    HA   PRO  16           HA       PRO  16  -6.308  -4.350   6.191
  133    HB2  PRO  16           1HB      PRO  16  -4.535  -5.434   7.928
  134    HB3  PRO  16           2HB      PRO  16  -5.964  -4.535   8.452
  135    HG2  PRO  16           1HG      PRO  16  -5.553  -7.497   8.269
  136    HG3  PRO  16           2HG      PRO  16  -6.304  -6.548   9.566
  137    HD2  PRO  16           1HD      PRO  16  -7.760  -7.867   7.710
  138    HD3  PRO  16           2HD      PRO  16  -8.301  -6.338   8.432
  139    H    VAL  17           H        VAL  17  -4.010  -4.302   5.608
  140    HA   VAL  17           HA       VAL  17  -3.348  -6.529   3.806
  141    HB   VAL  17           HB       VAL  17  -2.254  -3.708   3.785
  142   HG11  VAL  17          1HG1      VAL  17  -0.722  -5.337   2.822
  143   HG12  VAL  17          2HG1      VAL  17  -1.400  -4.295   1.569
  144   HG13  VAL  17          3HG1      VAL  17  -2.006  -5.939   1.772
  145   HG21  VAL  17          3HG2      VAL  17  -4.361  -4.964   2.028
  146   HG22  VAL  17          1HG2      VAL  17  -3.668  -3.356   1.818
  147   HG23  VAL  17          2HG2      VAL  17  -4.633  -3.721   3.248
  148    H    THR  18           H        THR  18  -1.547  -7.711   4.114
  149    HA   THR  18           HA       THR  18   0.184  -7.004   6.381
  150    HB   THR  18           HB       THR  18  -0.073  -9.656   4.950
  151    HG1  THR  18           HG1      THR  18  -1.896  -8.655   6.360
  152   HG21  THR  18          3HG2      THR  18   1.225  -8.939   7.583
  153   HG22  THR  18          1HG2      THR  18   2.079  -9.342   6.096
  154   HG23  THR  18          2HG2      THR  18   1.092 -10.561   6.904
  155    H    ILE  19           H        ILE  19   1.921  -5.887   5.774
  156    HA   ILE  19           HA       ILE  19   3.352  -6.703   3.322
  157    HB   ILE  19           HB       ILE  19   3.298  -4.051   4.765
  158   HG12  ILE  19          1HG1      ILE  19   1.422  -4.531   3.212
  159   HG13  ILE  19          2HG1      ILE  19   2.417  -3.181   2.678
  160   HG21  ILE  19          1HG2      ILE  19   5.065  -4.881   2.468
  161   HG22  ILE  19          2HG2      ILE  19   5.587  -4.496   4.108
  162   HG23  ILE  19          3HG2      ILE  19   4.894  -3.237   3.085
  163   HD11  ILE  19          3HD1      ILE  19   3.515  -4.601   1.060
  164   HD12  ILE  19          1HD1      ILE  19   1.768  -4.642   0.836
  165   HD13  ILE  19          2HD1      ILE  19   2.587  -5.991   1.624
  166    H    SER  20           H        SER  20   5.053  -7.934   3.744
  167    HA   SER  20           HA       SER  20   6.339  -7.833   6.352
  168    HB2  SER  20           1HB      SER  20   7.575  -9.840   5.480
  169    HB3  SER  20           2HB      SER  20   5.822 -10.032   5.506
  170    HG   SER  20           HG       SER  20   7.087  -9.059   3.190
  171    H    LEU  21           H        LEU  21   8.122  -6.682   6.712
  172    HA   LEU  21           HA       LEU  21   9.508  -5.422   4.511
  173    HB2  LEU  21           1HB      LEU  21  10.176  -5.311   7.453
  174    HB3  LEU  21           2HB      LEU  21  10.734  -4.217   6.200
  175    HG   LEU  21           HG       LEU  21   7.883  -4.477   7.161
  176   HD11  LEU  21          1HD1      LEU  21   9.338  -3.395   8.790
  177   HD12  LEU  21          2HD1      LEU  21   8.224  -2.236   8.064
  178   HD13  LEU  21          3HD1      LEU  21   9.910  -2.281   7.548
  179   HD21  LEU  21          3HD2      LEU  21   7.465  -2.521   5.742
  180   HD22  LEU  21          1HD2      LEU  21   7.980  -3.919   4.797
  181   HD23  LEU  21          2HD2      LEU  21   9.120  -2.616   5.137
  182    H    GLN  22           H        GLN  22  12.051  -5.328   4.877
  183    HA   GLN  22           HA       GLN  22  13.048  -7.801   4.046
  184    HB2  GLN  22           1HB      GLN  22  14.112  -5.664   3.513
  185    HB3  GLN  22           2HB      GLN  22  14.540  -5.437   5.204
  186    HG2  GLN  22           1HG      GLN  22  15.951  -7.455   5.080
  187    HG3  GLN  22           2HG      GLN  22  15.570  -7.587   3.365
  188   HE21  GLN  22          2HE2      GLN  22  18.132  -7.209   4.714
  189   HE22  GLN  22          1HE2      GLN  22  18.817  -5.771   4.034
  190    H    ASN  23           H        ASN  23  12.728  -6.462   7.234
  191    HA   ASN  23           HA       ASN  23  14.595  -8.214   8.514
  192    HB2  ASN  23           1HB      ASN  23  12.342  -6.621   9.752
  193    HB3  ASN  23           2HB      ASN  23  13.733  -7.295  10.592
  194   HD21  ASN  23          2HD2      ASN  23  15.733  -6.311  10.385
  195   HD22  ASN  23          1HD2      ASN  23  15.907  -4.714   9.735
  196    H    GLY  24           H        GLY  24  11.704  -8.876   7.103
  197    HA2  GLY  24           1HA      GLY  24  10.405 -10.791   7.194
  198    HA3  GLY  24           2HA      GLY  24  11.358 -11.335   8.569
  199    H    ALA  25           H        ALA  25   9.912  -8.192   8.528
  200    HA   ALA  25           HA       ALA  25   8.118  -9.034  10.695
  201    HB1  ALA  25           3HB      ALA  25   8.154  -6.729  11.452
  202    HB2  ALA  25           1HB      ALA  25   9.127  -6.264  10.056
  203    HB3  ALA  25           2HB      ALA  25   9.802  -7.335  11.281
  204    HA   PRO  26           HA       PRO  26   4.922  -8.158   7.630
  205    HB2  PRO  26           1HB      PRO  26   3.135  -9.573   9.409
  206    HB3  PRO  26           2HB      PRO  26   3.732 -10.069   7.825
  207    HG2  PRO  26           1HG      PRO  26   4.429 -11.312  10.152
  208    HG3  PRO  26           2HG      PRO  26   5.464 -11.276   8.713
  209    HD2  PRO  26           1HD      PRO  26   5.595  -9.585  11.184
  210    HD3  PRO  26           2HD      PRO  26   6.916 -10.341  10.264
  211    H    ARG  27           H        ARG  27   4.452  -6.031   7.835
  212    HA   ARG  27           HA       ARG  27   3.085  -5.066  10.216
  213    HB2  ARG  27           1HB      ARG  27   4.016  -3.716   7.683
  214    HB3  ARG  27           2HB      ARG  27   3.004  -2.893   8.862
  215    HG2  ARG  27           1HG      ARG  27   4.742  -3.346  10.579
  216    HG3  ARG  27           2HG      ARG  27   5.767  -3.999   9.303
  217    HD2  ARG  27           1HD      ARG  27   5.860  -1.883   8.197
  218    HD3  ARG  27           2HD      ARG  27   4.627  -1.212   9.264
  219    HE   ARG  27           HE       ARG  27   6.680  -2.034  10.914
  220   HH11  ARG  27          1HH1      ARG  27   6.342   0.242   8.262
  221   HH12  ARG  27          2HH1      ARG  27   7.558   1.323   8.877
  222   HH21  ARG  27          1HH2      ARG  27   8.270  -0.611  11.703
  223   HH22  ARG  27          2HH2      ARG  27   8.652   0.834  10.818
  224    H    ILE  28           H        ILE  28   0.981  -5.074  10.434
  225    HA   ILE  28           HA       ILE  28  -0.665  -5.671   8.075
  226    HB   ILE  28           HB       ILE  28  -1.294  -6.092  11.005
  227   HG12  ILE  28          1HG1      ILE  28  -0.588  -8.066   8.820
  228   HG13  ILE  28          2HG1      ILE  28   0.439  -7.622  10.179
  229   HG21  ILE  28          1HG2      ILE  28  -2.840  -6.872   8.536
  230   HG22  ILE  28          2HG2      ILE  28  -3.299  -5.638   9.712
  231   HG23  ILE  28          3HG2      ILE  28  -3.244  -7.337  10.187
  232   HD11  ILE  28          3HD1      ILE  28  -2.207  -9.043  10.350
  233   HD12  ILE  28          1HD1      ILE  28  -1.192  -8.589  11.719
  234   HD13  ILE  28          2HD1      ILE  28  -0.612  -9.769  10.545
  235    H    PHE  29           H        PHE  29  -1.554  -3.906   7.247
  236    HA   PHE  29           HA       PHE  29  -1.984  -1.565   8.929
  237    HB2  PHE  29           1HB      PHE  29  -2.407  -1.809   5.947
  238    HB3  PHE  29           2HB      PHE  29  -2.214  -0.330   6.883
  239    HD1  PHE  29           HD2      PHE  29   0.043  -0.082   8.160
  240    HD2  PHE  29           HD1      PHE  29  -0.583  -2.735   4.893
  241    HE1  PHE  29           HE2      PHE  29   2.471  -0.169   7.768
  242    HE2  PHE  29           HE1      PHE  29   1.839  -2.827   4.499
  243    HZ   PHE  29           HZ       PHE  29   3.370  -1.546   5.936
  244    H    ASN  30           H        ASN  30  -3.846  -1.377   9.940
  245    HA   ASN  30           HA       ASN  30  -6.223  -2.697   8.850
  246    HB2  ASN  30           1HB      ASN  30  -5.590  -1.559  11.572
  247    HB3  ASN  30           2HB      ASN  30  -7.200  -2.114  11.124
  248   HD21  ASN  30          2HD2      ASN  30  -3.903  -3.061  11.733
  249   HD22  ASN  30          1HD2      ASN  30  -4.220  -4.754  11.931
  250    H    GLY  31           H        GLY  31  -4.854   0.113   8.336
  251    HA2  GLY  31           1HA      GLY  31  -7.426   1.370   7.753
  252    HA3  GLY  31           2HA      GLY  31  -6.278   2.289   8.719
  253    H    VAL  32           H        VAL  32  -7.399   2.623   5.909
  254    HA   VAL  32           HA       VAL  32  -5.370   2.076   4.040
  255    HB   VAL  32           HB       VAL  32  -7.429   4.286   3.914
  256   HG11  VAL  32          1HG1      VAL  32  -5.648   4.615   2.301
  257   HG12  VAL  32          2HG1      VAL  32  -7.124   4.109   1.479
  258   HG13  VAL  32          3HG1      VAL  32  -5.820   2.951   1.740
  259   HG21  VAL  32          3HG2      VAL  32  -8.769   2.688   2.624
  260   HG22  VAL  32          1HG2      VAL  32  -8.462   2.104   4.261
  261   HG23  VAL  32          2HG2      VAL  32  -7.552   1.444   2.904
  262    H    TYR  33           H        TYR  33  -5.938   4.874   6.113
  263    HA   TYR  33           HA       TYR  33  -3.979   6.568   5.042
  264    HB2  TYR  33           1HB      TYR  33  -5.536   7.507   6.594
  265    HB3  TYR  33           2HB      TYR  33  -5.093   6.346   7.842
  266    HD1  TYR  33           HD1      TYR  33  -3.789   9.233   5.887
  267    HD2  TYR  33           HD2      TYR  33  -3.373   6.822   9.368
  268    HE1  TYR  33           HE1      TYR  33  -2.104  10.797   6.765
  269    HE2  TYR  33           HE2      TYR  33  -1.692   8.376  10.256
  270    HH   TYR  33           HH       TYR  33  -0.142  10.047   9.479
  271    H    GLU  34           H        GLU  34  -3.755   3.919   7.343
  272    HA   GLU  34           HA       GLU  34  -1.138   4.421   8.262
  273    HB2  GLU  34           1HB      GLU  34  -2.742   2.907   9.385
  274    HB3  GLU  34           2HB      GLU  34  -2.598   1.780   8.045
  275    HG2  GLU  34           1HG      GLU  34  -0.264   1.419   8.557
  276    HG3  GLU  34           2HG      GLU  34  -0.344   2.614   9.851
  277    H    ALA  35           H        ALA  35  -2.398   2.505   5.568
  278    HA   ALA  35           HA       ALA  35   0.101   1.525   4.670
  279    HB1  ALA  35           3HB      ALA  35  -2.021   0.524   3.973
  280    HB2  ALA  35           1HB      ALA  35  -1.061   1.017   2.578
  281    HB3  ALA  35           2HB      ALA  35  -2.431   1.998   3.097
  282    H    PHE  36           H        PHE  36  -1.841   4.344   3.773
  283    HA   PHE  36           HA       PHE  36  -0.204   5.392   1.772
  284    HB2  PHE  36           1HB      PHE  36  -2.466   6.210   2.197
  285    HB3  PHE  36           2HB      PHE  36  -1.973   6.818   3.771
  286    HD1  PHE  36           HD2      PHE  36  -1.407   7.245   0.126
  287    HD2  PHE  36           HD1      PHE  36  -1.154   8.984   4.004
  288    HE1  PHE  36           HE2      PHE  36  -0.871   9.422  -0.884
  289    HE2  PHE  36           HE1      PHE  36  -0.625  11.163   2.999
  290    HZ   PHE  36           HZ       PHE  36  -0.482  11.385   0.547
  291    H    ASP  37           H        ASP  37  -0.200   5.982   5.263
  292    HA   ASP  37           HA       ASP  37   1.936   7.790   5.376
  293    HB2  ASP  37           1HB      ASP  37   0.426   7.410   7.258
  294    HB3  ASP  37           2HB      ASP  37   1.006   5.756   7.418
  295    H    PHE  38           H        PHE  38   1.873   4.272   5.703
  296    HA   PHE  38           HA       PHE  38   4.575   3.799   6.132
  297    HB2  PHE  38           1HB      PHE  38   2.969   2.050   6.440
  298    HB3  PHE  38           2HB      PHE  38   2.457   2.143   4.760
  299    HD1  PHE  38           HD1      PHE  38   5.421   1.361   6.871
  300    HD2  PHE  38           HD2      PHE  38   3.371   0.706   3.199
  301    HE1  PHE  38           HE1      PHE  38   7.025  -0.415   6.292
  302    HE2  PHE  38           HE2      PHE  38   4.970  -1.064   2.614
  303    HZ   PHE  38           HZ       PHE  38   6.797  -1.628   4.160
  304    H    LEU  39           H        LEU  39   2.806   4.072   3.069
  305    HA   LEU  39           HA       LEU  39   4.888   3.315   1.354
  306    HB2  LEU  39           1HB      LEU  39   2.560   5.171   0.861
  307    HB3  LEU  39           2HB      LEU  39   3.605   4.542  -0.396
  308    HG   LEU  39           HG       LEU  39   1.870   2.854   1.405
  309   HD11  LEU  39          1HD1      LEU  39   0.486   2.517  -0.574
  310   HD12  LEU  39          2HD1      LEU  39   1.498   3.640  -1.481
  311   HD13  LEU  39          3HD1      LEU  39   0.541   4.220  -0.119
  312   HD21  LEU  39          3HD2      LEU  39   2.438   1.055  -0.156
  313   HD22  LEU  39          1HD2      LEU  39   3.869   1.693   0.650
  314   HD23  LEU  39          2HD2      LEU  39   3.520   2.147  -1.018
  315    H    GLN  40           H        GLN  40   4.200   6.376   2.892
  316    HA   GLN  40           HA       GLN  40   6.252   7.698   1.282
  317    HB2  GLN  40           1HB      GLN  40   4.241   8.756   3.268
  318    HB3  GLN  40           2HB      GLN  40   5.493   9.755   2.543
  319    HG2  GLN  40           1HG      GLN  40   4.571   9.402   0.348
  320    HG3  GLN  40           2HG      GLN  40   3.389   8.262   0.990
  321   HE21  GLN  40          2HE2      GLN  40   3.060  10.822  -0.468
  322   HE22  GLN  40          1HE2      GLN  40   2.041  11.792   0.547
  323    H    HIS  41           H        HIS  41   6.031   6.026   4.164
  324    HA   HIS  41           HA       HIS  41   8.143   7.559   5.467
  325    HB2  HIS  41           1HB      HIS  41   6.288   5.398   6.356
  326    HB3  HIS  41           2HB      HIS  41   7.826   5.579   7.193
  327    HD1  HIS  41           HD1      HIS  41   7.396   6.796   9.298
  328    HD2  HIS  41           HD2      HIS  41   5.199   8.352   6.125
  329    HE1  HIS  41           HE1      HIS  41   6.188   8.801  10.221
  330    HE2  HIS  41           HE2      HIS  41   4.665   9.536   8.355
  331    H    GLU  42           H        GLU  42   7.650   4.060   4.907
  332    HA   GLU  42           HA       GLU  42  10.384   3.900   3.923
  333    HB2  GLU  42           1HB      GLU  42   9.414   2.406   6.355
  334    HB3  GLU  42           2HB      GLU  42  10.844   1.941   5.446
  335    HG2  GLU  42           1HG      GLU  42  11.795   4.186   5.905
  336    HG3  GLU  42           2HG      GLU  42  10.398   4.520   6.929
  337    H    TRP  43           H        TRP  43   8.995   3.512   2.009
  338    HA   TRP  43           HA       TRP  43   7.946   0.828   1.766
  339    HB2  TRP  43           1HB      TRP  43   7.025   2.713   0.436
  340    HB3  TRP  43           2HB      TRP  43   8.580   2.893  -0.366
  341    HD1  TRP  43           HD1      TRP  43   8.592   1.860  -2.684
  342    HE1  TRP  43           HE1      TRP  43   7.416  -0.105  -3.854
  343    HE3  TRP  43           HE3      TRP  43   5.832   0.103   1.246
  344    HZ2  TRP  43           HZ2      TRP  43   5.561  -2.127  -3.204
  345    HZ3  TRP  43           HZ3      TRP  43   4.380  -1.849   0.884
  346    HH2  TRP  43           HH2      TRP  43   4.248  -2.940  -1.294
  347    HA   PRO  44           HA       PRO  44  12.078  -0.861   1.243
  348    HB2  PRO  44           1HB      PRO  44  10.675  -3.336   0.509
  349    HB3  PRO  44           2HB      PRO  44  11.758  -3.019   1.866
  350    HG2  PRO  44           1HG      PRO  44   9.121  -3.372   2.220
  351    HG3  PRO  44           2HG      PRO  44  10.059  -2.243   3.218
  352    HD2  PRO  44           1HD      PRO  44   8.263  -1.671   0.886
  353    HD3  PRO  44           2HD      PRO  44   8.414  -0.809   2.434
  354    H    ALA  45           H        ALA  45  10.860   0.499  -1.023
  355    HA   ALA  45           HA       ALA  45  12.430  -0.574  -3.125
  356    HB1  ALA  45           3HB      ALA  45  10.633  -1.106  -4.707
  357    HB2  ALA  45           1HB      ALA  45   9.433  -0.825  -3.445
  358    HB3  ALA  45           2HB      ALA  45  10.570  -2.164  -3.297
  359    H    ARG  46           H        ARG  46  11.978   0.760  -5.204
  360    HA   ARG  46           HA       ARG  46  11.550   3.511  -4.494
  361    HB2  ARG  46           1HB      ARG  46  11.895   2.185  -7.188
  362    HB3  ARG  46           2HB      ARG  46  11.750   3.923  -6.962
  363    HG2  ARG  46           1HG      ARG  46  13.779   3.874  -5.555
  364    HG3  ARG  46           2HG      ARG  46  13.941   2.150  -5.899
  365    HD2  ARG  46           1HD      ARG  46  13.961   4.369  -7.946
  366    HD3  ARG  46           2HD      ARG  46  15.379   3.505  -7.353
  367    HE   ARG  46           HE       ARG  46  14.010   1.467  -8.281
  368   HH11  ARG  46          1HH1      ARG  46  14.383   4.650  -9.721
  369   HH12  ARG  46          2HH1      ARG  46  14.198   4.067 -11.350
  370   HH21  ARG  46          1HH2      ARG  46  13.785   0.708 -10.399
  371   HH22  ARG  46          2HH2      ARG  46  13.865   1.811 -11.740
  372    H    GLY  47           H        GLY  47  10.018   2.015  -7.289
  373    HA2  GLY  47           1HA      GLY  47   7.678   1.184  -6.942
  374    HA3  GLY  47           2HA      GLY  47   7.404   2.710  -6.113
  375    H    ASP  48           H        ASP  48   8.609   4.503  -7.732
  376    HA   ASP  48           HA       ASP  48   8.039   5.902  -9.421
  377    HB2  ASP  48           1HB      ASP  48   8.229   3.282 -10.915
  378    HB3  ASP  48           2HB      ASP  48   8.039   4.838 -11.718
  379    H    ARG  49           H        ARG  49   6.386   4.077 -11.616
  380    HA   ARG  49           HA       ARG  49   3.988   5.473 -11.359
  381    HB2  ARG  49           1HB      ARG  49   4.771   4.263 -13.391
  382    HB3  ARG  49           2HB      ARG  49   4.371   2.749 -12.599
  383    HG2  ARG  49           1HG      ARG  49   2.014   3.450 -12.494
  384    HG3  ARG  49           2HG      ARG  49   2.440   4.928 -13.360
  385    HD2  ARG  49           1HD      ARG  49   2.777   2.107 -14.380
  386    HD3  ARG  49           2HD      ARG  49   1.538   3.254 -14.890
  387    HE   ARG  49           HE       ARG  49   3.456   4.658 -15.702
  388   HH11  ARG  49          1HH1      ARG  49   3.705   1.170 -15.485
  389   HH12  ARG  49          2HH1      ARG  49   4.937   1.050 -16.705
  390   HH21  ARG  49          1HH2      ARG  49   5.100   4.506 -17.291
  391   HH22  ARG  49          2HH2      ARG  49   5.752   2.946 -17.697
  392    H    ALA  50           H        ALA  50   4.875   2.250 -10.187
  393    HA   ALA  50           HA       ALA  50   2.298   1.522  -9.281
  394    HB1  ALA  50           3HB      ALA  50   3.438  -0.266  -8.065
  395    HB2  ALA  50           1HB      ALA  50   4.990   0.513  -8.372
  396    HB3  ALA  50           2HB      ALA  50   4.043  -0.124  -9.715
  397    H    HIS  51           H        HIS  51   4.984   3.200  -7.769
  398    HA   HIS  51           HA       HIS  51   3.927   3.118  -5.117
  399    HB2  HIS  51           1HB      HIS  51   6.334   3.466  -5.584
  400    HB3  HIS  51           2HB      HIS  51   5.957   5.023  -6.313
  401    HD1  HIS  51           HD1      HIS  51   5.592   7.004  -4.753
  402    HD2  HIS  51           HD2      HIS  51   6.075   3.379  -2.752
  403    HE1  HIS  51           HE1      HIS  51   5.893   7.594  -2.320
  404    HE2  HIS  51           HE2      HIS  51   6.279   5.398  -1.143
  405    H    GLU  52           H        GLU  52   3.913   5.500  -7.734
  406    HA   GLU  52           HA       GLU  52   2.622   7.513  -6.212
  407    HB2  GLU  52           1HB      GLU  52   2.757   7.221  -9.218
  408    HB3  GLU  52           2HB      GLU  52   2.347   8.686  -8.332
  409    HG2  GLU  52           1HG      GLU  52   4.996   7.267  -8.414
  410    HG3  GLU  52           2HG      GLU  52   4.608   8.871  -9.036
  411    H    GLN  53           H        GLN  53   1.414   5.168  -8.625
  412    HA   GLN  53           HA       GLN  53  -1.271   5.906  -8.555
  413    HB2  GLN  53           1HB      GLN  53  -0.011   3.193  -8.940
  414    HB3  GLN  53           2HB      GLN  53  -1.735   3.483  -9.123
  415    HG2  GLN  53           1HG      GLN  53  -1.221   5.139 -10.890
  416    HG3  GLN  53           2HG      GLN  53   0.483   4.713 -10.741
  417   HE21  GLN  53          2HE2      GLN  53  -1.338   4.475 -13.018
  418   HE22  GLN  53          1HE2      GLN  53  -1.318   2.800 -13.464
  419    H    ALA  54           H        ALA  54   0.501   3.675  -6.448
  420    HA   ALA  54           HA       ALA  54  -1.622   2.797  -4.874
  421    HB1  ALA  54           3HB      ALA  54   0.590   1.794  -4.780
  422    HB2  ALA  54           1HB      ALA  54   0.064   2.289  -3.172
  423    HB3  ALA  54           2HB      ALA  54   1.241   3.263  -4.054
  424    H    LEU  55           H        LEU  55   0.485   5.629  -4.448
  425    HA   LEU  55           HA       LEU  55  -0.663   6.568  -2.057
  426    HB2  LEU  55           1HB      LEU  55   0.671   8.099  -4.289
  427    HB3  LEU  55           2HB      LEU  55   0.272   8.779  -2.723
  428    HG   LEU  55           HG       LEU  55   2.216   6.520  -3.212
  429   HD11  LEU  55          1HD1      LEU  55   2.655   9.414  -2.487
  430   HD12  LEU  55          2HD1      LEU  55   3.081   8.634  -4.011
  431   HD13  LEU  55          3HD1      LEU  55   3.905   8.170  -2.523
  432   HD21  LEU  55          3HD2      LEU  55   1.522   7.994  -0.673
  433   HD22  LEU  55          1HD2      LEU  55   2.774   6.767  -0.852
  434   HD23  LEU  55          2HD2      LEU  55   1.077   6.331  -1.055
  435    H    ARG  56           H        ARG  56  -1.424   7.236  -5.441
  436    HA   ARG  56           HA       ARG  56  -3.388   9.199  -4.967
  437    HB2  ARG  56           1HB      ARG  56  -3.147   7.301  -7.310
  438    HB3  ARG  56           2HB      ARG  56  -4.088   8.788  -7.282
  439    HG2  ARG  56           1HG      ARG  56  -1.949  10.022  -6.859
  440    HG3  ARG  56           2HG      ARG  56  -1.098   8.502  -7.141
  441    HD2  ARG  56           1HD      ARG  56  -1.044   9.633  -9.201
  442    HD3  ARG  56           2HD      ARG  56  -2.312   8.420  -9.372
  443    HE   ARG  56           HE       ARG  56  -3.392  10.879  -8.460
  444   HH11  ARG  56          1HH1      ARG  56  -2.214   9.260 -11.345
  445   HH12  ARG  56          2HH1      ARG  56  -3.092  10.304 -12.429
  446   HH21  ARG  56          1HH2      ARG  56  -4.510  12.257  -9.880
  447   HH22  ARG  56          2HH2      ARG  56  -4.381  12.016 -11.596
  448    H    LEU  57           H        LEU  57  -3.586   5.691  -5.275
  449    HA   LEU  57           HA       LEU  57  -6.403   5.475  -5.173
  450    HB2  LEU  57           1HB      LEU  57  -4.265   3.515  -4.321
  451    HB3  LEU  57           2HB      LEU  57  -5.965   3.124  -4.505
  452    HG   LEU  57           HG       LEU  57  -4.225   4.121  -6.758
  453   HD11  LEU  57          1HD1      LEU  57  -4.215   1.789  -7.526
  454   HD12  LEU  57          2HD1      LEU  57  -5.024   1.306  -6.035
  455   HD13  LEU  57          3HD1      LEU  57  -3.395   1.980  -5.976
  456   HD21  LEU  57          3HD2      LEU  57  -6.043   3.324  -8.166
  457   HD22  LEU  57          1HD2      LEU  57  -6.627   4.532  -7.020
  458   HD23  LEU  57          2HD2      LEU  57  -6.947   2.820  -6.738
  459    H    CYS  58           H        CYS  58  -3.910   5.407  -2.652
  460    HA   CYS  58           HA       CYS  58  -5.648   4.936  -0.483
  461    HB2  CYS  58           1HB      CYS  58  -2.999   6.395  -0.512
  462    HB3  CYS  58           2HB      CYS  58  -3.810   5.776   0.921
  463    HG   CYS  58           HG       CYS  58  -2.368   3.976  -1.596
  464    H    ARG  59           H        ARG  59  -4.563   7.909  -2.060
  465    HA   ARG  59           HA       ARG  59  -5.761   9.674  -0.192
  466    HB2  ARG  59           1HB      ARG  59  -4.856  10.032  -3.038
  467    HB3  ARG  59           2HB      ARG  59  -5.602  11.338  -2.123
  468    HG2  ARG  59           1HG      ARG  59  -3.808  10.909  -0.370
  469    HG3  ARG  59           2HG      ARG  59  -2.999   9.940  -1.602
  470    HD2  ARG  59           1HD      ARG  59  -2.192  12.286  -1.480
  471    HD3  ARG  59           2HD      ARG  59  -2.825  11.832  -3.063
  472    HE   ARG  59           HE       ARG  59  -4.367  13.491  -2.847
  473   HH11  ARG  59          1HH1      ARG  59  -3.311  12.610   0.386
  474   HH12  ARG  59          2HH1      ARG  59  -4.330  13.775   1.174
  475   HH21  ARG  59          1HH2      ARG  59  -5.650  15.060  -1.815
  476   HH22  ARG  59          2HH2      ARG  59  -5.629  15.200  -0.079
  477    H    ALA  60           H        ALA  60  -6.898   8.209  -3.205
  478    HA   ALA  60           HA       ALA  60  -9.362   9.543  -3.374
  479    HB1  ALA  60           3HB      ALA  60 -10.084   7.696  -4.789
  480    HB2  ALA  60           1HB      ALA  60  -8.720   6.723  -4.238
  481    HB3  ALA  60           2HB      ALA  60  -8.436   8.179  -5.191
  482    H    SER  61           H        SER  61  -8.330   6.762  -1.510
  483    HA   SER  61           HA       SER  61 -10.895   6.008  -0.565
  484    HB2  SER  61           1HB      SER  61  -8.199   5.552   0.737
  485    HB3  SER  61           2HB      SER  61  -9.684   4.654   1.057
  486    HG   SER  61           HG       SER  61  -8.202   4.720  -1.372
  487    H    LEU  62           H        LEU  62  -8.422   8.229   0.587
  488    HA   LEU  62           HA       LEU  62  -9.686   8.807   3.083
  489    HB2  LEU  62           1HB      LEU  62  -7.627  10.385   1.537
  490    HB3  LEU  62           2HB      LEU  62  -8.079  10.668   3.206
  491    HG   LEU  62           HG       LEU  62  -6.758   8.158   2.164
  492   HD11  LEU  62          1HD1      LEU  62  -4.785   8.940   3.349
  493   HD12  LEU  62          2HD1      LEU  62  -5.631  10.416   3.813
  494   HD13  LEU  62          3HD1      LEU  62  -5.272  10.102   2.115
  495   HD21  LEU  62          3HD2      LEU  62  -8.203   7.736   4.087
  496   HD22  LEU  62          1HD2      LEU  62  -7.399   9.028   4.979
  497   HD23  LEU  62          2HD2      LEU  62  -6.501   7.581   4.522
  498    H    MET  63           H        MET  63 -10.496   9.593  -0.051
  499    HA   MET  63           HA       MET  63 -11.756  12.136   0.673
  500    HB2  MET  63           1HB      MET  63 -11.480  10.754  -1.999
  501    HB3  MET  63           2HB      MET  63 -12.291  12.292  -1.751
  502    HG2  MET  63           1HG      MET  63 -10.213  13.296  -1.019
  503    HG3  MET  63           2HG      MET  63  -9.387  11.748  -1.197
  504    HE1  MET  63           3HE      MET  63  -8.339  14.428  -2.541
  505    HE2  MET  63           1HE      MET  63  -7.910  13.852  -4.153
  506    HE3  MET  63           2HE      MET  63  -7.538  12.869  -2.736
  507    H    GLY  64           H        GLY  64 -12.469   8.814   0.284
  508    HA2  GLY  64           1HA      GLY  64 -14.566   7.868   0.886
  509    HA3  GLY  64           2HA      GLY  64 -15.342   9.389   0.466
  510    H    ASP  65           H        ASP  65 -13.115   8.692  -1.882
  511    HA   ASP  65           HA       ASP  65 -15.139   7.917  -3.778
  512    HB2  ASP  65           1HB      ASP  65 -13.355   9.443  -4.467
  513    HB3  ASP  65           2HB      ASP  65 -12.141   8.226  -4.090
  514    H    VAL  66           H        VAL  66 -12.536   6.426  -2.019
  515    HA   VAL  66           HA       VAL  66 -13.501   3.799  -2.931
  516    HB   VAL  66           HB       VAL  66 -10.648   4.469  -2.161
  517   HG11  VAL  66          1HG1      VAL  66 -10.139   2.204  -2.966
  518   HG12  VAL  66          2HG1      VAL  66 -11.860   1.917  -3.217
  519   HG13  VAL  66          3HG1      VAL  66 -11.239   2.191  -1.589
  520   HG21  VAL  66          3HG2      VAL  66 -10.106   4.054  -4.524
  521   HG22  VAL  66          1HG2      VAL  66 -11.164   5.449  -4.311
  522   HG23  VAL  66          2HG2      VAL  66 -11.827   3.918  -4.879
  523    H    ALA  67           H        ALA  67 -14.136   2.471  -1.316
  524    HA   ALA  67           HA       ALA  67 -14.154   3.432   1.383
  525    HB1  ALA  67           3HB      ALA  67 -14.933   0.723   0.305
  526    HB2  ALA  67           1HB      ALA  67 -16.006   2.111   0.480
  527    HB3  ALA  67           2HB      ALA  67 -15.311   1.349   1.910
  528    H    GLY  68           H        GLY  68 -12.249   1.176  -0.463
  529    HA2  GLY  68           1HA      GLY  68  -9.878   1.193   0.534
  530    HA3  GLY  68           2HA      GLY  68 -10.683   0.514   1.944
  531    H    GLU  69           H        GLU  69 -12.557  -0.917   0.112
  532    HA   GLU  69           HA       GLU  69 -11.191  -3.382   0.038
  533    HB2  GLU  69           1HB      GLU  69 -13.353  -3.718  -1.647
  534    HB3  GLU  69           2HB      GLU  69 -13.350  -3.974   0.090
  535    HG2  GLU  69           1HG      GLU  69 -15.234  -2.634  -0.439
  536    HG3  GLU  69           2HG      GLU  69 -14.063  -1.604   0.375
  537    H    ILE  70           H        ILE  70 -12.173  -1.158  -2.559
  538    HA   ILE  70           HA       ILE  70 -10.965  -2.638  -4.656
  539    HB   ILE  70           HB       ILE  70 -11.528   0.335  -4.521
  540   HG12  ILE  70          1HG1      ILE  70 -13.183  -1.916  -5.691
  541   HG13  ILE  70          2HG1      ILE  70 -13.525  -1.088  -4.175
  542   HG21  ILE  70          1HG2      ILE  70  -9.932  -0.187  -6.275
  543   HG22  ILE  70          2HG2      ILE  70 -11.492   0.240  -6.978
  544   HG23  ILE  70          3HG2      ILE  70 -10.996  -1.450  -6.896
  545   HD11  ILE  70          3HD1      ILE  70 -14.934  -0.263  -5.969
  546   HD12  ILE  70          1HD1      ILE  70 -13.506   0.173  -6.907
  547   HD13  ILE  70          2HD1      ILE  70 -13.850   1.002  -5.389
  548    H    ALA  71           H        ALA  71  -9.836  -0.057  -2.552
  549    HA   ALA  71           HA       ALA  71  -7.377   0.453  -3.814
  550    HB1  ALA  71           3HB      ALA  71  -6.733   1.543  -1.723
  551    HB2  ALA  71           1HB      ALA  71  -8.117   0.809  -0.909
  552    HB3  ALA  71           2HB      ALA  71  -8.373   1.987  -2.196
  553    H    ARG  72           H        ARG  72  -8.311  -1.840  -1.288
  554    HA   ARG  72           HA       ARG  72  -5.731  -2.750  -0.628
  555    HB2  ARG  72           1HB      ARG  72  -7.664  -3.277   0.746
  556    HB3  ARG  72           2HB      ARG  72  -8.383  -4.200  -0.565
  557    HG2  ARG  72           1HG      ARG  72  -6.363  -5.713  -0.441
  558    HG3  ARG  72           2HG      ARG  72  -5.952  -4.884   1.062
  559    HD2  ARG  72           1HD      ARG  72  -7.209  -6.956   1.469
  560    HD3  ARG  72           2HD      ARG  72  -8.085  -5.529   2.030
  561    HE   ARG  72           HE       ARG  72  -8.688  -6.654  -0.613
  562   HH11  ARG  72          1HH1      ARG  72  -9.655  -5.951   2.665
  563   HH12  ARG  72          2HH1      ARG  72 -11.347  -6.248   2.377
  564   HH21  ARG  72          1HH2      ARG  72 -10.909  -7.002  -1.033
  565   HH22  ARG  72          2HH2      ARG  72 -12.069  -6.825   0.251
  566    H    THR  73           H        THR  73  -8.108  -3.998  -2.942
  567    HA   THR  73           HA       THR  73  -6.590  -6.153  -3.894
  568    HB   THR  73           HB       THR  73  -8.636  -4.576  -5.466
  569    HG1  THR  73           HG1      THR  73 -10.076  -5.316  -4.105
  570   HG21  THR  73          3HG2      THR  73  -9.091  -6.736  -6.535
  571   HG22  THR  73          1HG2      THR  73  -7.826  -7.487  -5.564
  572   HG23  THR  73          2HG2      THR  73  -7.409  -6.260  -6.759
  573    H    ALA  74           H        ALA  74  -6.841  -2.796  -5.000
  574    HA   ALA  74           HA       ALA  74  -5.135  -3.112  -7.249
  575    HB1  ALA  74           3HB      ALA  74  -6.759  -1.287  -7.066
  576    HB2  ALA  74           1HB      ALA  74  -5.127  -0.682  -7.347
  577    HB3  ALA  74           2HB      ALA  74  -5.831  -0.601  -5.731
  578    H    PHE  75           H        PHE  75  -4.609  -2.239  -3.884
  579    HA   PHE  75           HA       PHE  75  -1.935  -1.401  -4.086
  580    HB2  PHE  75           1HB      PHE  75  -3.377  -1.047  -2.091
  581    HB3  PHE  75           2HB      PHE  75  -3.284  -2.769  -1.746
  582    HD1  PHE  75           HD1      PHE  75  -1.270   0.315  -2.041
  583    HD2  PHE  75           HD2      PHE  75  -1.484  -3.658  -0.535
  584    HE1  PHE  75           HE1      PHE  75   0.765   0.707  -0.727
  585    HE2  PHE  75           HE2      PHE  75   0.561  -3.273   0.780
  586    HZ   PHE  75           HZ       PHE  75   1.687  -1.086   0.686
  587    H    VAL  76           H        VAL  76  -3.354  -4.591  -3.469
  588    HA   VAL  76           HA       VAL  76  -0.932  -6.005  -3.218
  589    HB   VAL  76           HB       VAL  76  -3.611  -6.991  -4.228
  590   HG11  VAL  76          1HG1      VAL  76  -2.814  -9.233  -3.648
  591   HG12  VAL  76          2HG1      VAL  76  -1.235  -8.565  -3.234
  592   HG13  VAL  76          3HG1      VAL  76  -1.811  -8.498  -4.900
  593   HG21  VAL  76          3HG2      VAL  76  -2.366  -7.055  -1.481
  594   HG22  VAL  76          1HG2      VAL  76  -3.877  -7.846  -1.930
  595   HG23  VAL  76          2HG2      VAL  76  -3.751  -6.086  -1.986
  596    H    ALA  77           H        ALA  77  -2.913  -5.170  -6.013
  597    HA   ALA  77           HA       ALA  77  -1.477  -6.607  -7.958
  598    HB1  ALA  77           3HB      ALA  77  -2.550  -5.142  -9.584
  599    HB2  ALA  77           1HB      ALA  77  -3.034  -4.042  -8.294
  600    HB3  ALA  77           2HB      ALA  77  -3.704  -5.673  -8.361
  601    H    ALA  78           H        ALA  78  -1.026  -3.374  -6.614
  602    HA   ALA  78           HA       ALA  78   1.117  -2.667  -8.369
  603    HB1  ALA  78           3HB      ALA  78   0.339  -1.497  -5.698
  604    HB2  ALA  78           1HB      ALA  78  -0.237  -0.959  -7.277
  605    HB3  ALA  78           2HB      ALA  78   1.466  -0.780  -6.850
  606    H    SER  79           H        SER  79   0.880  -4.155  -5.191
  607    HA   SER  79           HA       SER  79   3.626  -4.031  -4.539
  608    HB2  SER  79           1HB      SER  79   1.566  -4.588  -3.037
  609    HB3  SER  79           2HB      SER  79   1.831  -6.245  -3.578
  610    HG   SER  79           HG       SER  79   3.569  -6.368  -2.374
  611    H    ARG  80           H        ARG  80   1.807  -6.049  -6.660
  612    HA   ARG  80           HA       ARG  80   3.549  -8.247  -6.894
  613    HB2  ARG  80           1HB      ARG  80   1.739  -6.960  -8.945
  614    HB3  ARG  80           2HB      ARG  80   2.571  -8.485  -9.194
  615    HG2  ARG  80           1HG      ARG  80   1.352  -9.466  -7.330
  616    HG3  ARG  80           2HG      ARG  80   0.531  -7.929  -7.054
  617    HD2  ARG  80           1HD      ARG  80  -0.500  -8.050  -9.238
  618    HD3  ARG  80           2HD      ARG  80   0.388  -9.527  -9.605
  619    HE   ARG  80           HE       ARG  80  -0.910 -10.364  -7.491
  620   HH11  ARG  80          1HH1      ARG  80  -2.125  -8.281 -10.042
  621   HH12  ARG  80          2HH1      ARG  80  -3.758  -8.848  -9.887
  622   HH21  ARG  80          1HH2      ARG  80  -3.041 -11.107  -7.286
  623   HH22  ARG  80          2HH2      ARG  80  -4.296 -10.448  -8.301
  624    H    GLN  81           H        GLN  81   3.573  -5.032  -8.298
  625    HA   GLN  81           HA       GLN  81   5.687  -5.560 -10.149
  626    HB2  GLN  81           1HB      GLN  81   3.987  -3.728 -10.399
  627    HB3  GLN  81           2HB      GLN  81   4.772  -2.886  -9.071
  628    HG2  GLN  81           1HG      GLN  81   5.492  -1.978 -11.187
  629    HG3  GLN  81           2HG      GLN  81   6.841  -2.768 -10.372
  630   HE21  GLN  81          2HE2      GLN  81   7.661  -4.684 -11.205
  631   HE22  GLN  81          1HE2      GLN  81   7.312  -5.217 -12.813
  632    H    ALA  82           H        ALA  82   5.463  -4.622  -6.821
  633    HA   ALA  82           HA       ALA  82   8.216  -3.785  -6.596
  634    HB1  ALA  82           3HB      ALA  82   6.173  -4.364  -4.454
  635    HB2  ALA  82           1HB      ALA  82   6.505  -2.786  -5.168
  636    HB3  ALA  82           2HB      ALA  82   7.741  -3.597  -4.206
  637    H    HIS  83           H        HIS  83   6.685  -6.713  -6.865
  638    HA   HIS  83           HA       HIS  83   7.365  -8.872  -6.707
  639    HB2  HIS  83           1HB      HIS  83  10.080  -7.748  -5.972
  640    HB3  HIS  83           2HB      HIS  83   9.741  -9.394  -6.487
  641    HD1  HIS  83           HD1      HIS  83   8.772  -9.559  -9.054
  642    HD2  HIS  83           HD2      HIS  83  10.789  -6.087  -7.977
  643    HE1  HIS  83           HE1      HIS  83   9.437  -8.466 -11.215
  644    HE2  HIS  83           HE2      HIS  83  10.893  -6.525 -10.525
  645    H    CYS  84           H        CYS  84   6.063  -7.807  -4.525
  646    HA   CYS  84           HA       CYS  84   7.115  -9.472  -2.396
  647    HB2  CYS  84           1HB      CYS  84   8.115  -7.235  -1.983
  648    HB3  CYS  84           2HB      CYS  84   6.498  -6.540  -1.940
  649    HG   CYS  84           HG       CYS  84   8.225  -7.821   0.510
  650    H    LEU  85           H        LEU  85   5.339 -10.764  -2.699
  651    HA   LEU  85           HA       LEU  85   2.755  -9.543  -2.021
  652    HB2  LEU  85           1HB      LEU  85   3.372 -12.026  -3.606
  653    HB3  LEU  85           2HB      LEU  85   1.760 -11.588  -3.072
  654    HG   LEU  85           HG       LEU  85   3.485  -9.956  -4.929
  655   HD11  LEU  85          1HD1      LEU  85   1.824 -10.609  -6.621
  656   HD12  LEU  85          2HD1      LEU  85   1.071 -11.680  -5.438
  657   HD13  LEU  85          3HD1      LEU  85   2.719 -11.990  -5.985
  658   HD21  LEU  85          3HD2      LEU  85   1.988  -8.600  -3.538
  659   HD22  LEU  85          1HD2      LEU  85   0.621  -9.579  -4.070
  660   HD23  LEU  85          2HD2      LEU  85   1.501  -8.588  -5.235
  661    H    MET  86           H        MET  86   1.920  -9.996  -0.159
  662    HA   MET  86           HA       MET  86   2.405 -12.637   1.039
  663    HB2  MET  86           1HB      MET  86   2.308  -9.951   2.413
  664    HB3  MET  86           2HB      MET  86   2.023 -11.451   3.283
  665    HG2  MET  86           1HG      MET  86   4.532 -10.790   1.757
  666    HG3  MET  86           2HG      MET  86   4.325 -10.621   3.499
  667    HE1  MET  86           3HE      MET  86   3.775 -14.360   4.592
  668    HE2  MET  86           1HE      MET  86   2.550 -13.159   4.188
  669    HE3  MET  86           2HE      MET  86   3.950 -12.699   5.159
  670    H    GLU  87           H        GLU  87   0.599 -13.715   1.642
  671    HA   GLU  87           HA       GLU  87  -1.933 -12.446   0.947
  672    HB2  GLU  87           1HB      GLU  87  -1.289 -15.341   1.529
  673    HB3  GLU  87           2HB      GLU  87  -2.853 -14.732   1.003
  674    HG2  GLU  87           1HG      GLU  87  -1.824 -13.956  -1.090
  675    HG3  GLU  87           2HG      GLU  87  -0.283 -14.629  -0.563
  676    H    ASP  88           H        ASP  88  -3.829 -12.958   2.313
  677    HA   ASP  88           HA       ASP  88  -3.378 -12.206   5.016
  678    HB2  ASP  88           1HB      ASP  88  -5.403 -11.542   3.808
  679    HB3  ASP  88           2HB      ASP  88  -5.876 -13.228   3.639
  680    H    LYS  89           H        LYS  89  -4.173 -13.481   6.904
  681    HA   LYS  89           HA       LYS  89  -2.953 -16.087   6.780
  682    HB2  LYS  89           1HB      LYS  89  -4.236 -14.608   9.073
  683    HB3  LYS  89           2HB      LYS  89  -3.394 -16.144   9.223
  684    HG2  LYS  89           1HG      LYS  89  -1.353 -15.018   8.325
  685    HG3  LYS  89           2HG      LYS  89  -2.229 -13.489   8.430
  686    HD2  LYS  89           1HD      LYS  89  -2.539 -13.826  10.828
  687    HD3  LYS  89           2HD      LYS  89  -1.675 -15.362  10.727
  688    HE2  LYS  89           1HE      LYS  89   0.311 -14.122   9.900
  689    HE3  LYS  89           2HE      LYS  89  -0.563 -12.615  10.177
  690    HZ1  LYS  89           3HZ      LYS  89  -0.746 -13.233  12.530
  691    HZ2  LYS  89           1HZ      LYS  89   0.870 -13.092  12.030
  692    HZ3  LYS  89           2HZ      LYS  89   0.173 -14.626  12.235
  693    H    ALA  90           H        ALA  90  -5.869 -15.224   5.794
  694    HA   ALA  90           HA       ALA  90  -7.610 -17.080   7.002
  695    HB1  ALA  90           3HB      ALA  90  -9.019 -16.777   5.048
  696    HB2  ALA  90           1HB      ALA  90  -7.684 -16.029   4.174
  697    HB3  ALA  90           2HB      ALA  90  -8.379 -15.223   5.580
  698    H    GLU  91           H        GLU  91  -8.132 -19.177   6.498
  699    HA   GLU  91           HA       GLU  91  -6.026 -20.680   5.185
  700    HB2  GLU  91           1HB      GLU  91  -8.518 -21.631   6.605
  701    HB3  GLU  91           2HB      GLU  91  -7.204 -22.661   6.051
  702    HG2  GLU  91           1HG      GLU  91  -5.675 -21.602   7.590
  703    HG3  GLU  91           2HG      GLU  91  -6.929 -20.473   8.099
  704    H    ALA  92           H        ALA  92  -8.056 -18.982   3.822
  705    HA   ALA  92           HA       ALA  92  -8.380 -20.587   1.503
  706    HB1  ALA  92           3HB      ALA  92 -10.902 -19.814   2.976
  707    HB2  ALA  92           1HB      ALA  92 -10.292 -21.454   2.757
  708    HB3  ALA  92           2HB      ALA  92 -10.828 -20.520   1.361
  709    HA   PRO  93           HA       PRO  93  -7.751 -16.067   0.841
  710    HB2  PRO  93           1HB      PRO  93  -6.650 -17.185  -1.676
  711    HB3  PRO  93           2HB      PRO  93  -5.951 -15.997  -0.569
  712    HG2  PRO  93           1HG      PRO  93  -5.021 -18.495  -0.652
  713    HG3  PRO  93           2HG      PRO  93  -5.157 -17.620   0.885
  714    HD2  PRO  93           1HD      PRO  93  -6.926 -19.749  -0.249
  715    HD3  PRO  93           2HD      PRO  93  -6.395 -19.499   1.427
  716    H    ASN  94           H        ASN  94  -9.109 -18.546  -1.257
  717    HA   ASN  94           HA       ASN  94 -10.490 -16.638  -2.920
  718    HB2  ASN  94           1HB      ASN  94 -10.923 -19.627  -2.658
  719    HB3  ASN  94           2HB      ASN  94 -11.606 -18.596  -3.911
  720   HD21  ASN  94          2HD2      ASN  94  -8.909 -20.400  -2.871
  721   HD22  ASN  94          1HD2      ASN  94  -7.883 -20.087  -4.232
  722    H    THR  95           H        THR  95 -11.883 -15.404  -1.809
  723    HA   THR  95           HA       THR  95 -13.595 -16.578   0.225
  724    HB   THR  95           HB       THR  95 -14.334 -14.151   0.500
  725    HG1  THR  95           HG1      THR  95 -12.062 -13.156  -0.594
  726   HG21  THR  95          3HG2      THR  95 -12.298 -13.542   1.727
  727   HG22  THR  95          1HG2      THR  95 -11.418 -14.827   0.901
  728   HG23  THR  95          2HG2      THR  95 -12.734 -15.229   2.003
  729    H    ILE  96           H        ILE  96 -15.932 -15.689   0.242
  730    HA   ILE  96           HA       ILE  96 -17.128 -16.437  -2.288
  731    HB   ILE  96           HB       ILE  96 -18.577 -15.571   0.222
  732   HG12  ILE  96          1HG1      ILE  96 -17.068 -17.449   0.740
  733   HG13  ILE  96          2HG1      ILE  96 -18.755 -17.947   0.800
  734   HG21  ILE  96          1HG2      ILE  96 -20.416 -16.924  -0.711
  735   HG22  ILE  96          2HG2      ILE  96 -19.438 -17.236  -2.145
  736   HG23  ILE  96          3HG2      ILE  96 -19.960 -15.593  -1.775
  737   HD11  ILE  96          3HD1      ILE  96 -16.836 -18.466  -1.460
  738   HD12  ILE  96          1HD1      ILE  96 -18.530 -18.957  -1.415
  739   HD13  ILE  96          2HD1      ILE  96 -17.382 -19.637  -0.261
  740    H    ALA  97           H        ALA  97 -15.913 -14.399  -3.056
  741    HA   ALA  97           HA       ALA  97 -17.923 -12.435  -3.663
  742    HB1  ALA  97           3HB      ALA  97 -17.060 -11.519  -1.556
  743    HB2  ALA  97           1HB      ALA  97 -16.623 -10.492  -2.922
  744    HB3  ALA  97           2HB      ALA  97 -15.421 -11.566  -2.205
  745    H    SER  98           H        SER  98 -17.700 -12.199  -5.783
  746    HA   SER  98           HA       SER  98 -15.016 -12.107  -6.938
  747    HB2  SER  98           1HB      SER  98 -15.920 -14.479  -7.000
  748    HB3  SER  98           2HB      SER  98 -17.170 -13.886  -8.089
  749    HG   SER  98           HG       SER  98 -14.607 -14.542  -8.619
  750    H    GLY  99           H        GLY  99 -14.942 -11.138  -9.030
  751    HA2  GLY  99           1HA      GLY  99 -15.677  -9.782 -10.757
  752    HA3  GLY  99           2HA      GLY  99 -17.326 -10.012 -10.191
  753    H    SER 100           H        SER 100 -16.735  -7.560 -11.018
  754    HA   SER 100           HA       SER 100 -16.783  -6.056  -8.514
  755    HB2  SER 100           1HB      SER 100 -15.099  -5.268 -10.906
  756    HB3  SER 100           2HB      SER 100 -15.298  -4.327  -9.426
  757    HG   SER 100           HG       SER 100 -14.566  -6.698  -8.632
  Start of MODEL   13
    1    H1   MET   1           1H       MET   1  -1.395  31.179   4.318
    2    H2   MET   1           2H       MET   1  -0.839  29.610   4.644
    3    H3   MET   1           3H       MET   1  -1.990  30.325   5.662
    4    HA   MET   1           HA       MET   1  -2.985  28.679   4.182
    5    HB2  MET   1           1HB      MET   1  -3.762  31.561   3.702
    6    HB3  MET   1           2HB      MET   1  -4.749  30.185   3.229
    7    HG2  MET   1           1HG      MET   1  -4.933  29.502   5.563
    8    HG3  MET   1           2HG      MET   1  -3.929  30.868   6.044
    9    HE1  MET   1           3HE      MET   1  -6.698  30.863   3.234
   10    HE2  MET   1           1HE      MET   1  -8.124  31.315   4.167
   11    HE3  MET   1           2HE      MET   1  -7.339  29.762   4.453
   12    H    GLU   2           H        GLU   2  -0.398  29.649   2.911
   13    HA   GLU   2           HA       GLU   2  -1.244  29.994   0.130
   14    HB2  GLU   2           1HB      GLU   2   1.564  30.094   1.241
   15    HB3  GLU   2           2HB      GLU   2   1.027  30.642  -0.338
   16    HG2  GLU   2           1HG      GLU   2   1.327  32.595   0.888
   17    HG3  GLU   2           2HG      GLU   2  -0.415  32.326   0.928
   18    H    VAL   3           H        VAL   3   0.249  27.744   2.298
   19    HA   VAL   3           HA       VAL   3   1.392  26.040   0.312
   20    HB   VAL   3           HB       VAL   3   0.639  25.357   3.161
   21   HG11  VAL   3          1HG1      VAL   3   1.073  23.400   1.767
   22   HG12  VAL   3          2HG1      VAL   3   2.347  23.619   2.965
   23   HG13  VAL   3          3HG1      VAL   3   2.628  24.077   1.286
   24   HG21  VAL   3          3HG2      VAL   3   2.101  27.305   3.111
   25   HG22  VAL   3          1HG2      VAL   3   3.237  26.442   2.076
   26   HG23  VAL   3          2HG2      VAL   3   2.962  25.896   3.730
   27    H    GLN   4           H        GLN   4  -1.577  26.049   2.201
   28    HA   GLN   4           HA       GLN   4  -3.533  24.945   2.052
   29    HB2  GLN   4           1HB      GLN   4  -3.624  25.796  -0.236
   30    HB3  GLN   4           2HB      GLN   4  -2.686  24.420  -0.804
   31    HG2  GLN   4           1HG      GLN   4  -4.488  22.915  -0.124
   32    HG3  GLN   4           2HG      GLN   4  -5.430  24.296   0.430
   33   HE21  GLN   4          2HE2      GLN   4  -4.606  25.994  -1.783
   34   HE22  GLN   4          1HE2      GLN   4  -5.470  25.422  -3.168
   35    H    SER   5           H        SER   5  -2.732  23.487   3.586
   36    HA   SER   5           HA       SER   5  -1.834  20.887   2.612
   37    HB2  SER   5           1HB      SER   5  -1.727  20.476   5.183
   38    HB3  SER   5           2HB      SER   5  -0.530  21.538   4.445
   39    HG   SER   5           HG       SER   5  -1.306  22.622   6.201
   40    H    MET   6           H        MET   6  -2.907  18.926   3.473
   41    HA   MET   6           HA       MET   6  -5.812  19.400   3.709
   42    HB2  MET   6           1HB      MET   6  -4.383  17.144   2.296
   43    HB3  MET   6           2HB      MET   6  -6.123  17.244   2.520
   44    HG2  MET   6           1HG      MET   6  -6.179  19.290   1.193
   45    HG3  MET   6           2HG      MET   6  -4.433  19.194   0.970
   46    HE1  MET   6           3HE      MET   6  -7.052  16.257   0.993
   47    HE2  MET   6           1HE      MET   6  -7.428  16.116  -0.725
   48    HE3  MET   6           2HE      MET   6  -7.908  17.560   0.167
   49    H    LEU   7           H        LEU   7  -7.004  18.081   5.049
   50    HA   LEU   7           HA       LEU   7  -5.453  16.389   6.899
   51    HB2  LEU   7           1HB      LEU   7  -6.550  18.280   8.000
   52    HB3  LEU   7           2HB      LEU   7  -8.092  17.809   7.309
   53    HG   LEU   7           HG       LEU   7  -8.019  15.715   8.627
   54   HD11  LEU   7          1HD1      LEU   7  -6.376  15.468  10.411
   55   HD12  LEU   7          2HD1      LEU   7  -5.553  16.928   9.865
   56   HD13  LEU   7          3HD1      LEU   7  -5.597  15.501   8.829
   57   HD21  LEU   7          3HD2      LEU   7  -8.459  16.744  10.800
   58   HD22  LEU   7          1HD2      LEU   7  -9.197  17.665   9.491
   59   HD23  LEU   7          2HD2      LEU   7  -7.710  18.241  10.244
   60    H    LEU   8           H        LEU   8  -5.650  14.320   6.382
   61    HA   LEU   8           HA       LEU   8  -8.017  13.438   4.921
   62    HB2  LEU   8           1HB      LEU   8  -5.327  12.152   5.374
   63    HB3  LEU   8           2HB      LEU   8  -6.662  11.320   4.606
   64    HG   LEU   8           HG       LEU   8  -5.263  12.073   2.861
   65   HD11  LEU   8          1HD1      LEU   8  -7.546  14.024   3.109
   66   HD12  LEU   8          2HD1      LEU   8  -7.622  12.403   2.413
   67   HD13  LEU   8          3HD1      LEU   8  -6.658  13.657   1.628
   68   HD21  LEU   8          3HD2      LEU   8  -4.533  14.395   2.602
   69   HD22  LEU   8          1HD2      LEU   8  -3.931  13.681   4.099
   70   HD23  LEU   8          2HD2      LEU   8  -5.293  14.802   4.141
   71    H    ASN   9           H        ASN   9  -9.551  12.237   5.808
   72    HA   ASN   9           HA       ASN   9  -9.401  11.442   8.568
   73    HB2  ASN   9           1HB      ASN   9 -11.504  10.880   6.455
   74    HB3  ASN   9           2HB      ASN   9 -11.670  10.495   8.166
   75   HD21  ASN   9          2HD2      ASN   9 -11.690  12.989   5.772
   76   HD22  ASN   9          1HD2      ASN   9 -12.277  14.262   6.788
   77    H    ASP  10           H        ASP  10  -8.889   9.462   9.356
   78    HA   ASP  10           HA       ASP  10  -7.730   7.562   7.551
   79    HB2  ASP  10           1HB      ASP  10  -6.718   7.824   9.733
   80    HB3  ASP  10           2HB      ASP  10  -8.232   7.408  10.529
   81    H    VAL  11           H        VAL  11  -9.319   6.849   6.220
   82    HA   VAL  11           HA       VAL  11 -11.672   5.537   7.236
   83    HB   VAL  11           HB       VAL  11 -10.515   5.408   4.442
   84   HG11  VAL  11          1HG1      VAL  11 -12.195   3.706   4.938
   85   HG12  VAL  11          2HG1      VAL  11 -12.799   4.883   3.770
   86   HG13  VAL  11          3HG1      VAL  11 -13.318   4.964   5.455
   87   HG21  VAL  11          3HG2      VAL  11 -10.847   7.733   5.043
   88   HG22  VAL  11          1HG2      VAL  11 -12.487   7.385   5.588
   89   HG23  VAL  11          2HG2      VAL  11 -12.073   7.231   3.882
   90    H    LYS  12           H        LYS  12 -11.596   3.549   8.087
   91    HA   LYS  12           HA       LYS  12  -9.149   2.072   7.768
   92    HB2  LYS  12           1HB      LYS  12 -11.466   1.767   9.644
   93    HB3  LYS  12           2HB      LYS  12 -10.185   0.561   9.538
   94    HG2  LYS  12           1HG      LYS  12  -8.543   2.378  10.013
   95    HG3  LYS  12           2HG      LYS  12  -9.908   3.456  10.304
   96    HD2  LYS  12           1HD      LYS  12 -10.683   2.015  12.104
   97    HD3  LYS  12           2HD      LYS  12  -9.353   0.896  11.796
   98    HE2  LYS  12           1HE      LYS  12  -8.917   2.397  13.706
   99    HE3  LYS  12           2HE      LYS  12  -7.736   2.580  12.409
  100    HZ1  LYS  12           3HZ      LYS  12  -8.740   4.586  11.711
  101    HZ2  LYS  12           1HZ      LYS  12  -8.573   4.697  13.398
  102    HZ3  LYS  12           2HZ      LYS  12 -10.092   4.355  12.720
  103    H    TRP  13           H        TRP  13  -9.063  -0.181   7.389
  104    HA   TRP  13           HA       TRP  13 -10.562  -0.789   5.023
  105    HB2  TRP  13           1HB      TRP  13  -8.129  -1.749   6.320
  106    HB3  TRP  13           2HB      TRP  13  -9.085  -3.042   5.598
  107    HD1  TRP  13           HD1      TRP  13  -9.997  -2.169   2.953
  108    HE1  TRP  13           HE1      TRP  13  -8.457  -1.327   1.082
  109    HE3  TRP  13           HE3      TRP  13  -5.965  -0.816   5.785
  110    HZ2  TRP  13           HZ2      TRP  13  -5.858  -0.239   0.833
  111    HZ3  TRP  13           HZ3      TRP  13  -3.990   0.112   4.652
  112    HH2  TRP  13           HH2      TRP  13  -3.939   0.393   2.224
  113    H    GLU  14           H        GLU  14 -11.855  -2.570   4.642
  114    HA   GLU  14           HA       GLU  14 -13.187  -3.645   7.005
  115    HB2  GLU  14           1HB      GLU  14 -14.377  -2.836   4.865
  116    HB3  GLU  14           2HB      GLU  14 -13.830  -4.346   4.147
  117    HG2  GLU  14           1HG      GLU  14 -15.136  -5.643   5.589
  118    HG3  GLU  14           2HG      GLU  14 -15.388  -4.300   6.704
  119    H    LYS  15           H        LYS  15 -11.192  -4.664   4.306
  120    HA   LYS  15           HA       LYS  15 -10.488  -7.051   5.876
  121    HB2  LYS  15           1HB      LYS  15 -10.123  -6.749   2.887
  122    HB3  LYS  15           2HB      LYS  15  -9.867  -8.196   3.846
  123    HG2  LYS  15           1HG      LYS  15 -12.384  -8.015   4.385
  124    HG3  LYS  15           2HG      LYS  15 -12.438  -6.932   2.991
  125    HD2  LYS  15           1HD      LYS  15 -11.195  -8.803   1.743
  126    HD3  LYS  15           2HD      LYS  15 -11.676  -9.835   3.088
  127    HE2  LYS  15           1HE      LYS  15 -13.443  -8.384   1.133
  128    HE3  LYS  15           2HE      LYS  15 -13.300 -10.120   1.385
  129    HZ1  LYS  15           3HZ      LYS  15 -14.479  -8.150   3.263
  130    HZ2  LYS  15           1HZ      LYS  15 -14.252  -9.795   3.622
  131    HZ3  LYS  15           2HZ      LYS  15 -15.308  -9.328   2.380
  132    HA   PRO  16           HA       PRO  16  -6.984  -4.216   6.349
  133    HB2  PRO  16           1HB      PRO  16  -6.038  -6.449   8.056
  134    HB3  PRO  16           2HB      PRO  16  -6.200  -4.732   8.433
  135    HG2  PRO  16           1HG      PRO  16  -7.921  -6.508   9.418
  136    HG3  PRO  16           2HG      PRO  16  -8.469  -4.908   8.880
  137    HD2  PRO  16           1HD      PRO  16  -8.696  -7.554   7.499
  138    HD3  PRO  16           2HD      PRO  16  -9.877  -6.232   7.601
  139    H    VAL  17           H        VAL  17  -4.916  -4.122   5.576
  140    HA   VAL  17           HA       VAL  17  -4.094  -6.380   3.892
  141    HB   VAL  17           HB       VAL  17  -3.117  -3.518   3.827
  142   HG11  VAL  17          1HG1      VAL  17  -1.469  -5.047   2.945
  143   HG12  VAL  17          2HG1      VAL  17  -2.205  -4.146   1.618
  144   HG13  VAL  17          3HG1      VAL  17  -2.684  -5.816   1.925
  145   HG21  VAL  17          3HG2      VAL  17  -4.477  -3.300   1.790
  146   HG22  VAL  17          1HG2      VAL  17  -5.462  -3.622   3.217
  147   HG23  VAL  17          2HG2      VAL  17  -5.126  -4.916   2.067
  148    H    THR  18           H        THR  18  -2.316  -7.517   4.339
  149    HA   THR  18           HA       THR  18  -0.529  -6.539   6.468
  150    HB   THR  18           HB       THR  18  -0.793  -9.397   5.532
  151    HG1  THR  18           HG1      THR  18  -2.697  -8.086   6.655
  152   HG21  THR  18          3HG2      THR  18   1.240  -8.833   6.792
  153   HG22  THR  18          1HG2      THR  18   0.184  -9.899   7.722
  154   HG23  THR  18          2HG2      THR  18   0.247  -8.176   8.095
  155    H    ILE  19           H        ILE  19   1.161  -5.568   5.565
  156    HA   ILE  19           HA       ILE  19   2.195  -6.504   3.010
  157    HB   ILE  19           HB       ILE  19   1.911  -4.083   3.341
  158   HG12  ILE  19          1HG1      ILE  19   4.263  -3.381   2.727
  159   HG13  ILE  19          2HG1      ILE  19   4.747  -5.049   3.007
  160   HG21  ILE  19          1HG2      ILE  19   3.420  -2.832   4.831
  161   HG22  ILE  19          2HG2      ILE  19   3.984  -4.364   5.505
  162   HG23  ILE  19          3HG2      ILE  19   2.300  -3.880   5.706
  163   HD11  ILE  19          3HD1      ILE  19   2.703  -4.129   1.008
  164   HD12  ILE  19          1HD1      ILE  19   3.239  -5.790   1.261
  165   HD13  ILE  19          2HD1      ILE  19   4.369  -4.582   0.649
  166    H    SER  20           H        SER  20   3.661  -8.059   2.993
  167    HA   SER  20           HA       SER  20   5.071  -8.720   5.423
  168    HB2  SER  20           1HB      SER  20   4.051 -10.471   3.933
  169    HB3  SER  20           2HB      SER  20   5.267 -10.073   2.720
  170    HG   SER  20           HG       SER  20   5.754 -11.887   4.184
  171    H    LEU  21           H        LEU  21   6.620  -7.222   5.795
  172    HA   LEU  21           HA       LEU  21   8.501  -6.470   3.733
  173    HB2  LEU  21           1HB      LEU  21   8.620  -5.960   6.710
  174    HB3  LEU  21           2HB      LEU  21   9.585  -5.167   5.479
  175    HG   LEU  21           HG       LEU  21   6.594  -4.903   5.803
  176   HD11  LEU  21          1HD1      LEU  21   8.830  -2.977   6.403
  177   HD12  LEU  21          2HD1      LEU  21   7.811  -3.795   7.585
  178   HD13  LEU  21          3HD1      LEU  21   7.109  -2.608   6.484
  179   HD21  LEU  21          3HD2      LEU  21   7.280  -4.715   3.472
  180   HD22  LEU  21          1HD2      LEU  21   8.495  -3.518   3.916
  181   HD23  LEU  21          2HD2      LEU  21   6.782  -3.148   4.111
  182    H    GLN  22           H        GLN  22  10.419  -7.411   3.355
  183    HA   GLN  22           HA       GLN  22  10.904 -10.026   3.902
  184    HB2  GLN  22           1HB      GLN  22  12.091  -8.715   2.191
  185    HB3  GLN  22           2HB      GLN  22  13.011  -7.905   3.453
  186    HG2  GLN  22           1HG      GLN  22  13.924 -10.117   4.120
  187    HG3  GLN  22           2HG      GLN  22  13.103 -10.823   2.730
  188   HE21  GLN  22          2HE2      GLN  22  15.024 -11.489   1.806
  189   HE22  GLN  22          1HE2      GLN  22  16.135 -10.377   1.074
  190    H    ASN  23           H        ASN  23  12.523  -7.334   5.594
  191    HA   ASN  23           HA       ASN  23  13.018  -9.187   7.835
  192    HB2  ASN  23           1HB      ASN  23  14.653  -6.884   6.783
  193    HB3  ASN  23           2HB      ASN  23  14.877  -7.501   8.415
  194   HD21  ASN  23          2HD2      ASN  23  16.992  -8.119   7.931
  195   HD22  ASN  23          1HD2      ASN  23  17.331  -9.522   6.972
  196    H    GLY  24           H        GLY  24  11.017  -6.823   6.909
  197    HA2  GLY  24           1HA      GLY  24  11.016  -5.383   9.472
  198    HA3  GLY  24           2HA      GLY  24  10.196  -4.866   8.008
  199    H    ALA  25           H        ALA  25   9.574  -8.019   8.105
  200    HA   ALA  25           HA       ALA  25   7.999  -9.441   8.905
  201    HB1  ALA  25           3HB      ALA  25   7.370  -7.358  10.991
  202    HB2  ALA  25           1HB      ALA  25   8.568  -8.643  11.161
  203    HB3  ALA  25           2HB      ALA  25   6.858  -9.046  10.996
  204    HA   PRO  26           HA       PRO  26   4.238  -8.213   6.816
  205    HB2  PRO  26           1HB      PRO  26   2.892 -10.175   8.572
  206    HB3  PRO  26           2HB      PRO  26   2.984 -10.122   6.808
  207    HG2  PRO  26           1HG      PRO  26   4.353 -11.941   8.213
  208    HG3  PRO  26           2HG      PRO  26   5.030 -11.202   6.750
  209    HD2  PRO  26           1HD      PRO  26   5.613 -10.601   9.623
  210    HD3  PRO  26           2HD      PRO  26   6.728 -10.703   8.243
  211    H    ARG  27           H        ARG  27   3.720  -6.214   7.492
  212    HA   ARG  27           HA       ARG  27   2.614  -5.872  10.183
  213    HB2  ARG  27           1HB      ARG  27   3.608  -3.845   8.174
  214    HB3  ARG  27           2HB      ARG  27   2.929  -3.441   9.747
  215    HG2  ARG  27           1HG      ARG  27   4.720  -4.682  10.843
  216    HG3  ARG  27           2HG      ARG  27   5.400  -5.092   9.270
  217    HD2  ARG  27           1HD      ARG  27   5.818  -2.753   8.807
  218    HD3  ARG  27           2HD      ARG  27   5.042  -2.291  10.323
  219    HE   ARG  27           HE       ARG  27   7.326  -4.090  10.522
  220   HH11  ARG  27          1HH1      ARG  27   6.161  -0.780  10.642
  221   HH12  ARG  27          2HH1      ARG  27   7.456  -0.226  11.667
  222   HH21  ARG  27          1HH2      ARG  27   9.023  -3.372  11.884
  223   HH22  ARG  27          2HH2      ARG  27   9.086  -1.705  12.372
  224    H    ILE  28           H        ILE  28   0.583  -5.105  10.547
  225    HA   ILE  28           HA       ILE  28  -1.237  -5.460   8.285
  226    HB   ILE  28           HB       ILE  28  -1.874  -5.311  11.237
  227   HG12  ILE  28          1HG1      ILE  28  -1.681  -7.741   9.444
  228   HG13  ILE  28          2HG1      ILE  28  -0.465  -7.269  10.627
  229   HG21  ILE  28          1HG2      ILE  28  -4.041  -6.253  10.583
  230   HG22  ILE  28          2HG2      ILE  28  -3.560  -6.177   8.889
  231   HG23  ILE  28          3HG2      ILE  28  -3.754  -4.690   9.818
  232   HD11  ILE  28          3HD1      ILE  28  -3.310  -8.043  11.226
  233   HD12  ILE  28          1HD1      ILE  28  -2.102  -7.561  12.415
  234   HD13  ILE  28          2HD1      ILE  28  -1.878  -9.040  11.484
  235    H    PHE  29           H        PHE  29  -2.102  -3.753   7.327
  236    HA   PHE  29           HA       PHE  29  -2.075  -1.167   8.652
  237    HB2  PHE  29           1HB      PHE  29  -2.937  -1.990   5.874
  238    HB3  PHE  29           2HB      PHE  29  -2.990  -0.336   6.477
  239    HD1  PHE  29           HD2      PHE  29  -0.588   0.171   7.792
  240    HD2  PHE  29           HD1      PHE  29  -1.218  -2.305   4.388
  241    HE1  PHE  29           HE2      PHE  29   1.755   0.497   7.127
  242    HE2  PHE  29           HE1      PHE  29   1.126  -1.983   3.718
  243    HZ   PHE  29           HZ       PHE  29   2.614  -0.581   5.090
  244    H    ASN  30           H        ASN  30  -3.668  -0.531   9.869
  245    HA   ASN  30           HA       ASN  30  -6.228  -1.891   9.850
  246    HB2  ASN  30           1HB      ASN  30  -5.303   0.507  11.458
  247    HB3  ASN  30           2HB      ASN  30  -6.772  -0.418  11.743
  248   HD21  ASN  30          2HD2      ASN  30  -3.301  -0.393  11.965
  249   HD22  ASN  30          1HD2      ASN  30  -3.168  -1.745  13.043
  250    H    GLY  31           H        GLY  31  -4.866   1.210   8.951
  251    HA2  GLY  31           1HA      GLY  31  -7.445   1.905   7.726
  252    HA3  GLY  31           2HA      GLY  31  -6.484   3.099   8.581
  253    H    VAL  32           H        VAL  32  -7.390   3.229   5.869
  254    HA   VAL  32           HA       VAL  32  -5.298   2.589   4.071
  255    HB   VAL  32           HB       VAL  32  -7.392   4.754   3.771
  256   HG11  VAL  32          1HG1      VAL  32  -7.042   4.427   1.364
  257   HG12  VAL  32          2HG1      VAL  32  -5.748   3.282   1.712
  258   HG13  VAL  32          3HG1      VAL  32  -5.577   4.977   2.174
  259   HG21  VAL  32          3HG2      VAL  32  -8.448   2.615   4.230
  260   HG22  VAL  32          1HG2      VAL  32  -7.490   1.847   2.965
  261   HG23  VAL  32          2HG2      VAL  32  -8.693   3.065   2.543
  262    H    TYR  33           H        TYR  33  -5.947   5.312   6.170
  263    HA   TYR  33           HA       TYR  33  -3.979   7.056   5.093
  264    HB2  TYR  33           1HB      TYR  33  -5.765   7.880   6.566
  265    HB3  TYR  33           2HB      TYR  33  -5.125   6.919   7.894
  266    HD1  TYR  33           HD1      TYR  33  -4.600   9.893   5.808
  267    HD2  TYR  33           HD2      TYR  33  -3.147   7.625   9.104
  268    HE1  TYR  33           HE1      TYR  33  -3.153  11.770   6.456
  269    HE2  TYR  33           HE2      TYR  33  -1.698   9.499   9.762
  270    HH   TYR  33           HH       TYR  33  -0.613  11.464   8.628
  271    H    GLU  34           H        GLU  34  -3.963   4.517   7.510
  272    HA   GLU  34           HA       GLU  34  -1.355   4.924   8.495
  273    HB2  GLU  34           1HB      GLU  34  -3.029   3.563   9.650
  274    HB3  GLU  34           2HB      GLU  34  -3.000   2.394   8.341
  275    HG2  GLU  34           1HG      GLU  34  -0.801   1.707   8.884
  276    HG3  GLU  34           2HG      GLU  34  -0.587   3.060   9.994
  277    H    ALA  35           H        ALA  35  -2.622   3.051   5.789
  278    HA   ALA  35           HA       ALA  35  -0.134   1.918   5.004
  279    HB1  ALA  35           3HB      ALA  35  -2.584   2.460   3.327
  280    HB2  ALA  35           1HB      ALA  35  -2.292   1.004   4.278
  281    HB3  ALA  35           2HB      ALA  35  -1.250   1.385   2.907
  282    H    PHE  36           H        PHE  36  -1.969   4.738   3.893
  283    HA   PHE  36           HA       PHE  36  -0.227   5.729   1.971
  284    HB2  PHE  36           1HB      PHE  36  -2.499   6.585   2.371
  285    HB3  PHE  36           2HB      PHE  36  -1.983   7.258   3.909
  286    HD1  PHE  36           HD1      PHE  36  -1.689   7.557   0.254
  287    HD2  PHE  36           HD2      PHE  36  -0.865   9.347   4.026
  288    HE1  PHE  36           HE1      PHE  36  -1.139   9.673  -0.874
  289    HE2  PHE  36           HE2      PHE  36  -0.308  11.464   2.905
  290    HZ   PHE  36           HZ       PHE  36  -0.443  11.629   0.452
  291    H    ASP  37           H        ASP  37  -0.279   6.264   5.457
  292    HA   ASP  37           HA       ASP  37   1.854   8.056   5.668
  293    HB2  ASP  37           1HB      ASP  37   0.348   7.617   7.528
  294    HB3  ASP  37           2HB      ASP  37   0.889   5.944   7.609
  295    H    PHE  38           H        PHE  38   1.824   4.513   5.809
  296    HA   PHE  38           HA       PHE  38   4.569   4.119   6.235
  297    HB2  PHE  38           1HB      PHE  38   3.005   2.314   6.563
  298    HB3  PHE  38           2HB      PHE  38   2.497   2.382   4.882
  299    HD1  PHE  38           HD2      PHE  38   5.476   1.699   7.010
  300    HD2  PHE  38           HD1      PHE  38   3.483   0.982   3.311
  301    HE1  PHE  38           HE2      PHE  38   7.148  -0.013   6.437
  302    HE2  PHE  38           HE1      PHE  38   5.151  -0.726   2.741
  303    HZ   PHE  38           HZ       PHE  38   6.984  -1.229   4.300
  304    H    LEU  39           H        LEU  39   2.696   4.470   3.271
  305    HA   LEU  39           HA       LEU  39   4.689   3.796   1.427
  306    HB2  LEU  39           1HB      LEU  39   2.371   5.705   1.147
  307    HB3  LEU  39           2HB      LEU  39   3.347   5.124  -0.190
  308    HG   LEU  39           HG       LEU  39   1.680   3.368   1.612
  309   HD11  LEU  39          1HD1      LEU  39   0.190   3.150  -0.315
  310   HD12  LEU  39          2HD1      LEU  39   1.158   4.332  -1.196
  311   HD13  LEU  39          3HD1      LEU  39   0.275   4.817   0.253
  312   HD21  LEU  39          3HD2      LEU  39   2.132   1.640  -0.050
  313   HD22  LEU  39          1HD2      LEU  39   3.630   2.237   0.665
  314   HD23  LEU  39          2HD2      LEU  39   3.153   2.762  -0.950
  315    H    GLN  40           H        GLN  40   3.956   6.882   2.989
  316    HA   GLN  40           HA       GLN  40   5.996   8.230   1.436
  317    HB2  GLN  40           1HB      GLN  40   4.273   9.212   3.719
  318    HB3  GLN  40           2HB      GLN  40   5.415  10.214   2.833
  319    HG2  GLN  40           1HG      GLN  40   4.131   9.699   0.753
  320    HG3  GLN  40           2HG      GLN  40   2.931   8.894   1.763
  321   HE21  GLN  40          2HE2      GLN  40   2.653  11.231   0.040
  322   HE22  GLN  40          1HE2      GLN  40   2.082  12.513   1.053
  323    H    HIS  41           H        HIS  41   5.844   6.469   4.350
  324    HA   HIS  41           HA       HIS  41   8.166   7.644   5.562
  325    HB2  HIS  41           1HB      HIS  41   6.442   5.296   6.110
  326    HB3  HIS  41           2HB      HIS  41   8.109   5.175   6.659
  327    HD1  HIS  41           HD1      HIS  41   8.833   6.687   8.604
  328    HD2  HIS  41           HD2      HIS  41   4.870   7.188   7.457
  329    HE1  HIS  41           HE1      HIS  41   7.755   8.015  10.448
  330    HE2  HIS  41           HE2      HIS  41   5.325   8.169   9.804
  331    H    GLU  42           H        GLU  42   7.639   4.428   4.157
  332    HA   GLU  42           HA       GLU  42   9.769   4.562   2.346
  333    HB2  GLU  42           1HB      GLU  42  11.179   4.500   4.363
  334    HB3  GLU  42           2HB      GLU  42  10.396   3.008   4.867
  335    HG2  GLU  42           1HG      GLU  42  11.258   1.876   2.893
  336    HG3  GLU  42           2HG      GLU  42  12.022   3.373   2.361
  337    H    TRP  43           H        TRP  43   8.141   3.680   1.066
  338    HA   TRP  43           HA       TRP  43   7.118   1.056   1.558
  339    HB2  TRP  43           1HB      TRP  43   5.766   2.249   0.086
  340    HB3  TRP  43           2HB      TRP  43   7.137   2.950  -0.768
  341    HD1  TRP  43           HD1      TRP  43   8.139   1.622  -2.784
  342    HE1  TRP  43           HE1      TRP  43   7.385  -0.438  -4.099
  343    HE3  TRP  43           HE3      TRP  43   4.451  -0.043   0.355
  344    HZ2  TRP  43           HZ2      TRP  43   5.452  -2.485  -3.877
  345    HZ3  TRP  43           HZ3      TRP  43   3.193  -2.057  -0.284
  346    HH2  TRP  43           HH2      TRP  43   3.684  -3.250  -2.354
  347    HA   PRO  44           HA       PRO  44  10.748  -1.290   0.442
  348    HB2  PRO  44           1HB      PRO  44   9.454  -3.600  -0.311
  349    HB3  PRO  44           2HB      PRO  44   9.823  -3.160   1.360
  350    HG2  PRO  44           1HG      PRO  44   7.272  -2.843  -0.167
  351    HG3  PRO  44           2HG      PRO  44   7.517  -3.368   1.509
  352    HD2  PRO  44           1HD      PRO  44   6.719  -0.875   0.925
  353    HD3  PRO  44           2HD      PRO  44   7.827  -1.203   2.275
  354    H    ALA  45           H        ALA  45  11.652  -0.529  -1.321
  355    HA   ALA  45           HA       ALA  45  12.528  -0.820  -3.412
  356    HB1  ALA  45           3HB      ALA  45  11.378  -2.963  -3.721
  357    HB2  ALA  45           1HB      ALA  45  11.402  -1.998  -5.196
  358    HB3  ALA  45           2HB      ALA  45   9.929  -2.102  -4.234
  359    H    ARG  46           H        ARG  46  11.791  -0.055  -5.759
  360    HA   ARG  46           HA       ARG  46  10.256   2.422  -5.403
  361    HB2  ARG  46           1HB      ARG  46  12.009   3.697  -6.535
  362    HB3  ARG  46           2HB      ARG  46  12.650   2.940  -5.081
  363    HG2  ARG  46           1HG      ARG  46  13.649   1.172  -6.431
  364    HG3  ARG  46           2HG      ARG  46  12.987   1.906  -7.891
  365    HD2  ARG  46           1HD      ARG  46  14.305   3.954  -7.376
  366    HD3  ARG  46           2HD      ARG  46  15.053   3.083  -6.035
  367    HE   ARG  46           HE       ARG  46  15.239   1.749  -8.595
  368   HH11  ARG  46          1HH1      ARG  46  16.769   4.043  -6.421
  369   HH12  ARG  46          2HH1      ARG  46  18.365   3.766  -7.062
  370   HH21  ARG  46          1HH2      ARG  46  17.314   1.430  -9.452
  371   HH22  ARG  46          2HH2      ARG  46  18.668   2.305  -8.806
  372    H    GLY  47           H        GLY  47  10.337   3.558  -7.750
  373    HA2  GLY  47           1HA      GLY  47  10.678   2.204 -10.100
  374    HA3  GLY  47           2HA      GLY  47   9.066   1.737  -9.569
  375    H    ASP  48           H        ASP  48   7.406   3.141  -9.778
  376    HA   ASP  48           HA       ASP  48   7.685   5.929  -9.922
  377    HB2  ASP  48           1HB      ASP  48   7.056   6.315 -12.290
  378    HB3  ASP  48           2HB      ASP  48   8.643   5.584 -12.119
  379    H    ARG  49           H        ARG  49   5.531   3.785 -11.771
  380    HA   ARG  49           HA       ARG  49   3.294   5.390 -10.961
  381    HB2  ARG  49           1HB      ARG  49   3.402   2.865 -12.618
  382    HB3  ARG  49           2HB      ARG  49   2.023   3.955 -12.487
  383    HG2  ARG  49           1HG      ARG  49   3.091   5.652 -13.660
  384    HG3  ARG  49           2HG      ARG  49   4.690   4.961 -13.391
  385    HD2  ARG  49           1HD      ARG  49   3.432   2.969 -14.770
  386    HD3  ARG  49           2HD      ARG  49   2.729   4.421 -15.491
  387    HE   ARG  49           HE       ARG  49   5.648   4.227 -15.217
  388   HH11  ARG  49          1HH1      ARG  49   2.808   4.338 -17.277
  389   HH12  ARG  49          2HH1      ARG  49   3.724   4.608 -18.724
  390   HH21  ARG  49          1HH2      ARG  49   6.846   4.563 -17.110
  391   HH22  ARG  49          2HH2      ARG  49   6.031   4.747 -18.637
  392    H    ALA  50           H        ALA  50   4.644   2.330  -9.990
  393    HA   ALA  50           HA       ALA  50   2.427   1.296  -8.603
  394    HB1  ALA  50           3HB      ALA  50   5.351   0.998  -7.922
  395    HB2  ALA  50           1HB      ALA  50   4.452  -0.013  -9.053
  396    HB3  ALA  50           2HB      ALA  50   4.038  -0.025  -7.337
  397    H    HIS  51           H        HIS  51   4.884   3.642  -7.728
  398    HA   HIS  51           HA       HIS  51   3.975   3.925  -5.012
  399    HB2  HIS  51           1HB      HIS  51   6.351   4.301  -5.820
  400    HB3  HIS  51           2HB      HIS  51   5.780   5.780  -6.583
  401    HD1  HIS  51           HD1      HIS  51   7.292   4.585  -3.572
  402    HD2  HIS  51           HD2      HIS  51   4.619   7.628  -4.525
  403    HE1  HIS  51           HE1      HIS  51   7.361   6.181  -1.632
  404    HE2  HIS  51           HE2      HIS  51   5.942   8.132  -2.358
  405    H    GLU  52           H        GLU  52   3.664   5.667  -8.059
  406    HA   GLU  52           HA       GLU  52   2.318   7.933  -7.108
  407    HB2  GLU  52           1HB      GLU  52   2.296   6.591  -9.808
  408    HB3  GLU  52           2HB      GLU  52   1.485   8.117  -9.487
  409    HG2  GLU  52           1HG      GLU  52   4.432   7.572  -9.240
  410    HG3  GLU  52           2HG      GLU  52   3.634   8.503 -10.506
  411    H    GLN  53           H        GLN  53   0.972   4.970  -8.581
  412    HA   GLN  53           HA       GLN  53  -1.717   5.790  -8.326
  413    HB2  GLN  53           1HB      GLN  53  -0.498   3.052  -8.654
  414    HB3  GLN  53           2HB      GLN  53  -2.232   3.344  -8.658
  415    HG2  GLN  53           1HG      GLN  53  -0.227   4.458 -10.605
  416    HG3  GLN  53           2HG      GLN  53  -1.391   3.172 -10.914
  417   HE21  GLN  53          2HE2      GLN  53  -1.073   5.691 -12.303
  418   HE22  GLN  53          1HE2      GLN  53  -2.588   6.521 -12.162
  419    H    ALA  54           H        ALA  54   0.426   3.984  -6.204
  420    HA   ALA  54           HA       ALA  54  -1.441   3.013  -4.381
  421    HB1  ALA  54           3HB      ALA  54   0.934   2.369  -4.404
  422    HB2  ALA  54           1HB      ALA  54   0.390   2.863  -2.799
  423    HB3  ALA  54           2HB      ALA  54   1.357   3.965  -3.781
  424    H    LEU  55           H        LEU  55   0.299   6.119  -4.395
  425    HA   LEU  55           HA       LEU  55  -0.876   7.110  -2.018
  426    HB2  LEU  55           1HB      LEU  55   0.256   8.648  -4.355
  427    HB3  LEU  55           2HB      LEU  55  -0.071   9.304  -2.763
  428    HG   LEU  55           HG       LEU  55   1.986   7.193  -3.418
  429   HD11  LEU  55          1HD1      LEU  55   3.599   8.936  -2.841
  430   HD12  LEU  55          2HD1      LEU  55   2.281  10.085  -2.620
  431   HD13  LEU  55          3HD1      LEU  55   2.601   9.408  -4.215
  432   HD21  LEU  55          3HD2      LEU  55   2.698   7.458  -1.093
  433   HD22  LEU  55          1HD2      LEU  55   1.043   6.857  -1.196
  434   HD23  LEU  55          2HD2      LEU  55   1.344   8.550  -0.801
  435    H    ARG  56           H        ARG  56  -1.711   7.450  -5.433
  436    HA   ARG  56           HA       ARG  56  -3.802   9.303  -5.136
  437    HB2  ARG  56           1HB      ARG  56  -3.206   7.232  -7.243
  438    HB3  ARG  56           2HB      ARG  56  -4.591   8.308  -7.358
  439    HG2  ARG  56           1HG      ARG  56  -3.249  10.208  -7.579
  440    HG3  ARG  56           2HG      ARG  56  -1.814   9.369  -6.986
  441    HD2  ARG  56           1HD      ARG  56  -1.729   8.025  -8.995
  442    HD3  ARG  56           2HD      ARG  56  -3.234   8.740  -9.570
  443    HE   ARG  56           HE       ARG  56  -2.010  10.448 -10.419
  444   HH11  ARG  56          1HH1      ARG  56  -0.177   9.119  -7.737
  445   HH12  ARG  56          2HH1      ARG  56   1.245  10.059  -8.094
  446   HH21  ARG  56          1HH2      ARG  56  -0.137  11.709 -10.834
  447   HH22  ARG  56          2HH2      ARG  56   1.260  11.523  -9.818
  448    H    LEU  57           H        LEU  57  -3.859   5.749  -5.228
  449    HA   LEU  57           HA       LEU  57  -6.669   5.512  -5.016
  450    HB2  LEU  57           1HB      LEU  57  -4.476   3.572  -4.286
  451    HB3  LEU  57           2HB      LEU  57  -6.181   3.163  -4.336
  452    HG   LEU  57           HG       LEU  57  -4.552   4.093  -6.703
  453   HD11  LEU  57          1HD1      LEU  57  -3.872   1.881  -5.966
  454   HD12  LEU  57          2HD1      LEU  57  -4.768   1.784  -7.482
  455   HD13  LEU  57          3HD1      LEU  57  -5.553   1.348  -5.963
  456   HD21  LEU  57          3HD2      LEU  57  -6.894   4.723  -6.884
  457   HD22  LEU  57          1HD2      LEU  57  -7.383   3.069  -6.518
  458   HD23  LEU  57          2HD2      LEU  57  -6.513   3.421  -8.011
  459    H    CYS  58           H        CYS  58  -4.087   5.567  -2.586
  460    HA   CYS  58           HA       CYS  58  -5.737   5.087  -0.353
  461    HB2  CYS  58           1HB      CYS  58  -3.145   6.637  -0.551
  462    HB3  CYS  58           2HB      CYS  58  -3.912   6.162   0.961
  463    HG   CYS  58           HG       CYS  58  -2.387   4.181  -1.348
  464    H    ARG  59           H        ARG  59  -4.708   8.093  -1.927
  465    HA   ARG  59           HA       ARG  59  -5.936   9.902  -0.190
  466    HB2  ARG  59           1HB      ARG  59  -4.351  10.622  -1.898
  467    HB3  ARG  59           2HB      ARG  59  -5.465  10.135  -3.169
  468    HG2  ARG  59           1HG      ARG  59  -7.078  11.816  -2.348
  469    HG3  ARG  59           2HG      ARG  59  -5.876  12.344  -1.169
  470    HD2  ARG  59           1HD      ARG  59  -4.358  12.958  -2.956
  471    HD3  ARG  59           2HD      ARG  59  -5.494  12.353  -4.161
  472    HE   ARG  59           HE       ARG  59  -6.979  14.180  -2.889
  473   HH11  ARG  59          1HH1      ARG  59  -3.724  14.329  -4.184
  474   HH12  ARG  59          2HH1      ARG  59  -3.805  16.038  -4.512
  475   HH21  ARG  59          1HH2      ARG  59  -7.083  16.428  -3.333
  476   HH22  ARG  59          2HH2      ARG  59  -5.702  17.214  -4.042
  477    H    ALA  60           H        ALA  60  -7.189   8.399  -3.161
  478    HA   ALA  60           HA       ALA  60  -9.687   9.663  -3.174
  479    HB1  ALA  60           3HB      ALA  60  -8.778   8.449  -5.096
  480    HB2  ALA  60           1HB      ALA  60 -10.398   7.889  -4.683
  481    HB3  ALA  60           2HB      ALA  60  -8.990   6.926  -4.234
  482    H    SER  61           H        SER  61  -8.588   6.731  -1.557
  483    HA   SER  61           HA       SER  61 -11.118   5.900  -0.604
  484    HB2  SER  61           1HB      SER  61  -8.395   5.408   0.625
  485    HB3  SER  61           2HB      SER  61  -9.862   4.480   0.933
  486    HG   SER  61           HG       SER  61  -8.309   4.613  -1.432
  487    H    LEU  62           H        LEU  62  -8.589   7.977   0.734
  488    HA   LEU  62           HA       LEU  62  -9.872   8.401   3.247
  489    HB2  LEU  62           1HB      LEU  62  -7.784  10.090   1.864
  490    HB3  LEU  62           2HB      LEU  62  -8.205  10.154   3.565
  491    HG   LEU  62           HG       LEU  62  -6.963   7.774   2.181
  492   HD11  LEU  62          1HD1      LEU  62  -4.943   8.358   3.429
  493   HD12  LEU  62          2HD1      LEU  62  -5.736   9.815   4.028
  494   HD13  LEU  62          3HD1      LEU  62  -5.406   9.637   2.305
  495   HD21  LEU  62          3HD2      LEU  62  -6.646   6.909   4.443
  496   HD22  LEU  62          1HD2      LEU  62  -8.356   7.145   4.081
  497   HD23  LEU  62          2HD2      LEU  62  -7.501   8.304   5.099
  498    H    MET  63           H        MET  63 -10.386   9.625   0.123
  499    HA   MET  63           HA       MET  63 -11.790  11.999   1.101
  500    HB2  MET  63           1HB      MET  63 -11.073  11.077  -1.683
  501    HB3  MET  63           2HB      MET  63 -12.070  12.489  -1.359
  502    HG2  MET  63           1HG      MET  63 -10.235  13.525  -0.141
  503    HG3  MET  63           2HG      MET  63  -9.232  12.105  -0.427
  504    HE1  MET  63           3HE      MET  63 -11.764  13.664  -2.984
  505    HE2  MET  63           1HE      MET  63 -10.752  14.845  -3.816
  506    HE3  MET  63           2HE      MET  63 -11.165  15.077  -2.117
  507    H    GLY  64           H        GLY  64 -12.502   8.875   0.873
  508    HA2  GLY  64           1HA      GLY  64 -14.555   7.857   1.158
  509    HA3  GLY  64           2HA      GLY  64 -15.327   9.409   0.879
  510    H    ASP  65           H        ASP  65 -13.160   8.673  -1.598
  511    HA   ASP  65           HA       ASP  65 -15.399   8.171  -3.389
  512    HB2  ASP  65           1HB      ASP  65 -12.488   8.770  -3.933
  513    HB3  ASP  65           2HB      ASP  65 -13.682   8.477  -5.192
  514    H    VAL  66           H        VAL  66 -12.824   6.490  -1.891
  515    HA   VAL  66           HA       VAL  66 -13.601   4.065  -3.373
  516    HB   VAL  66           HB       VAL  66 -10.850   4.713  -2.278
  517   HG11  VAL  66          1HG1      VAL  66 -11.346   2.348  -1.999
  518   HG12  VAL  66          2HG1      VAL  66 -10.157   2.576  -3.280
  519   HG13  VAL  66          3HG1      VAL  66 -11.837   2.234  -3.688
  520   HG21  VAL  66          3HG2      VAL  66 -10.131   4.625  -4.614
  521   HG22  VAL  66          1HG2      VAL  66 -11.337   5.886  -4.357
  522   HG23  VAL  66          2HG2      VAL  66 -11.801   4.364  -5.117
  523    H    ALA  67           H        ALA  67 -14.148   2.327  -2.145
  524    HA   ALA  67           HA       ALA  67 -14.740   2.778   0.600
  525    HB1  ALA  67           3HB      ALA  67 -14.893   0.218  -0.982
  526    HB2  ALA  67           1HB      ALA  67 -16.171   1.425  -0.848
  527    HB3  ALA  67           2HB      ALA  67 -15.652   0.530   0.578
  528    H    GLY  68           H        GLY  68 -12.208   1.018  -1.104
  529    HA2  GLY  68           1HA      GLY  68 -10.110   1.333   0.360
  530    HA3  GLY  68           2HA      GLY  68 -11.017   0.354   1.500
  531    H    GLU  69           H        GLU  69 -12.121  -1.554  -0.162
  532    HA   GLU  69           HA       GLU  69  -9.956  -3.347  -0.301
  533    HB2  GLU  69           1HB      GLU  69 -12.784  -3.526  -1.307
  534    HB3  GLU  69           2HB      GLU  69 -11.637  -4.852  -1.464
  535    HG2  GLU  69           1HG      GLU  69 -11.401  -5.014   0.912
  536    HG3  GLU  69           2HG      GLU  69 -12.370  -3.560   1.150
  537    H    ILE  70           H        ILE  70 -11.466  -1.347  -2.756
  538    HA   ILE  70           HA       ILE  70 -10.324  -2.471  -5.044
  539    HB   ILE  70           HB       ILE  70 -10.784   0.468  -4.481
  540   HG12  ILE  70          1HG1      ILE  70 -12.562  -1.565  -5.851
  541   HG13  ILE  70          2HG1      ILE  70 -12.801  -0.947  -4.221
  542   HG21  ILE  70          1HG2      ILE  70  -9.294   0.140  -6.375
  543   HG22  ILE  70          2HG2      ILE  70 -10.869   0.713  -6.923
  544   HG23  ILE  70          3HG2      ILE  70 -10.439  -0.988  -7.100
  545   HD11  ILE  70          3HD1      ILE  70 -12.894   0.678  -6.751
  546   HD12  ILE  70          1HD1      ILE  70 -13.140   1.294  -5.118
  547   HD13  ILE  70          2HD1      ILE  70 -14.281   0.139  -5.805
  548    H    ALA  71           H        ALA  71  -9.018  -0.064  -2.795
  549    HA   ALA  71           HA       ALA  71  -6.500   0.176  -4.108
  550    HB1  ALA  71           3HB      ALA  71  -7.399   1.950  -2.674
  551    HB2  ALA  71           1HB      ALA  71  -5.810   1.420  -2.128
  552    HB3  ALA  71           2HB      ALA  71  -7.258   0.889  -1.273
  553    H    ARG  72           H        ARG  72  -7.816  -1.889  -1.622
  554    HA   ARG  72           HA       ARG  72  -5.446  -2.965  -0.589
  555    HB2  ARG  72           1HB      ARG  72  -7.374  -3.460   0.635
  556    HB3  ARG  72           2HB      ARG  72  -8.266  -3.970  -0.793
  557    HG2  ARG  72           1HG      ARG  72  -6.858  -5.974  -0.936
  558    HG3  ARG  72           2HG      ARG  72  -6.008  -5.466   0.524
  559    HD2  ARG  72           1HD      ARG  72  -7.857  -5.840   1.879
  560    HD3  ARG  72           2HD      ARG  72  -8.984  -5.777   0.523
  561    HE   ARG  72           HE       ARG  72  -8.155  -7.953  -0.162
  562   HH11  ARG  72          1HH1      ARG  72  -7.368  -6.936   3.102
  563   HH12  ARG  72          2HH1      ARG  72  -7.078  -8.552   3.666
  564   HH21  ARG  72          1HH2      ARG  72  -7.798 -10.072   0.583
  565   HH22  ARG  72          2HH2      ARG  72  -7.335 -10.334   2.248
  566    H    THR  73           H        THR  73  -7.554  -4.249  -3.171
  567    HA   THR  73           HA       THR  73  -5.889  -6.423  -3.822
  568    HB   THR  73           HB       THR  73  -7.794  -5.016  -5.699
  569    HG1  THR  73           HG1      THR  73  -9.375  -6.417  -4.800
  570   HG21  THR  73          3HG2      THR  73  -8.069  -7.263  -6.656
  571   HG22  THR  73          1HG2      THR  73  -6.874  -7.888  -5.521
  572   HG23  THR  73          2HG2      THR  73  -6.393  -6.721  -6.753
  573    H    ALA  74           H        ALA  74  -5.987  -3.098  -4.947
  574    HA   ALA  74           HA       ALA  74  -4.121  -3.438  -7.072
  575    HB1  ALA  74           3HB      ALA  74  -4.046  -1.006  -7.133
  576    HB2  ALA  74           1HB      ALA  74  -4.901  -0.931  -5.593
  577    HB3  ALA  74           2HB      ALA  74  -5.708  -1.583  -7.020
  578    H    PHE  75           H        PHE  75  -3.848  -2.731  -3.655
  579    HA   PHE  75           HA       PHE  75  -1.181  -1.847  -3.584
  580    HB2  PHE  75           1HB      PHE  75  -3.007  -1.913  -1.717
  581    HB3  PHE  75           2HB      PHE  75  -2.396  -3.532  -1.402
  582    HD1  PHE  75           HD2      PHE  75  -1.533   0.046  -1.427
  583    HD2  PHE  75           HD1      PHE  75  -0.342  -3.862  -0.225
  584    HE1  PHE  75           HE2      PHE  75   0.220   1.020  -0.002
  585    HE2  PHE  75           HE1      PHE  75   1.405  -2.891   1.203
  586    HZ   PHE  75           HZ       PHE  75   1.689  -0.448   1.312
  587    H    VAL  76           H        VAL  76  -2.613  -5.069  -3.353
  588    HA   VAL  76           HA       VAL  76  -0.221  -6.528  -3.074
  589    HB   VAL  76           HB       VAL  76  -2.827  -7.397  -4.347
  590   HG11  VAL  76          1HG1      VAL  76  -0.985  -8.877  -4.956
  591   HG12  VAL  76          2HG1      VAL  76  -2.100  -9.677  -3.848
  592   HG13  VAL  76          3HG1      VAL  76  -0.558  -9.058  -3.254
  593   HG21  VAL  76          3HG2      VAL  76  -1.832  -7.698  -1.515
  594   HG22  VAL  76          1HG2      VAL  76  -3.334  -8.362  -2.156
  595   HG23  VAL  76          2HG2      VAL  76  -3.115  -6.616  -2.053
  596    H    ALA  77           H        ALA  77  -2.016  -5.429  -5.913
  597    HA   ALA  77           HA       ALA  77  -0.447  -6.738  -7.860
  598    HB1  ALA  77           3HB      ALA  77  -2.035  -4.187  -8.114
  599    HB2  ALA  77           1HB      ALA  77  -2.652  -5.821  -8.361
  600    HB3  ALA  77           2HB      ALA  77  -1.429  -5.165  -9.451
  601    H    ALA  78           H        ALA  78  -0.178  -3.555  -6.332
  602    HA   ALA  78           HA       ALA  78   2.011  -2.649  -7.887
  603    HB1  ALA  78           3HB      ALA  78   1.211  -1.827  -5.098
  604    HB2  ALA  78           1HB      ALA  78   0.578  -1.136  -6.592
  605    HB3  ALA  78           2HB      ALA  78   2.281  -0.937  -6.179
  606    H    SER  79           H        SER  79   1.741  -4.605  -5.006
  607    HA   SER  79           HA       SER  79   4.462  -4.473  -4.214
  608    HB2  SER  79           1HB      SER  79   2.401  -6.616  -3.637
  609    HB3  SER  79           2HB      SER  79   3.916  -6.379  -2.768
  610    HG   SER  79           HG       SER  79   1.796  -4.486  -2.936
  611    H    ARG  80           H        ARG  80   2.946  -6.004  -6.822
  612    HA   ARG  80           HA       ARG  80   4.534  -8.344  -7.012
  613    HB2  ARG  80           1HB      ARG  80   2.449  -8.265  -8.192
  614    HB3  ARG  80           2HB      ARG  80   2.937  -6.825  -9.074
  615    HG2  ARG  80           1HG      ARG  80   4.581  -8.074 -10.307
  616    HG3  ARG  80           2HG      ARG  80   4.257  -9.518  -9.344
  617    HD2  ARG  80           1HD      ARG  80   2.149  -8.150 -10.998
  618    HD3  ARG  80           2HD      ARG  80   3.194  -9.414 -11.643
  619    HE   ARG  80           HE       ARG  80   2.225 -10.688  -9.563
  620   HH11  ARG  80          1HH1      ARG  80   0.545  -8.559 -11.770
  621   HH12  ARG  80          2HH1      ARG  80  -0.975  -9.395 -11.631
  622   HH21  ARG  80          1HH2      ARG  80   0.254 -11.827  -9.402
  623   HH22  ARG  80          2HH2      ARG  80  -1.133 -11.276 -10.300
  624    H    GLN  81           H        GLN  81   4.974  -5.027  -8.176
  625    HA   GLN  81           HA       GLN  81   7.187  -5.579  -9.862
  626    HB2  GLN  81           1HB      GLN  81   6.365  -3.051  -8.433
  627    HB3  GLN  81           2HB      GLN  81   7.753  -3.133  -9.507
  628    HG2  GLN  81           1HG      GLN  81   6.151  -3.951 -11.288
  629    HG3  GLN  81           2HG      GLN  81   4.852  -3.482 -10.192
  630   HE21  GLN  81          2HE2      GLN  81   5.559  -2.435 -12.828
  631   HE22  GLN  81          1HE2      GLN  81   5.828  -0.736 -12.615
  632    H    ALA  82           H        ALA  82   6.875  -4.938  -6.439
  633    HA   ALA  82           HA       ALA  82   9.729  -4.905  -5.989
  634    HB1  ALA  82           3HB      ALA  82   9.138  -4.743  -3.623
  635    HB2  ALA  82           1HB      ALA  82   7.444  -5.038  -4.019
  636    HB3  ALA  82           2HB      ALA  82   8.238  -3.567  -4.581
  637    H    HIS  83           H        HIS  83   7.368  -7.231  -6.462
  638    HA   HIS  83           HA       HIS  83   7.229  -9.483  -6.270
  639    HB2  HIS  83           1HB      HIS  83  10.204  -9.387  -5.708
  640    HB3  HIS  83           2HB      HIS  83   9.284 -10.801  -6.197
  641    HD1  HIS  83           HD1      HIS  83   8.179 -10.570  -8.723
  642    HD2  HIS  83           HD2      HIS  83  11.333  -8.035  -7.746
  643    HE1  HIS  83           HE1      HIS  83   9.111  -9.764 -10.911
  644    HE2  HIS  83           HE2      HIS  83  11.157  -8.429 -10.295
  645    H    CYS  84           H        CYS  84   7.068  -7.670  -3.889
  646    HA   CYS  84           HA       CYS  84   7.986  -9.467  -1.758
  647    HB2  CYS  84           1HB      CYS  84   8.625  -6.942  -1.929
  648    HB3  CYS  84           2HB      CYS  84   7.004  -6.664  -1.304
  649    HG   CYS  84           HG       CYS  84   7.399  -7.881   1.128
  650    H    LEU  85           H        LEU  85   5.968 -10.656  -2.701
  651    HA   LEU  85           HA       LEU  85   3.455  -9.682  -1.608
  652    HB2  LEU  85           1HB      LEU  85   4.113 -12.193  -3.154
  653    HB3  LEU  85           2HB      LEU  85   2.500 -11.709  -2.668
  654    HG   LEU  85           HG       LEU  85   4.280 -10.153  -4.539
  655   HD11  LEU  85          1HD1      LEU  85   3.533 -12.262  -5.525
  656   HD12  LEU  85          2HD1      LEU  85   2.750 -10.881  -6.293
  657   HD13  LEU  85          3HD1      LEU  85   1.865 -11.859  -5.122
  658   HD21  LEU  85          3HD2      LEU  85   2.758  -8.727  -3.300
  659   HD22  LEU  85          1HD2      LEU  85   1.402  -9.763  -3.744
  660   HD23  LEU  85          2HD2      LEU  85   2.257  -8.848  -4.985
  661    H    MET  86           H        MET  86   2.375 -10.581   0.100
  662    HA   MET  86           HA       MET  86   3.937 -11.830   2.092
  663    HB2  MET  86           1HB      MET  86   2.016 -10.372   2.614
  664    HB3  MET  86           2HB      MET  86   0.926 -11.593   1.966
  665    HG2  MET  86           1HG      MET  86   1.731 -13.172   3.689
  666    HG3  MET  86           2HG      MET  86   2.722 -11.884   4.368
  667    HE1  MET  86           3HE      MET  86  -1.895 -11.908   4.346
  668    HE2  MET  86           1HE      MET  86  -0.891 -13.220   3.728
  669    HE3  MET  86           2HE      MET  86  -0.949 -11.676   2.877
  670    H    GLU  87           H        GLU  87   1.528 -13.099  -0.144
  671    HA   GLU  87           HA       GLU  87   1.390 -15.686   1.002
  672    HB2  GLU  87           1HB      GLU  87  -0.376 -14.818  -0.461
  673    HB3  GLU  87           2HB      GLU  87   0.746 -14.781  -1.815
  674    HG2  GLU  87           1HG      GLU  87   0.818 -17.107  -1.971
  675    HG3  GLU  87           2HG      GLU  87   0.142 -17.326  -0.357
  676    H    ASP  88           H        ASP  88   2.609 -17.452   0.712
  677    HA   ASP  88           HA       ASP  88   5.305 -17.068   0.056
  678    HB2  ASP  88           1HB      ASP  88   4.452 -18.750   1.682
  679    HB3  ASP  88           2HB      ASP  88   3.860 -19.712   0.331
  680    H    LYS  89           H        LYS  89   2.632 -18.180  -1.853
  681    HA   LYS  89           HA       LYS  89   3.842 -19.425  -3.990
  682    HB2  LYS  89           1HB      LYS  89   1.604 -17.393  -4.077
  683    HB3  LYS  89           2HB      LYS  89   2.038 -18.462  -5.401
  684    HG2  LYS  89           1HG      LYS  89   1.455 -20.398  -4.054
  685    HG3  LYS  89           2HG      LYS  89   1.050 -19.341  -2.696
  686    HD2  LYS  89           1HD      LYS  89  -0.704 -18.288  -4.028
  687    HD3  LYS  89           2HD      LYS  89  -0.284 -19.310  -5.403
  688    HE2  LYS  89           1HE      LYS  89  -1.313 -20.266  -2.733
  689    HE3  LYS  89           2HE      LYS  89  -2.249 -20.155  -4.224
  690    HZ1  LYS  89           3HZ      LYS  89  -0.688 -21.747  -5.233
  691    HZ2  LYS  89           1HZ      LYS  89  -1.522 -22.400  -3.903
  692    HZ3  LYS  89           2HZ      LYS  89   0.093 -21.912  -3.731
  693    H    ALA  90           H        ALA  90   3.584 -15.979  -3.314
  694    HA   ALA  90           HA       ALA  90   4.385 -14.113  -4.299
  695    HB1  ALA  90           3HB      ALA  90   6.498 -14.982  -3.480
  696    HB2  ALA  90           1HB      ALA  90   6.728 -14.159  -5.022
  697    HB3  ALA  90           2HB      ALA  90   6.708 -15.920  -4.958
  698    H    GLU  91           H        GLU  91   6.168 -15.836  -6.718
  699    HA   GLU  91           HA       GLU  91   4.023 -15.549  -8.673
  700    HB2  GLU  91           1HB      GLU  91   6.788 -14.372  -9.040
  701    HB3  GLU  91           2HB      GLU  91   5.551 -14.464 -10.287
  702    HG2  GLU  91           1HG      GLU  91   4.104 -13.015  -8.959
  703    HG3  GLU  91           2HG      GLU  91   5.348 -12.921  -7.712
  704    H    ALA  92           H        ALA  92   3.820 -17.595  -9.269
  705    HA   ALA  92           HA       ALA  92   6.036 -19.412  -9.324
  706    HB1  ALA  92           3HB      ALA  92   3.195 -19.790 -10.271
  707    HB2  ALA  92           1HB      ALA  92   3.808 -20.167  -8.661
  708    HB3  ALA  92           2HB      ALA  92   4.394 -21.066 -10.061
  709    HA   PRO  93           HA       PRO  93   7.206 -18.483 -13.513
  710    HB2  PRO  93           1HB      PRO  93   9.000 -20.482 -13.827
  711    HB3  PRO  93           2HB      PRO  93   9.335 -19.044 -12.854
  712    HG2  PRO  93           1HG      PRO  93   8.465 -21.772 -11.966
  713    HG3  PRO  93           2HG      PRO  93   9.712 -20.714 -11.275
  714    HD2  PRO  93           1HD      PRO  93   7.228 -20.927 -10.219
  715    HD3  PRO  93           2HD      PRO  93   8.173 -19.426 -10.148
  716    H    ASN  94           H        ASN  94   5.504 -21.192 -12.441
  717    HA   ASN  94           HA       ASN  94   4.745 -21.837 -15.188
  718    HB2  ASN  94           1HB      ASN  94   6.497 -23.486 -14.417
  719    HB3  ASN  94           2HB      ASN  94   5.370 -23.999 -13.166
  720   HD21  ASN  94          2HD2      ASN  94   5.279 -26.087 -14.005
  721   HD22  ASN  94          1HD2      ASN  94   4.418 -26.449 -15.463
  722    H    THR  95           H        THR  95   2.608 -22.519 -15.393
  723    HA   THR  95           HA       THR  95   0.854 -21.504 -13.416
  724    HB   THR  95           HB       THR  95   0.078 -23.280 -15.732
  725    HG1  THR  95           HG1      THR  95   0.260 -21.556 -17.047
  726   HG21  THR  95          3HG2      THR  95  -1.999 -21.993 -15.667
  727   HG22  THR  95          1HG2      THR  95  -1.379 -21.041 -14.318
  728   HG23  THR  95          2HG2      THR  95  -1.697 -22.763 -14.110
  729    H    ILE  96           H        ILE  96   1.128 -24.831 -14.700
  730    HA   ILE  96           HA       ILE  96  -0.352 -25.813 -12.393
  731    HB   ILE  96           HB       ILE  96  -0.879 -26.649 -14.680
  732   HG12  ILE  96          1HG1      ILE  96   0.151 -28.766 -12.776
  733   HG13  ILE  96          2HG1      ILE  96  -1.428 -27.997 -12.691
  734   HG21  ILE  96          1HG2      ILE  96   0.638 -28.256 -15.749
  735   HG22  ILE  96          2HG2      ILE  96   1.842 -27.934 -14.502
  736   HG23  ILE  96          3HG2      ILE  96   1.360 -26.653 -15.614
  737   HD11  ILE  96          3HD1      ILE  96  -1.588 -30.205 -13.668
  738   HD12  ILE  96          1HD1      ILE  96  -0.430 -29.754 -14.920
  739   HD13  ILE  96          2HD1      ILE  96  -2.009 -28.972 -14.859
  740    H    ALA  97           H        ALA  97   0.460 -27.476 -10.999
  741    HA   ALA  97           HA       ALA  97   3.307 -27.316 -10.529
  742    HB1  ALA  97           3HB      ALA  97   1.203 -28.950  -9.110
  743    HB2  ALA  97           1HB      ALA  97   1.737 -27.335  -8.645
  744    HB3  ALA  97           2HB      ALA  97   2.861 -28.691  -8.567
  745    H    SER  98           H        SER  98   4.734 -28.607 -11.458
  746    HA   SER  98           HA       SER  98   4.040 -30.763 -13.130
  747    HB2  SER  98           1HB      SER  98   6.712 -30.062 -11.888
  748    HB3  SER  98           2HB      SER  98   6.470 -31.195 -13.221
  749    HG   SER  98           HG       SER  98   5.621 -29.466 -14.448
  750    H    GLY  99           H        GLY  99   3.854 -32.880 -12.789
  751    HA2  GLY  99           1HA      GLY  99   4.513 -34.832 -11.384
  752    HA3  GLY  99           2HA      GLY  99   4.180 -33.806  -9.995
  753    H    SER 100           H        SER 100   2.011 -32.976 -12.271
  754    HA   SER 100           HA       SER 100  -0.120 -34.415 -10.955
  755    HB2  SER 100           1HB      SER 100  -0.240 -32.415 -13.226
  756    HB3  SER 100           2HB      SER 100  -1.599 -32.962 -12.240
  757    HG   SER 100           HG       SER 100   0.544 -31.260 -11.562
  Start of MODEL   14
    1    H1   MET   1           1H       MET   1  -5.460  25.565   5.949
    2    H2   MET   1           2H       MET   1  -4.657  24.142   5.507
    3    H3   MET   1           3H       MET   1  -4.593  24.685   7.113
    4    HA   MET   1           HA       MET   1  -6.987  23.710   5.669
    5    HB2  MET   1           1HB      MET   1  -5.417  21.944   6.374
    6    HB3  MET   1           2HB      MET   1  -5.459  22.562   8.018
    7    HG2  MET   1           1HG      MET   1  -7.836  22.031   8.162
    8    HG3  MET   1           2HG      MET   1  -7.800  21.419   6.509
    9    HE1  MET   1           3HE      MET   1  -6.549  19.223   5.761
   10    HE2  MET   1           1HE      MET   1  -5.515  18.271   6.827
   11    HE3  MET   1           2HE      MET   1  -5.037  19.904   6.362
   12    H    GLU   2           H        GLU   2  -8.471  25.200   6.141
   13    HA   GLU   2           HA       GLU   2  -8.555  26.750   8.486
   14    HB2  GLU   2           1HB      GLU   2  -9.638  27.475   6.450
   15    HB3  GLU   2           2HB      GLU   2 -10.713  26.085   6.483
   16    HG2  GLU   2           1HG      GLU   2 -11.742  26.916   8.528
   17    HG3  GLU   2           2HG      GLU   2 -10.657  28.306   8.509
   18    H    VAL   3           H        VAL   3 -10.601  24.004   7.518
   19    HA   VAL   3           HA       VAL   3 -11.109  23.490  10.368
   20    HB   VAL   3           HB       VAL   3 -13.386  22.716   9.777
   21   HG11  VAL   3          1HG1      VAL   3 -12.787  25.571   9.013
   22   HG12  VAL   3          2HG1      VAL   3 -13.084  24.962  10.641
   23   HG13  VAL   3          3HG1      VAL   3 -14.377  24.939   9.441
   24   HG21  VAL   3          3HG2      VAL   3 -14.351  23.319   7.602
   25   HG22  VAL   3          1HG2      VAL   3 -13.019  22.175   7.431
   26   HG23  VAL   3          2HG2      VAL   3 -12.770  23.881   7.060
   27    H    GLN   4           H        GLN   4 -11.672  21.236  10.835
   28    HA   GLN   4           HA       GLN   4 -10.347  19.429   8.926
   29    HB2  GLN   4           1HB      GLN   4 -10.512  19.259  11.937
   30    HB3  GLN   4           2HB      GLN   4  -9.853  17.993  10.909
   31    HG2  GLN   4           1HG      GLN   4  -8.201  19.653  10.052
   32    HG3  GLN   4           2HG      GLN   4  -8.792  20.782  11.270
   33   HE21  GLN   4          2HE2      GLN   4  -6.161  19.556  10.875
   34   HE22  GLN   4          1HE2      GLN   4  -5.779  18.764  12.364
   35    H    SER   5           H        SER   5 -11.685  18.170   7.899
   36    HA   SER   5           HA       SER   5 -14.336  17.643   8.967
   37    HB2  SER   5           1HB      SER   5 -13.989  18.362   6.590
   38    HB3  SER   5           2HB      SER   5 -13.148  16.841   6.295
   39    HG   SER   5           HG       SER   5 -15.704  17.268   6.098
   40    H    MET   6           H        MET   6 -15.085  15.262   8.197
   41    HA   MET   6           HA       MET   6 -13.686  13.492   9.964
   42    HB2  MET   6           1HB      MET   6 -15.965  12.967   8.050
   43    HB3  MET   6           2HB      MET   6 -15.368  11.814   9.234
   44    HG2  MET   6           1HG      MET   6 -15.988  13.338  11.034
   45    HG3  MET   6           2HG      MET   6 -16.581  14.500   9.848
   46    HE1  MET   6           3HE      MET   6 -18.681  14.011   8.233
   47    HE2  MET   6           1HE      MET   6 -19.573  12.489   8.247
   48    HE3  MET   6           2HE      MET   6 -17.895  12.523   7.701
   49    H    LEU   7           H        LEU   7 -13.163  14.377   6.806
   50    HA   LEU   7           HA       LEU   7 -12.331  11.879   5.701
   51    HB2  LEU   7           1HB      LEU   7 -11.618  14.687   4.843
   52    HB3  LEU   7           2HB      LEU   7 -11.401  13.233   3.887
   53    HG   LEU   7           HG       LEU   7 -14.043  14.421   4.737
   54   HD11  LEU   7          1HD1      LEU   7 -14.344  14.841   2.343
   55   HD12  LEU   7          2HD1      LEU   7 -12.710  14.249   2.040
   56   HD13  LEU   7          3HD1      LEU   7 -12.956  15.710   2.995
   57   HD21  LEU   7          3HD2      LEU   7 -13.470  12.003   3.027
   58   HD22  LEU   7          1HD2      LEU   7 -15.060  12.698   3.341
   59   HD23  LEU   7          2HD2      LEU   7 -14.136  11.979   4.659
   60    H    LEU   8           H        LEU   8 -11.027  13.742   8.102
   61    HA   LEU   8           HA       LEU   8  -8.253  13.087   7.451
   62    HB2  LEU   8           1HB      LEU   8  -9.525  14.776   9.587
   63    HB3  LEU   8           2HB      LEU   8  -7.849  14.280   9.699
   64    HG   LEU   8           HG       LEU   8  -7.489  15.391   7.450
   65   HD11  LEU   8          1HD1      LEU   8 -10.185  16.586   8.072
   66   HD12  LEU   8          2HD1      LEU   8  -9.814  15.506   6.729
   67   HD13  LEU   8          3HD1      LEU   8  -9.089  17.113   6.795
   68   HD21  LEU   8          3HD2      LEU   8  -7.323  17.614   8.441
   69   HD22  LEU   8          1HD2      LEU   8  -6.765  16.368   9.557
   70   HD23  LEU   8          2HD2      LEU   8  -8.355  17.098   9.775
   71    H    ASN   9           H        ASN   9 -10.693  11.395   8.543
   72    HA   ASN   9           HA       ASN   9  -9.434  10.192  10.879
   73    HB2  ASN   9           1HB      ASN   9 -11.906  10.561  10.804
   74    HB3  ASN   9           2HB      ASN   9 -12.001   9.429   9.456
   75   HD21  ASN   9          2HD2      ASN   9 -13.327   8.019  10.570
   76   HD22  ASN   9          1HD2      ASN   9 -12.758   7.038  11.871
   77    H    ASP  10           H        ASP  10  -8.508   8.161  10.897
   78    HA   ASP  10           HA       ASP  10  -7.713   7.017   8.406
   79    HB2  ASP  10           1HB      ASP  10  -6.243   6.729  10.296
   80    HB3  ASP  10           2HB      ASP  10  -7.522   5.960  11.235
   81    H    VAL  11           H        VAL  11  -9.156   6.114   7.140
   82    HA   VAL  11           HA       VAL  11 -11.514   4.844   8.211
   83    HB   VAL  11           HB       VAL  11 -10.659   4.902   5.313
   84   HG11  VAL  11          1HG1      VAL  11 -12.471   3.376   5.836
   85   HG12  VAL  11          2HG1      VAL  11 -13.069   4.741   4.894
   86   HG13  VAL  11          3HG1      VAL  11 -13.359   4.676   6.633
   87   HG21  VAL  11          3HG2      VAL  11 -12.267   6.985   6.790
   88   HG22  VAL  11          1HG2      VAL  11 -11.974   6.944   5.051
   89   HG23  VAL  11          2HG2      VAL  11 -10.630   7.192   6.166
   90    H    LYS  12           H        LYS  12 -11.358   2.845   8.945
   91    HA   LYS  12           HA       LYS  12  -9.116   1.228   8.430
   92    HB2  LYS  12           1HB      LYS  12 -10.332   1.072  10.541
   93    HB3  LYS  12           2HB      LYS  12 -11.759   0.487   9.693
   94    HG2  LYS  12           1HG      LYS  12 -10.468  -1.487   8.959
   95    HG3  LYS  12           2HG      LYS  12  -9.105  -0.912   9.917
   96    HD2  LYS  12           1HD      LYS  12 -10.419  -1.094  11.947
   97    HD3  LYS  12           2HD      LYS  12 -11.833  -1.588  11.009
   98    HE2  LYS  12           1HE      LYS  12 -10.634  -3.577  10.247
   99    HE3  LYS  12           2HE      LYS  12  -9.215  -3.081  11.170
  100    HZ1  LYS  12           3HZ      LYS  12 -11.876  -3.738  12.320
  101    HZ2  LYS  12           1HZ      LYS  12 -10.494  -3.296  13.201
  102    HZ3  LYS  12           2HZ      LYS  12 -10.519  -4.754  12.336
  103    H    TRP  13           H        TRP  13  -8.763  -0.397   7.041
  104    HA   TRP  13           HA       TRP  13 -10.468  -0.777   4.804
  105    HB2  TRP  13           1HB      TRP  13  -7.861  -1.706   5.682
  106    HB3  TRP  13           2HB      TRP  13  -8.795  -3.014   4.961
  107    HD1  TRP  13           HD1      TRP  13 -10.233  -1.589   2.626
  108    HE1  TRP  13           HE1      TRP  13  -8.917  -0.664   0.626
  109    HE3  TRP  13           HE3      TRP  13  -5.647  -1.135   4.832
  110    HZ2  TRP  13           HZ2      TRP  13  -6.270   0.158   0.055
  111    HZ3  TRP  13           HZ3      TRP  13  -3.774  -0.269   3.491
  112    HH2  TRP  13           HH2      TRP  13  -4.080   0.363   1.152
  113    H    GLU  14           H        GLU  14 -11.863  -2.453   4.320
  114    HA   GLU  14           HA       GLU  14 -13.279  -3.659   6.404
  115    HB2  GLU  14           1HB      GLU  14 -14.020  -3.352   3.992
  116    HB3  GLU  14           2HB      GLU  14 -13.073  -4.788   3.622
  117    HG2  GLU  14           1HG      GLU  14 -14.428  -6.099   5.154
  118    HG3  GLU  14           2HG      GLU  14 -15.366  -4.665   5.569
  119    H    LYS  15           H        LYS  15 -10.763  -4.992   4.280
  120    HA   LYS  15           HA       LYS  15 -10.089  -6.783   6.489
  121    HB2  LYS  15           1HB      LYS  15 -11.211  -7.836   4.327
  122    HB3  LYS  15           2HB      LYS  15  -9.569  -7.723   3.707
  123    HG2  LYS  15           1HG      LYS  15 -10.186  -9.913   4.781
  124    HG3  LYS  15           2HG      LYS  15  -8.723  -9.140   5.403
  125    HD2  LYS  15           1HD      LYS  15  -9.936  -8.283   7.310
  126    HD3  LYS  15           2HD      LYS  15 -11.455  -8.900   6.666
  127    HE2  LYS  15           1HE      LYS  15  -9.131 -10.688   7.325
  128    HE3  LYS  15           2HE      LYS  15 -10.355 -10.248   8.514
  129    HZ1  LYS  15           3HZ      LYS  15 -12.026 -11.128   6.884
  130    HZ2  LYS  15           1HZ      LYS  15 -11.017 -12.290   7.596
  131    HZ3  LYS  15           2HZ      LYS  15 -10.732 -11.783   6.003
  132    HA   PRO  16           HA       PRO  16  -6.382  -4.273   6.248
  133    HB2  PRO  16           1HB      PRO  16  -5.632  -6.522   8.071
  134    HB3  PRO  16           2HB      PRO  16  -5.361  -4.784   8.257
  135    HG2  PRO  16           1HG      PRO  16  -7.306  -5.972   9.604
  136    HG3  PRO  16           2HG      PRO  16  -7.570  -4.377   8.873
  137    HD2  PRO  16           1HD      PRO  16  -8.534  -7.054   7.982
  138    HD3  PRO  16           2HD      PRO  16  -9.333  -5.472   7.870
  139    H    VAL  17           H        VAL  17  -4.285  -4.492   5.455
  140    HA   VAL  17           HA       VAL  17  -3.899  -6.870   3.762
  141    HB   VAL  17           HB       VAL  17  -2.670  -4.124   3.424
  142   HG11  VAL  17          1HG1      VAL  17  -2.109  -4.925   1.163
  143   HG12  VAL  17          2HG1      VAL  17  -2.743  -6.516   1.585
  144   HG13  VAL  17          3HG1      VAL  17  -1.327  -5.879   2.423
  145   HG21  VAL  17          3HG2      VAL  17  -5.086  -4.017   3.126
  146   HG22  VAL  17          1HG2      VAL  17  -5.018  -5.357   1.982
  147   HG23  VAL  17          2HG2      VAL  17  -4.257  -3.816   1.582
  148    H    THR  18           H        THR  18  -2.023  -8.021   3.831
  149    HA   THR  18           HA       THR  18  -0.163  -7.394   6.020
  150    HB   THR  18           HB       THR  18  -0.300  -9.973   4.461
  151    HG1  THR  18           HG1      THR  18  -2.370  -9.339   5.492
  152   HG21  THR  18          3HG2      THR  18   0.677 -10.912   6.506
  153   HG22  THR  18          1HG2      THR  18   0.661  -9.313   7.251
  154   HG23  THR  18          2HG2      THR  18   1.689  -9.623   5.852
  155    H    ILE  19           H        ILE  19   1.661  -6.407   5.482
  156    HA   ILE  19           HA       ILE  19   2.800  -6.842   2.805
  157    HB   ILE  19           HB       ILE  19   3.045  -4.591   4.782
  158   HG12  ILE  19          1HG1      ILE  19   1.243  -4.592   3.052
  159   HG13  ILE  19          2HG1      ILE  19   2.341  -3.224   2.929
  160   HG21  ILE  19          1HG2      ILE  19   5.328  -5.088   4.155
  161   HG22  ILE  19          2HG2      ILE  19   4.803  -3.590   3.386
  162   HG23  ILE  19          3HG2      ILE  19   4.887  -5.082   2.447
  163   HD11  ILE  19          3HD1      ILE  19   2.470  -5.702   1.234
  164   HD12  ILE  19          1HD1      ILE  19   3.489  -4.271   1.086
  165   HD13  ILE  19          2HD1      ILE  19   1.760  -4.162   0.749
  166    H    SER  20           H        SER  20   4.577  -8.039   2.611
  167    HA   SER  20           HA       SER  20   5.924  -8.979   5.001
  168    HB2  SER  20           1HB      SER  20   6.501  -9.656   2.107
  169    HB3  SER  20           2HB      SER  20   7.054 -10.536   3.531
  170    HG   SER  20           HG       SER  20   4.863 -10.952   2.170
  171    H    LEU  21           H        LEU  21   7.146  -7.321   5.796
  172    HA   LEU  21           HA       LEU  21   8.652  -5.529   4.226
  173    HB2  LEU  21           1HB      LEU  21   9.110  -6.361   7.093
  174    HB3  LEU  21           2HB      LEU  21   9.798  -4.949   6.314
  175    HG   LEU  21           HG       LEU  21   6.858  -5.404   6.827
  176   HD11  LEU  21          1HD1      LEU  21   8.846  -3.578   8.165
  177   HD12  LEU  21          2HD1      LEU  21   8.078  -4.994   8.882
  178   HD13  LEU  21          3HD1      LEU  21   7.107  -3.585   8.453
  179   HD21  LEU  21          3HD2      LEU  21   6.595  -3.090   6.103
  180   HD22  LEU  21          1HD2      LEU  21   7.264  -4.090   4.812
  181   HD23  LEU  21          2HD2      LEU  21   8.316  -3.007   5.725
  182    H    GLN  22           H        GLN  22  10.880  -5.423   3.846
  183    HA   GLN  22           HA       GLN  22  12.063  -7.901   3.125
  184    HB2  GLN  22           1HB      GLN  22  14.022  -6.450   2.493
  185    HB3  GLN  22           2HB      GLN  22  12.494  -6.023   1.739
  186    HG2  GLN  22           1HG      GLN  22  12.206  -4.250   3.447
  187    HG3  GLN  22           2HG      GLN  22  13.811  -4.638   4.061
  188   HE21  GLN  22          2HE2      GLN  22  14.559  -2.562   3.605
  189   HE22  GLN  22          1HE2      GLN  22  14.892  -2.043   1.980
  190    H    ASN  23           H        ASN  23  11.709  -6.835   6.093
  191    HA   ASN  23           HA       ASN  23  14.350  -7.734   7.023
  192    HB2  ASN  23           1HB      ASN  23  12.210  -6.123   8.436
  193    HB3  ASN  23           2HB      ASN  23  13.677  -6.709   9.211
  194   HD21  ASN  23          2HD2      ASN  23  15.344  -6.253   6.878
  195   HD22  ASN  23          1HD2      ASN  23  15.581  -4.542   6.789
  196    H    GLY  24           H        GLY  24  11.622  -9.071   6.189
  197    HA2  GLY  24           1HA      GLY  24  10.710 -11.127   6.690
  198    HA3  GLY  24           2HA      GLY  24  11.872 -11.279   7.999
  199    H    ALA  25           H        ALA  25   9.251  -8.963   7.320
  200    HA   ALA  25           HA       ALA  25   7.977  -9.751   9.833
  201    HB1  ALA  25           3HB      ALA  25   7.804  -7.450  10.603
  202    HB2  ALA  25           1HB      ALA  25   8.701  -6.893   9.191
  203    HB3  ALA  25           2HB      ALA  25   9.495  -7.907  10.395
  204    HA   PRO  26           HA       PRO  26   4.482  -9.101   7.035
  205    HB2  PRO  26           1HB      PRO  26   2.936 -10.513   9.037
  206    HB3  PRO  26           2HB      PRO  26   3.361 -11.032   7.404
  207    HG2  PRO  26           1HG      PRO  26   4.355 -12.203   9.661
  208    HG3  PRO  26           2HG      PRO  26   5.220 -12.167   8.114
  209    HD2  PRO  26           1HD      PRO  26   5.585 -10.436  10.532
  210    HD3  PRO  26           2HD      PRO  26   6.812 -11.158   9.466
  211    H    ARG  27           H        ARG  27   4.301  -6.896   7.397
  212    HA   ARG  27           HA       ARG  27   3.075  -5.972   9.872
  213    HB2  ARG  27           1HB      ARG  27   4.923  -4.657   9.055
  214    HB3  ARG  27           2HB      ARG  27   4.179  -4.507   7.470
  215    HG2  ARG  27           1HG      ARG  27   2.615  -2.964   8.206
  216    HG3  ARG  27           2HG      ARG  27   2.802  -3.434   9.897
  217    HD2  ARG  27           1HD      ARG  27   4.976  -2.111   8.283
  218    HD3  ARG  27           2HD      ARG  27   3.820  -1.220   9.272
  219    HE   ARG  27           HE       ARG  27   4.824  -3.023  11.009
  220   HH11  ARG  27          1HH1      ARG  27   6.329  -0.695   8.862
  221   HH12  ARG  27          2HH1      ARG  27   7.729  -0.488   9.864
  222   HH21  ARG  27          1HH2      ARG  27   6.670  -2.747  12.325
  223   HH22  ARG  27          2HH2      ARG  27   7.935  -1.656  11.822
  224    H    ILE  28           H        ILE  28   0.972  -5.887  10.071
  225    HA   ILE  28           HA       ILE  28  -0.698  -5.966   7.666
  226    HB   ILE  28           HB       ILE  28  -1.473  -6.500  10.542
  227   HG12  ILE  28          1HG1      ILE  28  -0.930  -8.448   8.286
  228   HG13  ILE  28          2HG1      ILE  28   0.146  -8.152   9.649
  229   HG21  ILE  28          1HG2      ILE  28  -3.342  -5.757   9.169
  230   HG22  ILE  28          2HG2      ILE  28  -3.508  -7.465   9.576
  231   HG23  ILE  28          3HG2      ILE  28  -2.964  -6.990   7.967
  232   HD11  ILE  28          3HD1      ILE  28  -2.643  -9.273   9.826
  233   HD12  ILE  28          1HD1      ILE  28  -1.537  -9.011  11.175
  234   HD13  ILE  28          2HD1      ILE  28  -1.144 -10.198   9.931
  235    H    PHE  29           H        PHE  29  -1.674  -4.175   7.019
  236    HA   PHE  29           HA       PHE  29  -1.818  -1.894   8.852
  237    HB2  PHE  29           1HB      PHE  29  -2.312  -2.005   5.867
  238    HB3  PHE  29           2HB      PHE  29  -2.230  -0.547   6.853
  239    HD1  PHE  29           HD2      PHE  29  -0.078   0.129   7.875
  240    HD2  PHE  29           HD1      PHE  29  -0.360  -3.079   5.095
  241    HE1  PHE  29           HE2      PHE  29   2.352   0.232   7.512
  242    HE2  PHE  29           HE1      PHE  29   2.070  -2.982   4.731
  243    HZ   PHE  29           HZ       PHE  29   3.427  -1.326   5.934
  244    H    ASN  30           H        ASN  30  -3.644  -1.417   9.838
  245    HA   ASN  30           HA       ASN  30  -6.060  -2.869   9.214
  246    HB2  ASN  30           1HB      ASN  30  -5.879  -0.600  11.186
  247    HB3  ASN  30           2HB      ASN  30  -6.947  -1.996  11.219
  248   HD21  ASN  30          2HD2      ASN  30  -3.783  -0.781  11.886
  249   HD22  ASN  30          1HD2      ASN  30  -3.243  -2.124  12.849
  250    H    GLY  31           H        GLY  31  -4.922   0.472   9.108
  251    HA2  GLY  31           1HA      GLY  31  -7.455   1.214   7.801
  252    HA3  GLY  31           2HA      GLY  31  -6.491   2.305   8.779
  253    H    VAL  32           H        VAL  32  -7.392   2.915   6.245
  254    HA   VAL  32           HA       VAL  32  -5.500   2.381   4.211
  255    HB   VAL  32           HB       VAL  32  -7.470   4.670   4.408
  256   HG11  VAL  32          1HG1      VAL  32  -6.057   3.498   2.018
  257   HG12  VAL  32          2HG1      VAL  32  -5.743   5.075   2.742
  258   HG13  VAL  32          3HG1      VAL  32  -7.296   4.754   1.971
  259   HG21  VAL  32          3HG2      VAL  32  -8.580   2.512   4.587
  260   HG22  VAL  32          1HG2      VAL  32  -7.756   1.949   3.135
  261   HG23  VAL  32          2HG2      VAL  32  -8.930   3.261   3.030
  262    H    TYR  33           H        TYR  33  -5.702   4.841   6.718
  263    HA   TYR  33           HA       TYR  33  -3.824   6.602   5.452
  264    HB2  TYR  33           1HB      TYR  33  -5.514   7.392   7.124
  265    HB3  TYR  33           2HB      TYR  33  -4.608   6.544   8.374
  266    HD1  TYR  33           HD2      TYR  33  -4.606   9.392   6.069
  267    HD2  TYR  33           HD1      TYR  33  -2.482   7.411   9.176
  268    HE1  TYR  33           HE2      TYR  33  -3.159  11.361   6.325
  269    HE2  TYR  33           HE1      TYR  33  -1.026   9.375   9.440
  270    HH   TYR  33           HH       TYR  33  -0.268  11.311   7.979
  271    H    GLU  34           H        GLU  34  -3.663   4.034   7.861
  272    HA   GLU  34           HA       GLU  34  -1.016   4.361   8.698
  273    HB2  GLU  34           1HB      GLU  34  -2.544   1.781   8.290
  274    HB3  GLU  34           2HB      GLU  34  -1.047   1.931   9.194
  275    HG2  GLU  34           1HG      GLU  34  -2.206   3.481  10.744
  276    HG3  GLU  34           2HG      GLU  34  -3.707   3.147   9.880
  277    H    ALA  35           H        ALA  35  -2.346   2.539   5.981
  278    HA   ALA  35           HA       ALA  35   0.132   1.589   5.004
  279    HB1  ALA  35           3HB      ALA  35  -2.426   1.999   3.460
  280    HB2  ALA  35           1HB      ALA  35  -2.077   0.597   4.475
  281    HB3  ALA  35           2HB      ALA  35  -1.092   0.920   3.045
  282    H    PHE  36           H        PHE  36  -1.909   4.345   4.092
  283    HA   PHE  36           HA       PHE  36  -0.390   5.332   1.972
  284    HB2  PHE  36           1HB      PHE  36  -2.651   6.116   2.478
  285    HB3  PHE  36           2HB      PHE  36  -2.088   6.834   3.980
  286    HD1  PHE  36           HD2      PHE  36  -1.128   6.946   0.368
  287    HD2  PHE  36           HD1      PHE  36  -1.900   9.110   3.952
  288    HE1  PHE  36           HE2      PHE  36  -0.693   9.058  -0.816
  289    HE2  PHE  36           HE1      PHE  36  -1.466  11.225   2.771
  290    HZ   PHE  36           HZ       PHE  36  -0.861  11.200   0.385
  291    H    ASP  37           H        ASP  37  -0.167   6.001   5.437
  292    HA   ASP  37           HA       ASP  37   1.883   7.949   5.268
  293    HB2  ASP  37           1HB      ASP  37   0.422   7.662   7.236
  294    HB3  ASP  37           2HB      ASP  37   1.169   6.100   7.555
  295    H    PHE  38           H        PHE  38   1.913   4.466   5.798
  296    HA   PHE  38           HA       PHE  38   4.653   4.104   6.243
  297    HB2  PHE  38           1HB      PHE  38   3.177   2.322   6.759
  298    HB3  PHE  38           2HB      PHE  38   2.499   2.309   5.139
  299    HD1  PHE  38           HD2      PHE  38   5.604   1.582   7.045
  300    HD2  PHE  38           HD1      PHE  38   3.340   0.894   3.509
  301    HE1  PHE  38           HE2      PHE  38   7.155  -0.220   6.402
  302    HE2  PHE  38           HE1      PHE  38   4.880  -0.909   2.867
  303    HZ   PHE  38           HZ       PHE  38   6.788  -1.469   4.307
  304    H    LEU  39           H        LEU  39   2.782   4.107   3.239
  305    HA   LEU  39           HA       LEU  39   4.774   3.284   1.467
  306    HB2  LEU  39           1HB      LEU  39   2.465   5.176   1.026
  307    HB3  LEU  39           2HB      LEU  39   3.440   4.495  -0.260
  308    HG   LEU  39           HG       LEU  39   1.765   2.876   1.658
  309   HD11  LEU  39          1HD1      LEU  39   0.258   2.560  -0.242
  310   HD12  LEU  39          2HD1      LEU  39   1.236   3.667  -1.205
  311   HD13  LEU  39          3HD1      LEU  39   0.372   4.260   0.213
  312   HD21  LEU  39          3HD2      LEU  39   2.182   1.053   0.068
  313   HD22  LEU  39          1HD2      LEU  39   3.677   1.651   0.790
  314   HD23  LEU  39          2HD2      LEU  39   3.246   2.115  -0.856
  315    H    GLN  40           H        GLN  40   4.239   6.364   2.979
  316    HA   GLN  40           HA       GLN  40   6.019   7.749   1.150
  317    HB2  GLN  40           1HB      GLN  40   4.532   8.716   3.598
  318    HB3  GLN  40           2HB      GLN  40   5.491   9.740   2.539
  319    HG2  GLN  40           1HG      GLN  40   3.985   9.460   0.746
  320    HG3  GLN  40           2HG      GLN  40   3.157   8.130   1.555
  321   HE21  GLN  40          2HE2      GLN  40   1.718   8.561   3.194
  322   HE22  GLN  40          1HE2      GLN  40   1.081  10.143   3.480
  323    H    HIS  41           H        HIS  41   6.027   6.491   4.427
  324    HA   HIS  41           HA       HIS  41   8.446   7.846   5.145
  325    HB2  HIS  41           1HB      HIS  41   6.752   5.766   6.464
  326    HB3  HIS  41           2HB      HIS  41   8.383   6.057   7.060
  327    HD1  HIS  41           HD1      HIS  41   8.727   8.062   8.547
  328    HD2  HIS  41           HD2      HIS  41   5.032   8.082   6.629
  329    HE1  HIS  41           HE1      HIS  41   7.445   9.975   9.558
  330    HE2  HIS  41           HE2      HIS  41   5.278  10.067   8.270
  331    H    GLU  42           H        GLU  42   7.881   4.312   5.021
  332    HA   GLU  42           HA       GLU  42  10.419   4.073   3.610
  333    HB2  GLU  42           1HB      GLU  42   9.848   2.751   6.258
  334    HB3  GLU  42           2HB      GLU  42  11.125   2.222   5.169
  335    HG2  GLU  42           1HG      GLU  42  12.013   4.586   5.279
  336    HG3  GLU  42           2HG      GLU  42  10.886   4.841   6.610
  337    H    TRP  43           H        TRP  43   8.762   3.594   1.964
  338    HA   TRP  43           HA       TRP  43   7.871   0.834   1.992
  339    HB2  TRP  43           1HB      TRP  43   6.465   2.417   0.820
  340    HB3  TRP  43           2HB      TRP  43   7.824   2.979  -0.145
  341    HD1  TRP  43           HD1      TRP  43   8.242   1.792  -2.381
  342    HE1  TRP  43           HE1      TRP  43   7.221  -0.223  -3.606
  343    HE3  TRP  43           HE3      TRP  43   5.328  -0.023   1.389
  344    HZ2  TRP  43           HZ2      TRP  43   5.402  -2.311  -3.039
  345    HZ3  TRP  43           HZ3      TRP  43   3.974  -2.034   0.972
  346    HH2  TRP  43           HH2      TRP  43   4.012  -3.154  -1.198
  347    HA   PRO  44           HA       PRO  44  11.800  -1.022   1.245
  348    HB2  PRO  44           1HB      PRO  44  10.100  -2.555  -0.694
  349    HB3  PRO  44           2HB      PRO  44  11.334  -3.149   0.424
  350    HG2  PRO  44           1HG      PRO  44   8.727  -3.297   1.019
  351    HG3  PRO  44           2HG      PRO  44   9.948  -2.975   2.262
  352    HD2  PRO  44           1HD      PRO  44   7.909  -1.181   1.137
  353    HD3  PRO  44           2HD      PRO  44   8.825  -1.042   2.649
  354    H    ALA  45           H        ALA  45  10.011  -1.050  -1.841
  355    HA   ALA  45           HA       ALA  45  12.148   0.557  -3.048
  356    HB1  ALA  45           3HB      ALA  45  12.194  -0.910  -5.011
  357    HB2  ALA  45           1HB      ALA  45  11.056  -2.001  -4.222
  358    HB3  ALA  45           2HB      ALA  45  12.672  -1.777  -3.551
  359    H    ARG  46           H        ARG  46  11.156   2.324  -3.741
  360    HA   ARG  46           HA       ARG  46   8.429   2.716  -3.895
  361    HB2  ARG  46           1HB      ARG  46  10.729   4.195  -5.124
  362    HB3  ARG  46           2HB      ARG  46   9.069   4.718  -5.387
  363    HG2  ARG  46           1HG      ARG  46   8.741   5.053  -3.035
  364    HG3  ARG  46           2HG      ARG  46  10.321   4.356  -2.674
  365    HD2  ARG  46           1HD      ARG  46  11.461   6.188  -3.625
  366    HD3  ARG  46           2HD      ARG  46   9.999   6.788  -4.409
  367    HE   ARG  46           HE       ARG  46   9.294   7.703  -2.396
  368   HH11  ARG  46          1HH1      ARG  46  12.323   5.983  -2.000
  369   HH12  ARG  46          2HH1      ARG  46  12.606   6.585  -0.392
  370   HH21  ARG  46          1HH2      ARG  46   9.657   8.512  -0.299
  371   HH22  ARG  46          2HH2      ARG  46  11.071   8.012   0.589
  372    H    GLY  47           H        GLY  47  10.242   3.143  -6.894
  373    HA2  GLY  47           1HA      GLY  47   9.930   1.347  -8.606
  374    HA3  GLY  47           2HA      GLY  47   8.229   1.408  -8.184
  375    H    ASP  48           H        ASP  48   6.950   2.989  -8.979
  376    HA   ASP  48           HA       ASP  48   7.839   5.165 -10.565
  377    HB2  ASP  48           1HB      ASP  48   7.031   4.221 -12.763
  378    HB3  ASP  48           2HB      ASP  48   8.521   3.502 -12.163
  379    H    ARG  49           H        ARG  49   5.515   4.634 -12.440
  380    HA   ARG  49           HA       ARG  49   3.531   6.137 -11.245
  381    HB2  ARG  49           1HB      ARG  49   3.274   4.034 -13.404
  382    HB3  ARG  49           2HB      ARG  49   2.029   5.209 -13.005
  383    HG2  ARG  49           1HG      ARG  49   3.419   7.021 -13.714
  384    HG3  ARG  49           2HG      ARG  49   4.800   5.943 -13.924
  385    HD2  ARG  49           1HD      ARG  49   3.694   4.799 -15.730
  386    HD3  ARG  49           2HD      ARG  49   2.217   5.720 -15.460
  387    HE   ARG  49           HE       ARG  49   3.951   7.682 -15.977
  388   HH11  ARG  49          1HH1      ARG  49   3.465   4.618 -17.622
  389   HH12  ARG  49          2HH1      ARG  49   3.846   5.266 -19.191
  390   HH21  ARG  49          1HH2      ARG  49   4.472   8.517 -18.022
  391   HH22  ARG  49          2HH2      ARG  49   4.453   7.476 -19.414
  392    H    ALA  50           H        ALA  50   4.060   2.661 -11.105
  393    HA   ALA  50           HA       ALA  50   1.567   1.876 -10.079
  394    HB1  ALA  50           3HB      ALA  50   3.226   0.298 -10.944
  395    HB2  ALA  50           1HB      ALA  50   2.699  -0.141  -9.320
  396    HB3  ALA  50           2HB      ALA  50   4.265   0.633  -9.559
  397    H    HIS  51           H        HIS  51   4.416   3.182  -8.479
  398    HA   HIS  51           HA       HIS  51   3.447   2.687  -5.823
  399    HB2  HIS  51           1HB      HIS  51   5.847   2.850  -6.233
  400    HB3  HIS  51           2HB      HIS  51   5.660   4.493  -6.833
  401    HD1  HIS  51           HD1      HIS  51   5.619   2.502  -3.636
  402    HD2  HIS  51           HD2      HIS  51   5.563   6.464  -4.891
  403    HE1  HIS  51           HE1      HIS  51   5.999   3.876  -1.561
  404    HE2  HIS  51           HE2      HIS  51   6.187   6.252  -2.387
  405    H    GLU  52           H        GLU  52   3.452   5.392  -8.070
  406    HA   GLU  52           HA       GLU  52   2.356   7.322  -6.310
  407    HB2  GLU  52           1HB      GLU  52   2.074   7.178  -9.322
  408    HB3  GLU  52           2HB      GLU  52   1.878   8.610  -8.318
  409    HG2  GLU  52           1HG      GLU  52   4.230   8.530  -7.712
  410    HG3  GLU  52           2HG      GLU  52   4.437   7.064  -8.669
  411    H    GLN  53           H        GLN  53   0.953   4.999  -8.543
  412    HA   GLN  53           HA       GLN  53  -1.737   5.647  -8.364
  413    HB2  GLN  53           1HB      GLN  53  -0.899   4.005  -9.939
  414    HB3  GLN  53           2HB      GLN  53  -0.396   2.951  -8.628
  415    HG2  GLN  53           1HG      GLN  53  -2.762   2.687  -7.981
  416    HG3  GLN  53           2HG      GLN  53  -3.222   3.662  -9.377
  417   HE21  GLN  53          2HE2      GLN  53  -1.927   0.619  -8.307
  418   HE22  GLN  53          1HE2      GLN  53  -2.100  -0.217  -9.811
  419    H    ALA  54           H        ALA  54   0.154   3.414  -6.339
  420    HA   ALA  54           HA       ALA  54  -1.895   2.631  -4.611
  421    HB1  ALA  54           3HB      ALA  54   1.045   2.903  -3.993
  422    HB2  ALA  54           1HB      ALA  54   0.268   1.499  -4.725
  423    HB3  ALA  54           2HB      ALA  54  -0.127   1.961  -3.069
  424    H    LEU  55           H        LEU  55   0.260   5.416  -4.497
  425    HA   LEU  55           HA       LEU  55  -0.511   6.378  -1.960
  426    HB2  LEU  55           1HB      LEU  55   0.544   7.856  -4.374
  427    HB3  LEU  55           2HB      LEU  55   0.385   8.555  -2.775
  428    HG   LEU  55           HG       LEU  55   2.147   6.194  -3.437
  429   HD11  LEU  55          1HD1      LEU  55   2.868   9.089  -2.994
  430   HD12  LEU  55          2HD1      LEU  55   2.940   8.224  -4.530
  431   HD13  LEU  55          3HD1      LEU  55   4.006   7.759  -3.205
  432   HD21  LEU  55          3HD2      LEU  55   1.905   7.889  -0.954
  433   HD22  LEU  55          1HD2      LEU  55   3.102   6.622  -1.221
  434   HD23  LEU  55          2HD2      LEU  55   1.390   6.212  -1.127
  435    H    ARG  56           H        ARG  56  -1.623   7.184  -5.236
  436    HA   ARG  56           HA       ARG  56  -3.513   9.120  -4.484
  437    HB2  ARG  56           1HB      ARG  56  -3.376   7.328  -6.907
  438    HB3  ARG  56           2HB      ARG  56  -4.553   8.624  -6.723
  439    HG2  ARG  56           1HG      ARG  56  -2.649  10.215  -6.480
  440    HG3  ARG  56           2HG      ARG  56  -1.561   8.882  -6.876
  441    HD2  ARG  56           1HD      ARG  56  -3.752  10.011  -8.611
  442    HD3  ARG  56           2HD      ARG  56  -2.016  10.185  -8.858
  443    HE   ARG  56           HE       ARG  56  -3.531   7.663  -9.136
  444   HH11  ARG  56          1HH1      ARG  56  -0.711   9.634  -9.762
  445   HH12  ARG  56          2HH1      ARG  56  -0.089   8.583 -11.005
  446   HH21  ARG  56          1HH2      ARG  56  -2.749   6.288 -10.791
  447   HH22  ARG  56          2HH2      ARG  56  -1.260   6.680 -11.605
  448    H    LEU  57           H        LEU  57  -3.823   5.632  -4.967
  449    HA   LEU  57           HA       LEU  57  -6.580   5.383  -4.679
  450    HB2  LEU  57           1HB      LEU  57  -4.393   3.506  -3.793
  451    HB3  LEU  57           2HB      LEU  57  -6.091   3.078  -3.870
  452    HG   LEU  57           HG       LEU  57  -4.457   3.946  -6.254
  453   HD11  LEU  57          1HD1      LEU  57  -4.454   1.592  -6.880
  454   HD12  LEU  57          2HD1      LEU  57  -5.261   1.181  -5.367
  455   HD13  LEU  57          3HD1      LEU  57  -3.626   1.842  -5.343
  456   HD21  LEU  57          3HD2      LEU  57  -6.842   4.370  -6.488
  457   HD22  LEU  57          1HD2      LEU  57  -7.198   2.707  -6.025
  458   HD23  LEU  57          2HD2      LEU  57  -6.341   3.038  -7.530
  459    H    CYS  58           H        CYS  58  -4.065   5.229  -2.174
  460    HA   CYS  58           HA       CYS  58  -5.877   4.906  -0.021
  461    HB2  CYS  58           1HB      CYS  58  -3.064   6.012   0.049
  462    HB3  CYS  58           2HB      CYS  58  -3.961   5.347   1.410
  463    HG   CYS  58           HG       CYS  58  -2.531   3.699  -1.200
  464    H    ARG  59           H        ARG  59  -4.287   7.696  -1.458
  465    HA   ARG  59           HA       ARG  59  -5.053   9.638   0.417
  466    HB2  ARG  59           1HB      ARG  59  -3.302   9.965  -1.262
  467    HB3  ARG  59           2HB      ARG  59  -4.499   9.904  -2.544
  468    HG2  ARG  59           1HG      ARG  59  -5.495  11.966  -1.743
  469    HG3  ARG  59           2HG      ARG  59  -4.346  12.017  -0.400
  470    HD2  ARG  59           1HD      ARG  59  -2.496  12.185  -1.950
  471    HD3  ARG  59           2HD      ARG  59  -3.592  12.031  -3.319
  472    HE   ARG  59           HE       ARG  59  -4.285  14.248  -1.678
  473   HH11  ARG  59          1HH1      ARG  59  -1.974  13.175  -4.079
  474   HH12  ARG  59          2HH1      ARG  59  -1.703  14.769  -4.722
  475   HH21  ARG  59          1HH2      ARG  59  -3.927  16.353  -2.495
  476   HH22  ARG  59          2HH2      ARG  59  -2.814  16.583  -3.820
  477    H    ALA  60           H        ALA  60  -6.612   8.588  -2.603
  478    HA   ALA  60           HA       ALA  60  -8.788  10.437  -2.304
  479    HB1  ALA  60           3HB      ALA  60  -9.723   9.355  -4.269
  480    HB2  ALA  60           1HB      ALA  60  -8.525   8.067  -4.147
  481    HB3  ALA  60           2HB      ALA  60  -8.013   9.716  -4.508
  482    H    SER  61           H        SER  61  -8.151   7.190  -1.252
  483    HA   SER  61           HA       SER  61 -10.838   6.385  -0.841
  484    HB2  SER  61           1HB      SER  61  -8.846   4.845  -0.881
  485    HB3  SER  61           2HB      SER  61  -8.414   5.457   0.713
  486    HG   SER  61           HG       SER  61 -10.947   4.776   0.849
  487    H    LEU  62           H        LEU  62  -8.471   8.074   1.152
  488    HA   LEU  62           HA       LEU  62 -10.054   8.215   3.503
  489    HB2  LEU  62           1HB      LEU  62  -7.846  10.039   2.539
  490    HB3  LEU  62           2HB      LEU  62  -8.498  10.012   4.167
  491    HG   LEU  62           HG       LEU  62  -7.102   7.674   2.862
  492   HD11  LEU  62          1HD1      LEU  62  -6.054   9.688   4.844
  493   HD12  LEU  62          2HD1      LEU  62  -5.559   9.532   3.159
  494   HD13  LEU  62          3HD1      LEU  62  -5.210   8.236   4.304
  495   HD21  LEU  62          3HD2      LEU  62  -7.919   8.184   5.722
  496   HD22  LEU  62          1HD2      LEU  62  -7.019   6.785   5.136
  497   HD23  LEU  62          2HD2      LEU  62  -8.683   7.044   4.615
  498    H    MET  63           H        MET  63  -9.950  10.024   0.561
  499    HA   MET  63           HA       MET  63 -11.473  12.263   1.528
  500    HB2  MET  63           1HB      MET  63  -9.853  12.462  -0.328
  501    HB3  MET  63           2HB      MET  63 -10.844  11.387  -1.301
  502    HG2  MET  63           1HG      MET  63 -12.664  13.023  -1.235
  503    HG3  MET  63           2HG      MET  63 -11.645  14.107  -0.290
  504    HE1  MET  63           3HE      MET  63  -8.781  14.937  -2.836
  505    HE2  MET  63           1HE      MET  63  -8.795  13.634  -1.647
  506    HE3  MET  63           2HE      MET  63  -9.420  15.227  -1.218
  507    H    GLY  64           H        GLY  64 -12.219   9.100   0.738
  508    HA2  GLY  64           1HA      GLY  64 -14.330   8.106   0.813
  509    HA3  GLY  64           2HA      GLY  64 -15.059   9.701   0.688
  510    H    ASP  65           H        ASP  65 -12.648   9.255  -1.610
  511    HA   ASP  65           HA       ASP  65 -14.634   9.108  -3.718
  512    HB2  ASP  65           1HB      ASP  65 -12.763  10.705  -3.895
  513    HB3  ASP  65           2HB      ASP  65 -11.622   9.363  -3.885
  514    H    VAL  66           H        VAL  66 -11.763   7.282  -2.717
  515    HA   VAL  66           HA       VAL  66 -12.548   5.042  -4.398
  516    HB   VAL  66           HB       VAL  66 -10.204   5.296  -2.496
  517   HG11  VAL  66          1HG1      VAL  66 -10.818   3.205  -4.585
  518   HG12  VAL  66          2HG1      VAL  66 -10.825   2.971  -2.836
  519   HG13  VAL  66          3HG1      VAL  66  -9.314   3.327  -3.671
  520   HG21  VAL  66          3HG2      VAL  66  -8.851   5.594  -4.503
  521   HG22  VAL  66          1HG2      VAL  66 -10.068   6.863  -4.370
  522   HG23  VAL  66          2HG2      VAL  66 -10.303   5.530  -5.502
  523    H    ALA  67           H        ALA  67 -13.672   3.349  -3.707
  524    HA   ALA  67           HA       ALA  67 -14.882   3.438  -1.120
  525    HB1  ALA  67           3HB      ALA  67 -16.143   1.499  -1.861
  526    HB2  ALA  67           1HB      ALA  67 -15.070   1.313  -3.248
  527    HB3  ALA  67           2HB      ALA  67 -16.102   2.737  -3.116
  528    H    GLY  68           H        GLY  68 -11.893   2.755  -1.398
  529    HA2  GLY  68           1HA      GLY  68 -10.479   1.678   0.069
  530    HA3  GLY  68           2HA      GLY  68 -11.886   0.963   0.834
  531    H    GLU  69           H        GLU  69 -13.014  -0.590  -0.990
  532    HA   GLU  69           HA       GLU  69 -11.475  -2.907  -0.962
  533    HB2  GLU  69           1HB      GLU  69 -13.746  -2.263  -2.852
  534    HB3  GLU  69           2HB      GLU  69 -13.178  -3.868  -2.414
  535    HG2  GLU  69           1HG      GLU  69 -14.457  -1.872  -0.561
  536    HG3  GLU  69           2HG      GLU  69 -15.219  -3.313  -1.231
  537    H    ILE  70           H        ILE  70 -12.100  -0.696  -3.661
  538    HA   ILE  70           HA       ILE  70 -10.676  -2.069  -5.640
  539    HB   ILE  70           HB       ILE  70 -11.062   0.923  -5.408
  540   HG12  ILE  70          1HG1      ILE  70 -12.784  -1.154  -6.783
  541   HG13  ILE  70          2HG1      ILE  70 -13.177  -0.360  -5.263
  542   HG21  ILE  70          1HG2      ILE  70 -10.517  -0.806  -7.822
  543   HG22  ILE  70          2HG2      ILE  70  -9.374   0.301  -7.062
  544   HG23  ILE  70          3HG2      ILE  70 -10.824   0.932  -7.844
  545   HD11  ILE  70          3HD1      ILE  70 -13.261   1.793  -6.415
  546   HD12  ILE  70          1HD1      ILE  70 -14.392   0.631  -7.110
  547   HD13  ILE  70          2HD1      ILE  70 -12.875   0.988  -7.937
  548    H    ALA  71           H        ALA  71  -9.630   0.281  -3.240
  549    HA   ALA  71           HA       ALA  71  -7.034   0.713  -4.256
  550    HB1  ALA  71           3HB      ALA  71  -8.028   0.984  -1.421
  551    HB2  ALA  71           1HB      ALA  71  -8.083   2.236  -2.662
  552    HB3  ALA  71           2HB      ALA  71  -6.530   1.656  -2.063
  553    H    ARG  72           H        ARG  72  -8.383  -1.659  -2.033
  554    HA   ARG  72           HA       ARG  72  -5.976  -2.713  -1.037
  555    HB2  ARG  72           1HB      ARG  72  -8.197  -3.163  -0.058
  556    HB3  ARG  72           2HB      ARG  72  -8.616  -4.124  -1.467
  557    HG2  ARG  72           1HG      ARG  72  -6.763  -5.670  -0.910
  558    HG3  ARG  72           2HG      ARG  72  -6.467  -4.732   0.556
  559    HD2  ARG  72           1HD      ARG  72  -8.958  -6.272  -0.163
  560    HD3  ARG  72           2HD      ARG  72  -7.817  -6.629   1.133
  561    HE   ARG  72           HE       ARG  72  -8.568  -4.562   2.210
  562   HH11  ARG  72          1HH1      ARG  72 -10.627  -6.066  -0.186
  563   HH12  ARG  72          2HH1      ARG  72 -12.060  -5.217   0.317
  564   HH21  ARG  72          1HH2      ARG  72 -10.456  -3.415   2.853
  565   HH22  ARG  72          2HH2      ARG  72 -11.961  -3.693   2.017
  566    H    THR  73           H        THR  73  -8.026  -3.790  -3.726
  567    HA   THR  73           HA       THR  73  -6.480  -5.975  -4.524
  568    HB   THR  73           HB       THR  73  -8.183  -4.219  -6.301
  569    HG1  THR  73           HG1      THR  73  -9.897  -5.188  -5.437
  570   HG21  THR  73          3HG2      THR  73  -7.408  -7.134  -6.514
  571   HG22  THR  73          1HG2      THR  73  -6.802  -5.826  -7.531
  572   HG23  THR  73          2HG2      THR  73  -8.505  -6.281  -7.600
  573    H    ALA  74           H        ALA  74  -6.434  -2.606  -5.681
  574    HA   ALA  74           HA       ALA  74  -4.392  -3.106  -7.612
  575    HB1  ALA  74           3HB      ALA  74  -5.351  -0.480  -6.492
  576    HB2  ALA  74           1HB      ALA  74  -6.032  -1.315  -7.887
  577    HB3  ALA  74           2HB      ALA  74  -4.380  -0.700  -7.948
  578    H    PHE  75           H        PHE  75  -4.402  -2.224  -4.253
  579    HA   PHE  75           HA       PHE  75  -1.757  -1.255  -4.050
  580    HB2  PHE  75           1HB      PHE  75  -3.464  -1.019  -2.260
  581    HB3  PHE  75           2HB      PHE  75  -3.383  -2.752  -1.976
  582    HD1  PHE  75           HD2      PHE  75  -1.411   0.376  -1.845
  583    HD2  PHE  75           HD1      PHE  75  -1.756  -3.666  -0.559
  584    HE1  PHE  75           HE2      PHE  75   0.409   0.738  -0.230
  585    HE2  PHE  75           HE1      PHE  75   0.063  -3.310   1.058
  586    HZ   PHE  75           HZ       PHE  75   1.147  -1.107   1.224
  587    H    VAL  76           H        VAL  76  -3.136  -4.496  -3.551
  588    HA   VAL  76           HA       VAL  76  -0.706  -5.836  -3.122
  589    HB   VAL  76           HB       VAL  76  -3.290  -6.899  -4.284
  590   HG11  VAL  76          1HG1      VAL  76  -0.925  -8.410  -3.173
  591   HG12  VAL  76          2HG1      VAL  76  -1.416  -8.354  -4.865
  592   HG13  VAL  76          3HG1      VAL  76  -2.461  -9.120  -3.669
  593   HG21  VAL  76          3HG2      VAL  76  -3.678  -7.741  -2.014
  594   HG22  VAL  76          1HG2      VAL  76  -3.527  -5.983  -2.034
  595   HG23  VAL  76          2HG2      VAL  76  -2.180  -6.980  -1.478
  596    H    ALA  77           H        ALA  77  -2.550  -5.200  -6.077
  597    HA   ALA  77           HA       ALA  77  -0.978  -6.605  -7.900
  598    HB1  ALA  77           3HB      ALA  77  -2.464  -4.022  -8.366
  599    HB2  ALA  77           1HB      ALA  77  -3.162  -5.640  -8.440
  600    HB3  ALA  77           2HB      ALA  77  -1.931  -5.157  -9.606
  601    H    ALA  78           H        ALA  78  -0.578  -3.338  -6.605
  602    HA   ALA  78           HA       ALA  78   1.642  -2.692  -8.286
  603    HB1  ALA  78           3HB      ALA  78   1.897  -0.731  -6.866
  604    HB2  ALA  78           1HB      ALA  78   0.765  -1.414  -5.698
  605    HB3  ALA  78           2HB      ALA  78   0.206  -0.963  -7.310
  606    H    SER  79           H        SER  79   1.282  -3.949  -4.996
  607    HA   SER  79           HA       SER  79   4.030  -3.738  -4.334
  608    HB2  SER  79           1HB      SER  79   3.448  -5.282  -2.445
  609    HB3  SER  79           2HB      SER  79   2.420  -3.855  -2.559
  610    HG   SER  79           HG       SER  79   1.290  -5.742  -4.024
  611    H    ARG  80           H        ARG  80   2.412  -5.891  -6.399
  612    HA   ARG  80           HA       ARG  80   3.978  -8.222  -6.037
  613    HB2  ARG  80           1HB      ARG  80   2.646  -7.234  -8.568
  614    HB3  ARG  80           2HB      ARG  80   3.268  -8.856  -8.310
  615    HG2  ARG  80           1HG      ARG  80   1.628  -8.987  -6.360
  616    HG3  ARG  80           2HG      ARG  80   0.886  -7.542  -7.048
  617    HD2  ARG  80           1HD      ARG  80   0.724  -8.820  -9.224
  618    HD3  ARG  80           2HD      ARG  80   1.183 -10.258  -8.313
  619    HE   ARG  80           HE       ARG  80  -1.351  -8.837  -8.206
  620   HH11  ARG  80          1HH1      ARG  80   0.679 -11.328  -6.783
  621   HH12  ARG  80          2HH1      ARG  80  -0.636 -12.115  -5.963
  622   HH21  ARG  80          1HH2      ARG  80  -3.065  -9.865  -7.166
  623   HH22  ARG  80          2HH2      ARG  80  -2.784 -11.277  -6.189
  624    H    GLN  81           H        GLN  81   4.470  -5.243  -7.778
  625    HA   GLN  81           HA       GLN  81   6.604  -6.026  -9.432
  626    HB2  GLN  81           1HB      GLN  81   5.335  -3.951  -9.752
  627    HB3  GLN  81           2HB      GLN  81   5.973  -3.316  -8.244
  628    HG2  GLN  81           1HG      GLN  81   8.207  -3.275  -9.168
  629    HG3  GLN  81           2HG      GLN  81   7.628  -4.013 -10.662
  630   HE21  GLN  81          2HE2      GLN  81   8.965  -1.454 -10.262
  631   HE22  GLN  81          1HE2      GLN  81   7.895  -0.248 -10.900
  632    H    ALA  82           H        ALA  82   6.513  -4.774  -6.136
  633    HA   ALA  82           HA       ALA  82   9.401  -4.777  -5.916
  634    HB1  ALA  82           3HB      ALA  82   7.294  -4.268  -3.817
  635    HB2  ALA  82           1HB      ALA  82   8.080  -3.037  -4.806
  636    HB3  ALA  82           2HB      ALA  82   9.024  -3.972  -3.647
  637    H    HIS  83           H        HIS  83   7.014  -7.074  -5.733
  638    HA   HIS  83           HA       HIS  83   6.845  -9.195  -4.955
  639    HB2  HIS  83           1HB      HIS  83   9.839  -8.863  -4.736
  640    HB3  HIS  83           2HB      HIS  83   9.021 -10.376  -4.369
  641    HD1  HIS  83           HD1      HIS  83   8.452 -11.882  -6.306
  642    HD2  HIS  83           HD2      HIS  83   9.616  -8.066  -7.508
  643    HE1  HIS  83           HE1      HIS  83   8.691 -11.994  -8.809
  644    HE2  HIS  83           HE2      HIS  83   9.220  -9.637  -9.529
  645    H    CYS  84           H        CYS  84   6.626  -6.900  -3.140
  646    HA   CYS  84           HA       CYS  84   7.580  -7.876  -0.567
  647    HB2  CYS  84           1HB      CYS  84   7.573  -5.427  -1.349
  648    HB3  CYS  84           2HB      CYS  84   5.836  -5.466  -1.083
  649    HG   CYS  84           HG       CYS  84   7.348  -6.588   1.609
  650    H    LEU  85           H        LEU  85   5.615  -9.348  -2.134
  651    HA   LEU  85           HA       LEU  85   2.988  -8.893  -1.099
  652    HB2  LEU  85           1HB      LEU  85   4.132 -11.208  -2.657
  653    HB3  LEU  85           2HB      LEU  85   2.432 -10.974  -2.309
  654    HG   LEU  85           HG       LEU  85   4.097  -9.063  -3.943
  655   HD11  LEU  85          1HD1      LEU  85   2.163 -11.198  -4.840
  656   HD12  LEU  85          2HD1      LEU  85   3.915 -11.247  -5.035
  657   HD13  LEU  85          3HD1      LEU  85   2.968 -10.022  -5.879
  658   HD21  LEU  85          3HD2      LEU  85   1.911  -8.178  -4.607
  659   HD22  LEU  85          1HD2      LEU  85   2.167  -8.042  -2.868
  660   HD23  LEU  85          2HD2      LEU  85   1.123  -9.311  -3.508
  661    H    MET  86           H        MET  86   1.789 -10.213   0.253
  662    HA   MET  86           HA       MET  86   3.203 -12.481   1.506
  663    HB2  MET  86           1HB      MET  86   2.501 -10.449   3.007
  664    HB3  MET  86           2HB      MET  86   0.877 -11.093   2.819
  665    HG2  MET  86           1HG      MET  86   3.222 -12.622   3.927
  666    HG3  MET  86           2HG      MET  86   1.993 -11.817   4.896
  667    HE1  MET  86           3HE      MET  86  -0.486 -12.606   5.118
  668    HE2  MET  86           1HE      MET  86  -1.200 -13.912   4.173
  669    HE3  MET  86           2HE      MET  86  -0.704 -12.419   3.378
  670    H    GLU  87           H        GLU  87   2.488 -14.075   0.170
  671    HA   GLU  87           HA       GLU  87  -0.290 -14.720   0.031
  672    HB2  GLU  87           1HB      GLU  87  -0.252 -12.857  -1.547
  673    HB3  GLU  87           2HB      GLU  87   1.065 -13.611  -2.432
  674    HG2  GLU  87           1HG      GLU  87  -0.329 -15.324  -3.242
  675    HG3  GLU  87           2HG      GLU  87  -1.621 -14.907  -2.115
  676    H    ASP  88           H        ASP  88   2.547 -15.074  -2.069
  677    HA   ASP  88           HA       ASP  88   2.223 -17.977  -1.940
  678    HB2  ASP  88           1HB      ASP  88   2.500 -17.167  -4.188
  679    HB3  ASP  88           2HB      ASP  88   3.922 -16.232  -3.734
  680    H    LYS  89           H        LYS  89   3.723 -19.312  -1.080
  681    HA   LYS  89           HA       LYS  89   5.522 -18.205   0.849
  682    HB2  LYS  89           1HB      LYS  89   5.134 -21.056  -0.095
  683    HB3  LYS  89           2HB      LYS  89   6.087 -20.573   1.304
  684    HG2  LYS  89           1HG      LYS  89   4.187 -19.882   2.497
  685    HG3  LYS  89           2HG      LYS  89   3.173 -19.896   1.053
  686    HD2  LYS  89           1HD      LYS  89   3.374 -22.326   0.931
  687    HD3  LYS  89           2HD      LYS  89   4.410 -22.315   2.361
  688    HE2  LYS  89           1HE      LYS  89   2.630 -21.538   3.740
  689    HE3  LYS  89           2HE      LYS  89   1.599 -21.236   2.343
  690    HZ1  LYS  89           3HZ      LYS  89   2.587 -23.931   3.090
  691    HZ2  LYS  89           1HZ      LYS  89   1.393 -23.550   1.949
  692    HZ3  LYS  89           2HZ      LYS  89   1.092 -23.313   3.602
  693    H    ALA  90           H        ALA  90   5.918 -20.152  -2.084
  694    HA   ALA  90           HA       ALA  90   8.028 -18.768  -3.225
  695    HB1  ALA  90           3HB      ALA  90   9.341 -19.435  -1.251
  696    HB2  ALA  90           1HB      ALA  90   9.965 -20.178  -2.724
  697    HB3  ALA  90           2HB      ALA  90   8.994 -21.129  -1.598
  698    H    GLU  91           H        GLU  91   5.609 -20.341  -3.811
  699    HA   GLU  91           HA       GLU  91   6.758 -22.539  -5.388
  700    HB2  GLU  91           1HB      GLU  91   4.264 -22.704  -3.689
  701    HB3  GLU  91           2HB      GLU  91   4.909 -23.993  -4.697
  702    HG2  GLU  91           1HG      GLU  91   6.885 -24.136  -3.323
  703    HG3  GLU  91           2HG      GLU  91   6.350 -22.759  -2.362
  704    H    ALA  92           H        ALA  92   5.777 -19.838  -6.049
  705    HA   ALA  92           HA       ALA  92   3.362 -20.162  -7.542
  706    HB1  ALA  92           3HB      ALA  92   5.532 -18.079  -7.803
  707    HB2  ALA  92           1HB      ALA  92   4.096 -17.958  -6.787
  708    HB3  ALA  92           2HB      ALA  92   3.932 -17.998  -8.543
  709    HA   PRO  93           HA       PRO  93   5.460 -22.501 -10.731
  710    HB2  PRO  93           1HB      PRO  93   3.278 -23.194 -12.142
  711    HB3  PRO  93           2HB      PRO  93   3.659 -23.930 -10.581
  712    HG2  PRO  93           1HG      PRO  93   1.706 -21.754 -11.224
  713    HG3  PRO  93           2HG      PRO  93   1.521 -23.138 -10.131
  714    HD2  PRO  93           1HD      PRO  93   2.131 -20.606  -9.286
  715    HD3  PRO  93           2HD      PRO  93   2.597 -22.076  -8.408
  716    H    ASN  94           H        ASN  94   4.483 -19.469 -10.908
  717    HA   ASN  94           HA       ASN  94   4.153 -19.159 -13.758
  718    HB2  ASN  94           1HB      ASN  94   3.088 -17.677 -11.969
  719    HB3  ASN  94           2HB      ASN  94   4.683 -16.966 -11.752
  720   HD21  ASN  94          2HD2      ASN  94   1.965 -17.327 -13.853
  721   HD22  ASN  94          1HD2      ASN  94   2.387 -16.062 -14.965
  722    H    THR  95           H        THR  95   6.628 -18.490 -11.326
  723    HA   THR  95           HA       THR  95   8.586 -18.201 -13.502
  724    HB   THR  95           HB       THR  95   9.920 -16.797 -11.905
  725    HG1  THR  95           HG1      THR  95   8.616 -17.562 -10.033
  726   HG21  THR  95          3HG2      THR  95   7.189 -15.740 -12.644
  727   HG22  THR  95          1HG2      THR  95   8.611 -15.765 -13.689
  728   HG23  THR  95          2HG2      THR  95   8.597 -14.757 -12.241
  729    H    ILE  96           H        ILE  96   9.854 -19.902 -13.577
  730    HA   ILE  96           HA       ILE  96  10.685 -21.196 -11.063
  731    HB   ILE  96           HB       ILE  96  10.136 -22.627 -13.677
  732   HG12  ILE  96          1HG1      ILE  96   8.524 -22.659 -11.114
  733   HG13  ILE  96          2HG1      ILE  96   8.061 -21.816 -12.588
  734   HG21  ILE  96          1HG2      ILE  96  10.819 -23.696 -10.941
  735   HG22  ILE  96          2HG2      ILE  96  11.878 -23.684 -12.350
  736   HG23  ILE  96          3HG2      ILE  96  10.418 -24.672 -12.354
  737   HD11  ILE  96          3HD1      ILE  96   6.862 -23.908 -12.377
  738   HD12  ILE  96          1HD1      ILE  96   8.385 -24.793 -12.273
  739   HD13  ILE  96          2HD1      ILE  96   7.950 -23.960 -13.765
  740    H    ALA  97           H        ALA  97  12.848 -21.850 -10.974
  741    HA   ALA  97           HA       ALA  97  14.777 -20.465 -12.389
  742    HB1  ALA  97           3HB      ALA  97  15.059 -23.172 -11.088
  743    HB2  ALA  97           1HB      ALA  97  15.232 -21.610 -10.288
  744    HB3  ALA  97           2HB      ALA  97  16.386 -22.096 -11.530
  745    H    SER  98           H        SER  98  13.424 -23.662 -13.045
  746    HA   SER  98           HA       SER  98  14.850 -23.849 -15.566
  747    HB2  SER  98           1HB      SER  98  12.674 -25.655 -14.474
  748    HB3  SER  98           2HB      SER  98  13.808 -26.023 -15.775
  749    HG   SER  98           HG       SER  98  14.156 -26.107 -13.034
  750    H    GLY  99           H        GLY  99  14.128 -22.554 -17.137
  751    HA2  GLY  99           1HA      GLY  99  11.612 -21.277 -17.051
  752    HA3  GLY  99           2HA      GLY  99  12.745 -21.225 -18.388
  753    H    SER 100           H        SER 100  12.785 -23.941 -19.083
  754    HA   SER 100           HA       SER 100  10.044 -24.697 -19.644
  755    HB2  SER 100           1HB      SER 100  11.924 -24.052 -21.931
  756    HB3  SER 100           2HB      SER 100  10.253 -24.595 -22.058
  757    HG   SER 100           HG       SER 100  10.143 -22.489 -20.541
  Start of MODEL   15
    1    H1   MET   1           1H       MET   1 -19.211  27.451  12.088
    2    H2   MET   1           2H       MET   1 -17.645  27.839  11.583
    3    H3   MET   1           3H       MET   1 -18.521  28.931  12.545
    4    HA   MET   1           HA       MET   1 -16.832  27.761  13.815
    5    HB2  MET   1           1HB      MET   1 -19.700  27.102  14.493
    6    HB3  MET   1           2HB      MET   1 -18.356  26.836  15.594
    7    HG2  MET   1           1HG      MET   1 -17.853  29.307  15.335
    8    HG3  MET   1           2HG      MET   1 -19.434  29.438  14.565
    9    HE1  MET   1           3HE      MET   1 -17.446  28.694  17.820
   10    HE2  MET   1           1HE      MET   1 -18.263  27.152  17.577
   11    HE3  MET   1           2HE      MET   1 -18.704  28.177  18.942
   12    H    GLU   2           H        GLU   2 -16.955  25.564  15.244
   13    HA   GLU   2           HA       GLU   2 -15.810  23.696  13.512
   14    HB2  GLU   2           1HB      GLU   2 -16.789  23.295  16.339
   15    HB3  GLU   2           2HB      GLU   2 -15.696  22.221  15.475
   16    HG2  GLU   2           1HG      GLU   2 -15.177  25.045  16.353
   17    HG3  GLU   2           2HG      GLU   2 -14.396  23.571  16.927
   18    H    VAL   3           H        VAL   3 -16.845  22.545  12.054
   19    HA   VAL   3           HA       VAL   3 -19.332  21.185  12.812
   20    HB   VAL   3           HB       VAL   3 -19.484  20.517  10.431
   21   HG11  VAL   3          1HG1      VAL   3 -19.153  23.479  10.893
   22   HG12  VAL   3          2HG1      VAL   3 -20.616  22.529  11.160
   23   HG13  VAL   3          3HG1      VAL   3 -19.992  22.746   9.525
   24   HG21  VAL   3          3HG2      VAL   3 -17.996  21.566   8.777
   25   HG22  VAL   3          1HG2      VAL   3 -17.123  20.484   9.862
   26   HG23  VAL   3          2HG2      VAL   3 -17.023  22.231  10.089
   27    H    GLN   4           H        GLN   4 -19.464  18.887  12.716
   28    HA   GLN   4           HA       GLN   4 -16.940  17.622  13.337
   29    HB2  GLN   4           1HB      GLN   4 -19.769  16.571  13.323
   30    HB3  GLN   4           2HB      GLN   4 -18.370  15.591  13.739
   31    HG2  GLN   4           1HG      GLN   4 -17.853  17.209  15.554
   32    HG3  GLN   4           2HG      GLN   4 -19.364  18.036  15.181
   33   HE21  GLN   4          2HE2      GLN   4 -18.462  16.658  17.612
   34   HE22  GLN   4          1HE2      GLN   4 -19.673  15.456  17.941
   35    H    SER   5           H        SER   5 -16.182  18.112  11.151
   36    HA   SER   5           HA       SER   5 -16.302  15.680   9.597
   37    HB2  SER   5           1HB      SER   5 -16.972  18.373   8.372
   38    HB3  SER   5           2HB      SER   5 -16.678  16.894   7.456
   39    HG   SER   5           HG       SER   5 -18.511  16.441   9.382
   40    H    MET   6           H        MET   6 -14.207  15.211   9.759
   41    HA   MET   6           HA       MET   6 -12.219  17.294   9.924
   42    HB2  MET   6           1HB      MET   6 -11.898  14.288   9.891
   43    HB3  MET   6           2HB      MET   6 -10.634  15.449  10.276
   44    HG2  MET   6           1HG      MET   6 -11.924  16.189  12.222
   45    HG3  MET   6           2HG      MET   6 -13.163  14.996  11.839
   46    HE1  MET   6           3HE      MET   6 -11.286  12.566  10.814
   47    HE2  MET   6           1HE      MET   6 -12.695  12.342  11.852
   48    HE3  MET   6           2HE      MET   6 -11.144  11.637  12.308
   49    H    LEU   7           H        LEU   7 -10.477  17.570   8.524
   50    HA   LEU   7           HA       LEU   7 -10.991  16.937   5.755
   51    HB2  LEU   7           1HB      LEU   7 -10.026  19.106   6.491
   52    HB3  LEU   7           2HB      LEU   7  -8.593  18.257   7.035
   53    HG   LEU   7           HG       LEU   7  -8.213  17.519   4.674
   54   HD11  LEU   7          1HD1      LEU   7 -10.488  17.740   3.849
   55   HD12  LEU   7          2HD1      LEU   7  -9.383  18.729   2.896
   56   HD13  LEU   7          3HD1      LEU   7 -10.426  19.483   4.102
   57   HD21  LEU   7          3HD2      LEU   7  -7.019  19.416   5.647
   58   HD22  LEU   7          1HD2      LEU   7  -8.320  20.495   5.148
   59   HD23  LEU   7          2HD2      LEU   7  -7.342  19.674   3.934
   60    H    LEU   8           H        LEU   8  -8.786  15.955   8.302
   61    HA   LEU   8           HA       LEU   8  -7.593  13.938   6.547
   62    HB2  LEU   8           1HB      LEU   8  -6.077  15.350   7.913
   63    HB3  LEU   8           2HB      LEU   8  -6.841  14.735   9.366
   64    HG   LEU   8           HG       LEU   8  -6.067  12.448   8.757
   65   HD11  LEU   8          1HD1      LEU   8  -4.350  12.212   7.035
   66   HD12  LEU   8          2HD1      LEU   8  -4.564  13.904   6.587
   67   HD13  LEU   8          3HD1      LEU   8  -5.882  12.756   6.352
   68   HD21  LEU   8          3HD2      LEU   8  -4.796  13.814  10.324
   69   HD22  LEU   8          1HD2      LEU   8  -3.911  14.545   8.986
   70   HD23  LEU   8          2HD2      LEU   8  -3.718  12.828   9.334
   71    H    ASN   9           H        ASN   9  -8.503  11.995   6.526
   72    HA   ASN   9           HA       ASN   9  -9.815  11.026   8.985
   73    HB2  ASN   9           1HB      ASN   9 -10.881  10.697   6.169
   74    HB3  ASN   9           2HB      ASN   9 -11.616  10.057   7.633
   75   HD21  ASN   9          2HD2      ASN   9 -11.026  12.888   5.718
   76   HD22  ASN   9          1HD2      ASN   9 -12.134  13.927   6.548
   77    H    ASP  10           H        ASP  10  -8.923   9.170   9.625
   78    HA   ASP  10           HA       ASP  10  -7.548   7.498   7.664
   79    HB2  ASP  10           1HB      ASP  10  -6.362   7.928   9.757
   80    HB3  ASP  10           2HB      ASP  10  -7.709   7.264  10.678
   81    H    VAL  11           H        VAL  11  -8.925   6.293   6.546
   82    HA   VAL  11           HA       VAL  11 -11.291   5.169   7.809
   83    HB   VAL  11           HB       VAL  11 -10.386   5.024   4.922
   84   HG11  VAL  11          1HG1      VAL  11 -11.900   3.210   5.559
   85   HG12  VAL  11          2HG1      VAL  11 -12.670   4.332   4.438
   86   HG13  VAL  11          3HG1      VAL  11 -13.063   4.391   6.156
   87   HG21  VAL  11          3HG2      VAL  11 -12.061   6.750   4.490
   88   HG22  VAL  11          1HG2      VAL  11 -10.828   7.324   5.611
   89   HG23  VAL  11          2HG2      VAL  11 -12.415   6.844   6.216
   90    H    LYS  12           H        LYS  12 -11.512   3.024   8.267
   91    HA   LYS  12           HA       LYS  12  -9.080   1.471   8.127
   92    HB2  LYS  12           1HB      LYS  12 -11.695   1.139   9.561
   93    HB3  LYS  12           2HB      LYS  12 -10.614  -0.234   9.389
   94    HG2  LYS  12           1HG      LYS  12 -10.313   0.858  11.535
   95    HG3  LYS  12           2HG      LYS  12  -8.855   0.989  10.554
   96    HD2  LYS  12           1HD      LYS  12  -9.446   3.275   9.958
   97    HD3  LYS  12           2HD      LYS  12 -10.942   3.141  10.886
   98    HE2  LYS  12           1HE      LYS  12  -9.730   2.929  12.934
   99    HE3  LYS  12           2HE      LYS  12  -8.196   2.799  12.073
  100    HZ1  LYS  12           3HZ      LYS  12  -8.390   5.056  11.356
  101    HZ2  LYS  12           1HZ      LYS  12  -8.594   5.014  13.038
  102    HZ3  LYS  12           2HZ      LYS  12  -9.945   5.202  12.031
  103    H    TRP  13           H        TRP  13  -8.926  -0.599   7.221
  104    HA   TRP  13           HA       TRP  13 -10.508  -0.958   4.820
  105    HB2  TRP  13           1HB      TRP  13  -7.920  -1.864   5.812
  106    HB3  TRP  13           2HB      TRP  13  -8.835  -3.167   5.064
  107    HD1  TRP  13           HD1      TRP  13  -9.997  -2.184   2.545
  108    HE1  TRP  13           HE1      TRP  13  -8.641  -1.102   0.644
  109    HE3  TRP  13           HE3      TRP  13  -5.895  -0.719   5.217
  110    HZ2  TRP  13           HZ2      TRP  13  -6.151   0.193   0.322
  111    HZ3  TRP  13           HZ3      TRP  13  -4.068   0.429   4.040
  112    HH2  TRP  13           HH2      TRP  13  -4.196   0.875   1.639
  113    H    GLU  14           H        GLU  14 -11.534  -2.976   4.291
  114    HA   GLU  14           HA       GLU  14 -12.932  -4.168   6.514
  115    HB2  GLU  14           1HB      GLU  14 -12.969  -4.993   3.606
  116    HB3  GLU  14           2HB      GLU  14 -14.142  -5.428   4.839
  117    HG2  GLU  14           1HG      GLU  14 -13.672  -2.694   3.674
  118    HG3  GLU  14           2HG      GLU  14 -15.073  -3.733   3.425
  119    H    LYS  15           H        LYS  15 -10.986  -5.448   3.848
  120    HA   LYS  15           HA       LYS  15 -10.201  -7.735   5.475
  121    HB2  LYS  15           1HB      LYS  15  -9.688  -7.080   2.565
  122    HB3  LYS  15           2HB      LYS  15  -9.149  -8.549   3.370
  123    HG2  LYS  15           1HG      LYS  15 -12.019  -7.703   3.029
  124    HG3  LYS  15           2HG      LYS  15 -11.178  -8.900   2.042
  125    HD2  LYS  15           1HD      LYS  15 -10.788 -10.246   4.086
  126    HD3  LYS  15           2HD      LYS  15 -11.723  -9.068   5.005
  127    HE2  LYS  15           1HE      LYS  15 -12.773 -10.652   2.666
  128    HE3  LYS  15           2HE      LYS  15 -13.033 -11.067   4.359
  129    HZ1  LYS  15           3HZ      LYS  15 -14.920  -9.891   3.431
  130    HZ2  LYS  15           1HZ      LYS  15 -13.940  -8.566   3.028
  131    HZ3  LYS  15           2HZ      LYS  15 -14.196  -8.971   4.656
  132    HA   PRO  16           HA       PRO  16  -6.502  -5.695   6.783
  133    HB2  PRO  16           1HB      PRO  16  -5.112  -7.991   7.424
  134    HB3  PRO  16           2HB      PRO  16  -6.291  -7.203   8.475
  135    HG2  PRO  16           1HG      PRO  16  -6.636  -9.559   6.670
  136    HG3  PRO  16           2HG      PRO  16  -7.281  -9.288   8.300
  137    HD2  PRO  16           1HD      PRO  16  -8.812  -8.987   6.110
  138    HD3  PRO  16           2HD      PRO  16  -9.003  -7.936   7.530
  139    H    VAL  17           H        VAL  17  -4.563  -5.138   5.927
  140    HA   VAL  17           HA       VAL  17  -3.738  -6.556   3.478
  141    HB   VAL  17           HB       VAL  17  -3.148  -3.697   4.281
  142   HG11  VAL  17          1HG1      VAL  17  -2.567  -5.190   1.724
  143   HG12  VAL  17          2HG1      VAL  17  -1.381  -4.633   2.905
  144   HG13  VAL  17          3HG1      VAL  17  -2.319  -3.462   1.978
  145   HG21  VAL  17          3HG2      VAL  17  -4.692  -3.076   2.494
  146   HG22  VAL  17          1HG2      VAL  17  -5.502  -4.025   3.740
  147   HG23  VAL  17          2HG2      VAL  17  -5.052  -4.778   2.210
  148    H    THR  18           H        THR  18  -2.112  -7.902   3.887
  149    HA   THR  18           HA       THR  18  -0.188  -7.259   6.000
  150    HB   THR  18           HB       THR  18  -0.463  -9.865   4.502
  151    HG1  THR  18           HG1      THR  18  -1.950 -10.474   5.991
  152   HG21  THR  18          3HG2      THR  18   1.640  -9.571   5.710
  153   HG22  THR  18          1HG2      THR  18   0.636 -10.784   6.506
  154   HG23  THR  18          2HG2      THR  18   0.754  -9.158   7.178
  155    H    ILE  19           H        ILE  19   1.545  -6.190   5.358
  156    HA   ILE  19           HA       ILE  19   2.685  -6.702   2.703
  157    HB   ILE  19           HB       ILE  19   3.159  -4.487   4.704
  158   HG12  ILE  19          1HG1      ILE  19   1.091  -4.400   3.304
  159   HG13  ILE  19          2HG1      ILE  19   2.186  -3.049   3.034
  160   HG21  ILE  19          1HG2      ILE  19   4.684  -3.495   3.048
  161   HG22  ILE  19          2HG2      ILE  19   4.547  -4.954   2.066
  162   HG23  ILE  19          3HG2      ILE  19   5.281  -5.034   3.667
  163   HD11  ILE  19          3HD1      ILE  19   1.217  -3.925   0.962
  164   HD12  ILE  19          1HD1      ILE  19   1.987  -5.480   1.276
  165   HD13  ILE  19          2HD1      ILE  19   2.977  -4.044   0.993
  166    H    SER  20           H        SER  20   4.213  -8.208   2.627
  167    HA   SER  20           HA       SER  20   5.800  -8.809   4.977
  168    HB2  SER  20           1HB      SER  20   6.771 -10.571   3.356
  169    HB3  SER  20           2HB      SER  20   5.096 -10.762   3.875
  170    HG   SER  20           HG       SER  20   5.059 -10.997   1.691
  171    H    LEU  21           H        LEU  21   7.215  -7.124   5.247
  172    HA   LEU  21           HA       LEU  21   8.658  -6.013   3.029
  173    HB2  LEU  21           1HB      LEU  21   8.962  -5.637   6.005
  174    HB3  LEU  21           2HB      LEU  21   9.921  -4.783   4.810
  175    HG   LEU  21           HG       LEU  21   6.918  -4.620   5.044
  176   HD11  LEU  21          1HD1      LEU  21   7.319  -2.357   5.877
  177   HD12  LEU  21          2HD1      LEU  21   9.057  -2.655   5.852
  178   HD13  LEU  21          3HD1      LEU  21   8.020  -3.573   6.944
  179   HD21  LEU  21          3HD2      LEU  21   8.842  -3.013   3.367
  180   HD22  LEU  21          1HD2      LEU  21   7.088  -2.848   3.413
  181   HD23  LEU  21          2HD2      LEU  21   7.817  -4.314   2.761
  182    H    GLN  22           H        GLN  22  11.069  -5.861   3.094
  183    HA   GLN  22           HA       GLN  22  11.996  -8.552   2.830
  184    HB2  GLN  22           1HB      GLN  22  13.375  -5.908   2.366
  185    HB3  GLN  22           2HB      GLN  22  14.029  -7.478   1.907
  186    HG2  GLN  22           1HG      GLN  22  12.076  -7.844   0.464
  187    HG3  GLN  22           2HG      GLN  22  11.482  -6.242   0.893
  188   HE21  GLN  22          2HE2      GLN  22  12.210  -7.382  -1.681
  189   HE22  GLN  22          1HE2      GLN  22  13.416  -6.328  -2.339
  190    H    ASN  23           H        ASN  23  11.723  -6.844   5.517
  191    HA   ASN  23           HA       ASN  23  14.255  -7.637   6.720
  192    HB2  ASN  23           1HB      ASN  23  11.819  -6.272   7.895
  193    HB3  ASN  23           2HB      ASN  23  13.268  -6.670   8.808
  194   HD21  ASN  23          2HD2      ASN  23  13.798  -4.619   9.328
  195   HD22  ASN  23          1HD2      ASN  23  14.324  -3.433   8.171
  196    H    GLY  24           H        GLY  24  11.436  -9.084   5.891
  197    HA2  GLY  24           1HA      GLY  24  10.574 -11.160   6.463
  198    HA3  GLY  24           2HA      GLY  24  11.760 -11.257   7.761
  199    H    ALA  25           H        ALA  25   9.259  -8.863   7.032
  200    HA   ALA  25           HA       ALA  25   7.978  -9.469   9.597
  201    HB1  ALA  25           3HB      ALA  25   8.704  -6.690   8.678
  202    HB2  ALA  25           1HB      ALA  25   9.531  -7.595   9.946
  203    HB3  ALA  25           2HB      ALA  25   7.849  -7.113  10.161
  204    HA   PRO  26           HA       PRO  26   4.492  -8.931   6.780
  205    HB2  PRO  26           1HB      PRO  26   2.777 -10.464   8.166
  206    HB3  PRO  26           2HB      PRO  26   4.039 -11.169   7.150
  207    HG2  PRO  26           1HG      PRO  26   3.943 -10.861  10.115
  208    HG3  PRO  26           2HG      PRO  26   4.592 -12.194   9.144
  209    HD2  PRO  26           1HD      PRO  26   6.101 -10.171  10.307
  210    HD3  PRO  26           2HD      PRO  26   6.633 -11.203   8.965
  211    H    ARG  27           H        ARG  27   4.227  -6.731   7.245
  212    HA   ARG  27           HA       ARG  27   2.974  -5.997   9.766
  213    HB2  ARG  27           1HB      ARG  27   3.869  -4.287   7.439
  214    HB3  ARG  27           2HB      ARG  27   3.189  -3.667   8.938
  215    HG2  ARG  27           1HG      ARG  27   5.101  -4.902  10.104
  216    HG3  ARG  27           2HG      ARG  27   5.826  -5.020   8.498
  217    HD2  ARG  27           1HD      ARG  27   6.696  -3.078   9.642
  218    HD3  ARG  27           2HD      ARG  27   5.690  -2.568   8.288
  219    HE   ARG  27           HE       ARG  27   4.183  -2.709  10.701
  220   HH11  ARG  27          1HH1      ARG  27   6.593  -0.737   9.081
  221   HH12  ARG  27          2HH1      ARG  27   6.022   0.758   9.773
  222   HH21  ARG  27          1HH2      ARG  27   3.467  -0.754  11.653
  223   HH22  ARG  27          2HH2      ARG  27   4.259   0.741  11.240
  224    H    ILE  28           H        ILE  28   0.881  -6.105   9.978
  225    HA   ILE  28           HA       ILE  28  -0.818  -6.085   7.599
  226    HB   ILE  28           HB       ILE  28  -1.621  -6.745  10.435
  227   HG12  ILE  28          1HG1      ILE  28  -0.807  -8.626   8.201
  228   HG13  ILE  28          2HG1      ILE  28   0.154  -8.274   9.634
  229   HG21  ILE  28          1HG2      ILE  28  -3.531  -7.839   9.360
  230   HG22  ILE  28          2HG2      ILE  28  -2.931  -7.330   7.781
  231   HG23  ILE  28          3HG2      ILE  28  -3.460  -6.123   8.953
  232   HD11  ILE  28          3HD1      ILE  28  -1.578  -9.258  11.039
  233   HD12  ILE  28          1HD1      ILE  28  -0.987 -10.403   9.836
  234   HD13  ILE  28          2HD1      ILE  28  -2.544  -9.608   9.602
  235    H    PHE  29           H        PHE  29  -1.732  -4.246   7.035
  236    HA   PHE  29           HA       PHE  29  -1.921  -2.054   8.931
  237    HB2  PHE  29           1HB      PHE  29  -2.588  -2.189   5.984
  238    HB3  PHE  29           2HB      PHE  29  -2.614  -0.723   6.959
  239    HD1  PHE  29           HD1      PHE  29  -0.506  -3.227   5.343
  240    HD2  PHE  29           HD2      PHE  29  -0.566   0.330   7.671
  241    HE1  PHE  29           HE1      PHE  29   1.881  -2.884   4.873
  242    HE2  PHE  29           HE2      PHE  29   1.823   0.680   7.204
  243    HZ   PHE  29           HZ       PHE  29   3.048  -0.930   5.803
  244    H    ASN  30           H        ASN  30  -3.832  -0.951   9.434
  245    HA   ASN  30           HA       ASN  30  -6.288  -2.521   8.977
  246    HB2  ASN  30           1HB      ASN  30  -5.509  -0.824  11.357
  247    HB3  ASN  30           2HB      ASN  30  -7.128  -1.460  11.103
  248   HD21  ASN  30          2HD2      ASN  30  -6.105  -3.966   9.950
  249   HD22  ASN  30          1HD2      ASN  30  -5.515  -4.889  11.290
  250    H    GLY  31           H        GLY  31  -4.818   0.650   9.040
  251    HA2  GLY  31           1HA      GLY  31  -7.323   1.795   7.983
  252    HA3  GLY  31           2HA      GLY  31  -6.090   2.714   8.832
  253    H    VAL  32           H        VAL  32  -7.162   3.384   6.303
  254    HA   VAL  32           HA       VAL  32  -5.293   2.566   4.281
  255    HB   VAL  32           HB       VAL  32  -7.319   4.807   4.169
  256   HG11  VAL  32          1HG1      VAL  32  -5.895   3.319   1.968
  257   HG12  VAL  32          2HG1      VAL  32  -5.584   4.982   2.467
  258   HG13  VAL  32          3HG1      VAL  32  -7.134   4.552   1.751
  259   HG21  VAL  32          3HG2      VAL  32  -8.428   2.708   4.656
  260   HG22  VAL  32          1HG2      VAL  32  -7.567   1.920   3.335
  261   HG23  VAL  32          2HG2      VAL  32  -8.745   3.183   2.987
  262    H    TYR  33           H        TYR  33  -5.675   5.370   6.405
  263    HA   TYR  33           HA       TYR  33  -3.810   6.962   4.924
  264    HB2  TYR  33           1HB      TYR  33  -5.533   8.065   6.258
  265    HB3  TYR  33           2HB      TYR  33  -4.857   7.368   7.731
  266    HD1  TYR  33           HD1      TYR  33  -3.823   9.458   4.815
  267    HD2  TYR  33           HD2      TYR  33  -3.352   8.632   8.960
  268    HE1  TYR  33           HE1      TYR  33  -2.280  11.357   5.009
  269    HE2  TYR  33           HE2      TYR  33  -1.810  10.536   9.169
  270    HH   TYR  33           HH       TYR  33  -0.304  11.849   7.734
  271    H    GLU  34           H        GLU  34  -3.634   4.927   7.801
  272    HA   GLU  34           HA       GLU  34  -0.961   5.533   8.453
  273    HB2  GLU  34           1HB      GLU  34  -0.986   3.275   9.594
  274    HB3  GLU  34           2HB      GLU  34  -2.233   4.405  10.099
  275    HG2  GLU  34           1HG      GLU  34  -3.855   3.266   8.698
  276    HG3  GLU  34           2HG      GLU  34  -2.608   2.150   8.146
  277    H    ALA  35           H        ALA  35  -2.372   3.424   6.060
  278    HA   ALA  35           HA       ALA  35   0.092   2.159   5.325
  279    HB1  ALA  35           3HB      ALA  35  -2.487   2.429   3.781
  280    HB2  ALA  35           1HB      ALA  35  -2.055   1.098   4.850
  281    HB3  ALA  35           2HB      ALA  35  -1.142   1.365   3.367
  282    H    PHE  36           H        PHE  36  -1.844   4.837   4.061
  283    HA   PHE  36           HA       PHE  36  -0.261   5.631   1.927
  284    HB2  PHE  36           1HB      PHE  36  -2.452   6.590   2.338
  285    HB3  PHE  36           2HB      PHE  36  -1.900   7.295   3.851
  286    HD1  PHE  36           HD2      PHE  36  -1.480   7.448   0.177
  287    HD2  PHE  36           HD1      PHE  36  -0.927   9.420   3.905
  288    HE1  PHE  36           HE2      PHE  36  -0.896   9.520  -1.010
  289    HE2  PHE  36           HE1      PHE  36  -0.346  11.498   2.724
  290    HZ   PHE  36           HZ       PHE  36  -0.329  11.547   0.262
  291    H    ASP  37           H        ASP  37  -0.053   6.591   5.329
  292    HA   ASP  37           HA       ASP  37   2.149   8.320   5.122
  293    HB2  ASP  37           1HB      ASP  37   0.738   8.255   7.106
  294    HB3  ASP  37           2HB      ASP  37   1.225   6.596   7.431
  295    H    PHE  38           H        PHE  38   1.956   4.855   5.754
  296    HA   PHE  38           HA       PHE  38   4.660   4.284   6.116
  297    HB2  PHE  38           1HB      PHE  38   3.016   2.619   6.607
  298    HB3  PHE  38           2HB      PHE  38   2.384   2.667   4.968
  299    HD1  PHE  38           HD1      PHE  38   5.347   1.692   6.972
  300    HD2  PHE  38           HD2      PHE  38   3.190   1.213   3.331
  301    HE1  PHE  38           HE1      PHE  38   6.784  -0.211   6.371
  302    HE2  PHE  38           HE2      PHE  38   4.628  -0.687   2.725
  303    HZ   PHE  38           HZ       PHE  38   6.421  -1.402   4.245
  304    H    LEU  39           H        LEU  39   2.724   4.386   3.157
  305    HA   LEU  39           HA       LEU  39   4.639   3.517   1.333
  306    HB2  LEU  39           1HB      LEU  39   2.404   5.506   0.949
  307    HB3  LEU  39           2HB      LEU  39   3.297   4.745  -0.354
  308    HG   LEU  39           HG       LEU  39   1.658   3.221   1.668
  309   HD11  LEU  39          1HD1      LEU  39   0.005   2.984  -0.135
  310   HD12  LEU  39          2HD1      LEU  39   0.941   4.105  -1.125
  311   HD13  LEU  39          3HD1      LEU  39   0.199   4.661   0.375
  312   HD21  LEU  39          3HD2      LEU  39   3.434   1.921   0.634
  313   HD22  LEU  39          1HD2      LEU  39   2.892   2.422  -0.967
  314   HD23  LEU  39          2HD2      LEU  39   1.858   1.402   0.037
  315    H    GLN  40           H        GLN  40   3.975   6.777   2.526
  316    HA   GLN  40           HA       GLN  40   5.791   8.093   0.799
  317    HB2  GLN  40           1HB      GLN  40   4.553   8.877   3.433
  318    HB3  GLN  40           2HB      GLN  40   5.656   9.935   2.564
  319    HG2  GLN  40           1HG      GLN  40   4.141   9.944   0.654
  320    HG3  GLN  40           2HG      GLN  40   3.036   8.883   1.527
  321   HE21  GLN  40          2HE2      GLN  40   2.743  11.635   0.466
  322   HE22  GLN  40          1HE2      GLN  40   2.204  12.575   1.813
  323    H    HIS  41           H        HIS  41   6.095   6.799   4.070
  324    HA   HIS  41           HA       HIS  41   8.679   7.974   4.453
  325    HB2  HIS  41           1HB      HIS  41   7.183   5.918   6.080
  326    HB3  HIS  41           2HB      HIS  41   8.731   6.617   6.547
  327    HD1  HIS  41           HD1      HIS  41   8.077   9.580   5.727
  328    HD2  HIS  41           HD2      HIS  41   5.621   7.096   7.984
  329    HE1  HIS  41           HE1      HIS  41   6.586  11.114   7.050
  330    HE2  HIS  41           HE2      HIS  41   4.947   9.578   8.194
  331    H    GLU  42           H        GLU  42   7.528   4.687   3.707
  332    HA   GLU  42           HA       GLU  42  10.138   4.051   2.689
  333    HB2  GLU  42           1HB      GLU  42  10.308   3.806   5.195
  334    HB3  GLU  42           2HB      GLU  42   9.183   2.464   5.062
  335    HG2  GLU  42           1HG      GLU  42  10.718   1.152   3.872
  336    HG3  GLU  42           2HG      GLU  42  11.755   2.539   3.527
  337    H    TRP  43           H        TRP  43   8.527   3.855   0.910
  338    HA   TRP  43           HA       TRP  43   7.580   1.073   0.817
  339    HB2  TRP  43           1HB      TRP  43   5.922   2.820   0.193
  340    HB3  TRP  43           2HB      TRP  43   7.000   3.356  -1.091
  341    HD1  TRP  43           HD1      TRP  43   6.355   2.434  -3.379
  342    HE1  TRP  43           HE1      TRP  43   5.154   0.334  -4.267
  343    HE3  TRP  43           HE3      TRP  43   5.514   0.040   1.061
  344    HZ2  TRP  43           HZ2      TRP  43   3.999  -2.021  -3.217
  345    HZ3  TRP  43           HZ3      TRP  43   4.352  -2.128   1.032
  346    HH2  TRP  43           HH2      TRP  43   3.609  -3.137  -1.065
  347    HA   PRO  44           HA       PRO  44  11.480   0.055  -1.033
  348    HB2  PRO  44           1HB      PRO  44  10.345  -2.086  -2.523
  349    HB3  PRO  44           2HB      PRO  44  11.206  -2.177  -0.986
  350    HG2  PRO  44           1HG      PRO  44   8.293  -2.152  -1.521
  351    HG3  PRO  44           2HG      PRO  44   9.188  -2.874  -0.173
  352    HD2  PRO  44           1HD      PRO  44   7.717  -0.644   0.130
  353    HD3  PRO  44           2HD      PRO  44   9.238  -0.892   1.019
  354    H    ALA  45           H        ALA  45   8.587   0.282  -3.088
  355    HA   ALA  45           HA       ALA  45  10.172   0.745  -5.460
  356    HB1  ALA  45           3HB      ALA  45   7.201   1.086  -5.035
  357    HB2  ALA  45           1HB      ALA  45   7.994  -0.375  -5.624
  358    HB3  ALA  45           2HB      ALA  45   8.039   1.102  -6.588
  359    H    ARG  46           H        ARG  46  11.329   2.584  -5.429
  360    HA   ARG  46           HA       ARG  46  10.169   4.982  -4.206
  361    HB2  ARG  46           1HB      ARG  46  13.018   4.492  -5.085
  362    HB3  ARG  46           2HB      ARG  46  12.433   5.848  -4.138
  363    HG2  ARG  46           1HG      ARG  46  12.007   4.444  -2.256
  364    HG3  ARG  46           2HG      ARG  46  12.340   2.990  -3.207
  365    HD2  ARG  46           1HD      ARG  46  14.654   3.779  -3.543
  366    HD3  ARG  46           2HD      ARG  46  14.306   5.177  -2.528
  367    HE   ARG  46           HE       ARG  46  14.014   3.634  -0.663
  368   HH11  ARG  46          1HH1      ARG  46  15.599   2.396  -3.535
  369   HH12  ARG  46          2HH1      ARG  46  16.497   1.186  -2.664
  370   HH21  ARG  46          1HH2      ARG  46  15.163   2.036   0.466
  371   HH22  ARG  46          2HH2      ARG  46  16.225   0.954  -0.391
  372    H    GLY  47           H        GLY  47   8.785   5.382  -6.134
  373    HA2  GLY  47           1HA      GLY  47   9.016   7.555  -7.370
  374    HA3  GLY  47           2HA      GLY  47  10.405   6.818  -8.142
  375    H    ASP  48           H        ASP  48   8.770   4.220  -8.235
  376    HA   ASP  48           HA       ASP  48   8.030   4.599 -10.950
  377    HB2  ASP  48           1HB      ASP  48   8.934   2.461 -10.016
  378    HB3  ASP  48           2HB      ASP  48   7.404   2.224  -9.178
  379    H    ARG  49           H        ARG  49   5.940   4.003 -11.862
  380    HA   ARG  49           HA       ARG  49   3.783   5.487 -11.005
  381    HB2  ARG  49           1HB      ARG  49   3.832   2.963 -12.665
  382    HB3  ARG  49           2HB      ARG  49   2.424   4.003 -12.493
  383    HG2  ARG  49           1HG      ARG  49   3.195   5.485 -13.971
  384    HG3  ARG  49           2HG      ARG  49   4.833   5.426 -13.315
  385    HD2  ARG  49           1HD      ARG  49   3.631   3.304 -15.083
  386    HD3  ARG  49           2HD      ARG  49   4.640   4.628 -15.666
  387    HE   ARG  49           HE       ARG  49   5.676   2.771 -13.635
  388   HH11  ARG  49          1HH1      ARG  49   5.787   4.088 -16.877
  389   HH12  ARG  49          2HH1      ARG  49   7.392   3.496 -17.201
  390   HH21  ARG  49          1HH2      ARG  49   7.794   2.021 -14.026
  391   HH22  ARG  49          2HH2      ARG  49   8.544   2.340 -15.569
  392    H    ALA  50           H        ALA  50   4.655   2.160 -10.223
  393    HA   ALA  50           HA       ALA  50   2.321   1.361  -8.915
  394    HB1  ALA  50           3HB      ALA  50   4.167  -0.161  -9.447
  395    HB2  ALA  50           1HB      ALA  50   3.715  -0.262  -7.745
  396    HB3  ALA  50           2HB      ALA  50   5.163   0.623  -8.221
  397    H    HIS  51           H        HIS  51   5.041   3.283  -7.780
  398    HA   HIS  51           HA       HIS  51   4.160   3.457  -5.069
  399    HB2  HIS  51           1HB      HIS  51   6.514   3.843  -5.703
  400    HB3  HIS  51           2HB      HIS  51   6.034   5.255  -6.634
  401    HD1  HIS  51           HD1      HIS  51   6.981   4.174  -3.258
  402    HD2  HIS  51           HD2      HIS  51   5.151   7.476  -4.998
  403    HE1  HIS  51           HE1      HIS  51   7.025   5.974  -1.505
  404    HE2  HIS  51           HE2      HIS  51   6.139   8.028  -2.675
  405    H    GLU  52           H        GLU  52   3.919   5.562  -7.915
  406    HA   GLU  52           HA       GLU  52   2.624   7.719  -6.680
  407    HB2  GLU  52           1HB      GLU  52   2.541   6.748  -9.531
  408    HB3  GLU  52           2HB      GLU  52   1.790   8.247  -9.001
  409    HG2  GLU  52           1HG      GLU  52   4.030   8.983  -8.178
  410    HG3  GLU  52           2HG      GLU  52   4.713   7.554  -8.957
  411    H    GLN  53           H        GLN  53   1.235   4.904  -8.351
  412    HA   GLN  53           HA       GLN  53  -1.455   5.672  -8.146
  413    HB2  GLN  53           1HB      GLN  53  -0.318   2.871  -8.164
  414    HB3  GLN  53           2HB      GLN  53  -1.997   3.292  -8.464
  415    HG2  GLN  53           1HG      GLN  53  -1.280   4.583 -10.439
  416    HG3  GLN  53           2HG      GLN  53   0.373   4.035 -10.158
  417   HE21  GLN  53          2HE2      GLN  53  -1.311   3.583 -12.463
  418   HE22  GLN  53          1HE2      GLN  53  -1.476   1.862 -12.623
  419    H    ALA  54           H        ALA  54   0.544   3.675  -6.013
  420    HA   ALA  54           HA       ALA  54  -1.370   2.829  -4.218
  421    HB1  ALA  54           3HB      ALA  54   0.441   2.506  -2.631
  422    HB2  ALA  54           1HB      ALA  54   1.486   3.559  -3.584
  423    HB3  ALA  54           2HB      ALA  54   0.943   2.018  -4.251
  424    H    LEU  55           H        LEU  55   0.602   5.784  -4.030
  425    HA   LEU  55           HA       LEU  55  -0.514   6.708  -1.612
  426    HB2  LEU  55           1HB      LEU  55   1.046   7.996  -3.812
  427    HB3  LEU  55           2HB      LEU  55   0.294   9.006  -2.594
  428    HG   LEU  55           HG       LEU  55   1.553   7.739  -0.848
  429   HD11  LEU  55          1HD1      LEU  55   1.954   5.686  -2.085
  430   HD12  LEU  55          2HD1      LEU  55   3.468   6.397  -1.527
  431   HD13  LEU  55          3HD1      LEU  55   2.986   6.555  -3.218
  432   HD21  LEU  55          3HD2      LEU  55   2.319   9.897  -1.700
  433   HD22  LEU  55          1HD2      LEU  55   3.238   9.072  -2.959
  434   HD23  LEU  55          2HD2      LEU  55   3.666   8.847  -1.262
  435    H    ARG  56           H        ARG  56  -1.302   7.490  -4.992
  436    HA   ARG  56           HA       ARG  56  -3.169   9.511  -4.293
  437    HB2  ARG  56           1HB      ARG  56  -1.936   9.257  -6.504
  438    HB3  ARG  56           2HB      ARG  56  -3.114   8.013  -6.907
  439    HG2  ARG  56           1HG      ARG  56  -4.910   9.583  -6.813
  440    HG3  ARG  56           2HG      ARG  56  -3.849  10.835  -6.165
  441    HD2  ARG  56           1HD      ARG  56  -2.516  10.642  -8.292
  442    HD3  ARG  56           2HD      ARG  56  -3.813   9.624  -8.920
  443    HE   ARG  56           HE       ARG  56  -5.013  11.944  -7.990
  444   HH11  ARG  56          1HH1      ARG  56  -2.652  11.071 -10.431
  445   HH12  ARG  56          2HH1      ARG  56  -3.079  12.389 -11.487
  446   HH21  ARG  56          1HH2      ARG  56  -5.542  13.685  -9.347
  447   HH22  ARG  56          2HH2      ARG  56  -4.695  13.906 -10.856
  448    H    LEU  57           H        LEU  57  -3.479   6.073  -5.037
  449    HA   LEU  57           HA       LEU  57  -6.321   6.074  -5.103
  450    HB2  LEU  57           1HB      LEU  57  -4.350   3.842  -4.634
  451    HB3  LEU  57           2HB      LEU  57  -6.078   3.602  -4.819
  452    HG   LEU  57           HG       LEU  57  -4.263   4.789  -6.926
  453   HD11  LEU  57          1HD1      LEU  57  -4.612   2.695  -8.123
  454   HD12  LEU  57          2HD1      LEU  57  -5.530   2.062  -6.758
  455   HD13  LEU  57          3HD1      LEU  57  -3.814   2.420  -6.576
  456   HD21  LEU  57          3HD2      LEU  57  -7.169   3.986  -7.033
  457   HD22  LEU  57          1HD2      LEU  57  -6.207   4.558  -8.393
  458   HD23  LEU  57          2HD2      LEU  57  -6.552   5.638  -7.042
  459    H    CYS  58           H        CYS  58  -3.937   5.484  -2.546
  460    HA   CYS  58           HA       CYS  58  -5.774   4.787  -0.530
  461    HB2  CYS  58           1HB      CYS  58  -3.064   6.118  -0.341
  462    HB3  CYS  58           2HB      CYS  58  -3.982   5.566   1.056
  463    HG   CYS  58           HG       CYS  58  -2.393   3.730  -1.311
  464    H    ARG  59           H        ARG  59  -4.511   7.917  -1.603
  465    HA   ARG  59           HA       ARG  59  -5.848   9.500   0.298
  466    HB2  ARG  59           1HB      ARG  59  -4.105  10.501  -0.989
  467    HB3  ARG  59           2HB      ARG  59  -4.909  10.111  -2.505
  468    HG2  ARG  59           1HG      ARG  59  -6.678  11.693  -2.005
  469    HG3  ARG  59           2HG      ARG  59  -5.948  12.039  -0.438
  470    HD2  ARG  59           1HD      ARG  59  -4.495  12.458  -3.034
  471    HD3  ARG  59           2HD      ARG  59  -5.503  13.704  -2.298
  472    HE   ARG  59           HE       ARG  59  -3.713  12.809  -0.358
  473   HH11  ARG  59          1HH1      ARG  59  -3.618  14.441  -3.432
  474   HH12  ARG  59          2HH1      ARG  59  -2.235  15.407  -3.039
  475   HH21  ARG  59          1HH2      ARG  59  -1.881  14.066   0.194
  476   HH22  ARG  59          2HH2      ARG  59  -1.234  15.191  -0.974
  477    H    ALA  60           H        ALA  60  -6.830   8.400  -2.936
  478    HA   ALA  60           HA       ALA  60  -9.311   9.737  -3.005
  479    HB1  ALA  60           3HB      ALA  60  -8.244   8.793  -4.998
  480    HB2  ALA  60           1HB      ALA  60  -9.894   8.200  -4.803
  481    HB3  ALA  60           2HB      ALA  60  -8.530   7.167  -4.378
  482    H    SER  61           H        SER  61  -8.287   6.760  -1.509
  483    HA   SER  61           HA       SER  61 -10.905   5.792  -0.920
  484    HB2  SER  61           1HB      SER  61  -8.812   4.383  -0.951
  485    HB3  SER  61           2HB      SER  61  -8.336   5.167   0.555
  486    HG   SER  61           HG       SER  61 -10.885   4.028   0.408
  487    H    LEU  62           H        LEU  62  -8.488   7.705   0.826
  488    HA   LEU  62           HA       LEU  62  -9.879   8.020   3.250
  489    HB2  LEU  62           1HB      LEU  62  -8.037  10.019   1.931
  490    HB3  LEU  62           2HB      LEU  62  -8.446   9.946   3.633
  491    HG   LEU  62           HG       LEU  62  -6.898   7.820   2.150
  492   HD11  LEU  62          1HD1      LEU  62  -5.645   9.908   2.295
  493   HD12  LEU  62          2HD1      LEU  62  -4.953   8.672   3.347
  494   HD13  LEU  62          3HD1      LEU  62  -5.935   9.967   4.034
  495   HD21  LEU  62          3HD2      LEU  62  -6.403   6.955   4.373
  496   HD22  LEU  62          1HD2      LEU  62  -8.143   6.966   4.076
  497   HD23  LEU  62          2HD2      LEU  62  -7.414   8.206   5.096
  498    H    MET  63           H        MET  63  -9.972   9.805   0.227
  499    HA   MET  63           HA       MET  63 -11.643  11.910   1.145
  500    HB2  MET  63           1HB      MET  63 -11.134  10.900  -1.659
  501    HB3  MET  63           2HB      MET  63 -11.956  12.405  -1.266
  502    HG2  MET  63           1HG      MET  63  -9.957  13.282  -0.245
  503    HG3  MET  63           2HG      MET  63  -9.125  11.749  -0.488
  504    HE1  MET  63           3HE      MET  63 -10.497  15.011  -2.150
  505    HE2  MET  63           1HE      MET  63 -11.521  13.776  -2.883
  506    HE3  MET  63           2HE      MET  63 -10.344  14.643  -3.869
  507    H    GLY  64           H        GLY  64 -12.258   8.664   0.201
  508    HA2  GLY  64           1HA      GLY  64 -14.287   7.617   0.864
  509    HA3  GLY  64           2HA      GLY  64 -15.113   9.153   0.665
  510    H    ASP  65           H        ASP  65 -12.942   8.123  -1.837
  511    HA   ASP  65           HA       ASP  65 -15.288   7.592  -3.523
  512    HB2  ASP  65           1HB      ASP  65 -12.518   8.565  -4.170
  513    HB3  ASP  65           2HB      ASP  65 -13.570   7.898  -5.417
  514    H    VAL  66           H        VAL  66 -12.119   6.299  -2.660
  515    HA   VAL  66           HA       VAL  66 -12.761   3.815  -4.057
  516    HB   VAL  66           HB       VAL  66 -10.248   4.586  -2.553
  517   HG11  VAL  66          1HG1      VAL  66 -10.834   2.212  -4.316
  518   HG12  VAL  66          2HG1      VAL  66 -10.579   2.182  -2.572
  519   HG13  VAL  66          3HG1      VAL  66  -9.256   2.626  -3.650
  520   HG21  VAL  66          3HG2      VAL  66  -9.237   4.807  -4.772
  521   HG22  VAL  66          1HG2      VAL  66 -10.570   5.939  -4.552
  522   HG23  VAL  66          2HG2      VAL  66 -10.803   4.482  -5.517
  523    H    ALA  67           H        ALA  67 -13.865   2.299  -3.004
  524    HA   ALA  67           HA       ALA  67 -13.972   2.457  -0.086
  525    HB1  ALA  67           3HB      ALA  67 -16.090   2.607  -1.301
  526    HB2  ALA  67           1HB      ALA  67 -16.036   1.197  -0.240
  527    HB3  ALA  67           2HB      ALA  67 -15.809   1.003  -1.979
  528    H    GLY  68           H        GLY  68 -12.030   1.382   0.380
  529    HA2  GLY  68           1HA      GLY  68 -10.998  -0.434   1.304
  530    HA3  GLY  68           2HA      GLY  68 -12.551  -1.236   1.210
  531    H    GLU  69           H        GLU  69 -13.054  -2.434  -0.688
  532    HA   GLU  69           HA       GLU  69 -11.124  -4.332  -1.210
  533    HB2  GLU  69           1HB      GLU  69 -13.478  -3.716  -2.994
  534    HB3  GLU  69           2HB      GLU  69 -12.668  -5.263  -2.804
  535    HG2  GLU  69           1HG      GLU  69 -14.225  -3.841  -0.656
  536    HG3  GLU  69           2HG      GLU  69 -14.822  -5.175  -1.641
  537    H    ILE  70           H        ILE  70 -12.112  -1.623  -3.265
  538    HA   ILE  70           HA       ILE  70 -10.592  -2.319  -5.522
  539    HB   ILE  70           HB       ILE  70 -11.533   0.394  -4.574
  540   HG12  ILE  70          1HG1      ILE  70 -13.064   0.099  -6.605
  541   HG13  ILE  70          2HG1      ILE  70 -12.571  -1.589  -6.602
  542   HG21  ILE  70          1HG2      ILE  70 -10.291  -0.320  -7.228
  543   HG22  ILE  70          2HG2      ILE  70  -9.570   0.694  -5.977
  544   HG23  ILE  70          3HG2      ILE  70 -11.026   1.230  -6.817
  545   HD11  ILE  70          3HD1      ILE  70 -13.510  -1.886  -4.395
  546   HD12  ILE  70          1HD1      ILE  70 -14.723  -1.224  -5.492
  547   HD13  ILE  70          2HD1      ILE  70 -13.928  -0.174  -4.318
  548    H    ALA  71           H        ALA  71  -9.823  -0.284  -2.730
  549    HA   ALA  71           HA       ALA  71  -7.263   0.523  -3.641
  550    HB1  ALA  71           3HB      ALA  71  -8.358   0.424  -0.832
  551    HB2  ALA  71           1HB      ALA  71  -8.475   1.784  -1.947
  552    HB3  ALA  71           2HB      ALA  71  -6.899   1.276  -1.338
  553    H    ARG  72           H        ARG  72  -8.405  -2.150  -1.647
  554    HA   ARG  72           HA       ARG  72  -5.904  -3.034  -0.717
  555    HB2  ARG  72           1HB      ARG  72  -8.114  -3.774   0.172
  556    HB3  ARG  72           2HB      ARG  72  -8.349  -4.717  -1.292
  557    HG2  ARG  72           1HG      ARG  72  -6.163  -5.887  -0.680
  558    HG3  ARG  72           2HG      ARG  72  -6.363  -5.149   0.911
  559    HD2  ARG  72           1HD      ARG  72  -7.308  -7.340   0.997
  560    HD3  ARG  72           2HD      ARG  72  -8.636  -6.180   1.014
  561    HE   ARG  72           HE       ARG  72  -7.802  -7.560  -1.455
  562   HH11  ARG  72          1HH1      ARG  72 -10.292  -6.558   0.786
  563   HH12  ARG  72          2HH1      ARG  72 -11.594  -7.189  -0.171
  564   HH21  ARG  72          1HH2      ARG  72  -9.492  -8.388  -2.720
  565   HH22  ARG  72          2HH2      ARG  72 -11.142  -8.251  -2.167
  566    H    THR  73           H        THR  73  -7.810  -3.989  -3.548
  567    HA   THR  73           HA       THR  73  -6.049  -6.002  -4.439
  568    HB   THR  73           HB       THR  73  -7.983  -4.403  -6.126
  569    HG1  THR  73           HG1      THR  73  -9.284  -5.217  -4.594
  570   HG21  THR  73          3HG2      THR  73  -8.110  -6.458  -7.462
  571   HG22  THR  73          1HG2      THR  73  -6.913  -7.218  -6.411
  572   HG23  THR  73          2HG2      THR  73  -6.461  -5.836  -7.409
  573    H    ALA  74           H        ALA  74  -6.344  -2.565  -5.252
  574    HA   ALA  74           HA       ALA  74  -4.372  -2.570  -7.289
  575    HB1  ALA  74           3HB      ALA  74  -5.323  -0.285  -5.566
  576    HB2  ALA  74           1HB      ALA  74  -6.051  -0.804  -7.086
  577    HB3  ALA  74           2HB      ALA  74  -4.417  -0.141  -7.073
  578    H    PHE  75           H        PHE  75  -4.272  -2.112  -3.812
  579    HA   PHE  75           HA       PHE  75  -1.609  -1.235  -3.572
  580    HB2  PHE  75           1HB      PHE  75  -3.574  -1.420  -1.820
  581    HB3  PHE  75           2HB      PHE  75  -2.879  -3.005  -1.509
  582    HD1  PHE  75           HD1      PHE  75  -0.488  -3.149  -0.738
  583    HD2  PHE  75           HD2      PHE  75  -2.624   0.524  -0.947
  584    HE1  PHE  75           HE1      PHE  75   1.143  -2.117   0.789
  585    HE2  PHE  75           HE2      PHE  75  -0.999   1.558   0.580
  586    HZ   PHE  75           HZ       PHE  75   0.889   0.238   1.448
  587    H    VAL  76           H        VAL  76  -3.054  -4.478  -3.433
  588    HA   VAL  76           HA       VAL  76  -0.693  -5.937  -3.038
  589    HB   VAL  76           HB       VAL  76  -3.228  -6.792  -4.450
  590   HG11  VAL  76          1HG1      VAL  76  -1.401  -8.278  -5.028
  591   HG12  VAL  76          2HG1      VAL  76  -2.517  -9.089  -3.926
  592   HG13  VAL  76          3HG1      VAL  76  -0.982  -8.460  -3.324
  593   HG21  VAL  76          3HG2      VAL  76  -2.339  -7.100  -1.583
  594   HG22  VAL  76          1HG2      VAL  76  -3.782  -7.834  -2.285
  595   HG23  VAL  76          2HG2      VAL  76  -3.652  -6.080  -2.176
  596    H    ALA  77           H        ALA  77  -2.254  -4.799  -5.996
  597    HA   ALA  77           HA       ALA  77  -0.641  -6.147  -7.855
  598    HB1  ALA  77           3HB      ALA  77  -1.357  -4.426  -9.452
  599    HB2  ALA  77           1HB      ALA  77  -1.999  -3.464  -8.118
  600    HB3  ALA  77           2HB      ALA  77  -2.707  -5.037  -8.493
  601    H    ALA  78           H        ALA  78  -0.153  -3.143  -6.089
  602    HA   ALA  78           HA       ALA  78   2.267  -2.439  -7.448
  603    HB1  ALA  78           3HB      ALA  78   1.217  -1.518  -4.771
  604    HB2  ALA  78           1HB      ALA  78   0.890  -0.754  -6.327
  605    HB3  ALA  78           2HB      ALA  78   2.532  -0.772  -5.680
  606    H    SER  79           H        SER  79   1.459  -4.031  -4.393
  607    HA   SER  79           HA       SER  79   4.049  -4.399  -3.418
  608    HB2  SER  79           1HB      SER  79   1.656  -6.214  -3.025
  609    HB3  SER  79           2HB      SER  79   3.077  -6.113  -1.984
  610    HG   SER  79           HG       SER  79   1.817  -4.737  -0.974
  611    H    ARG  80           H        ARG  80   2.260  -6.158  -5.855
  612    HA   ARG  80           HA       ARG  80   3.759  -8.517  -5.965
  613    HB2  ARG  80           1HB      ARG  80   2.173  -6.985  -7.991
  614    HB3  ARG  80           2HB      ARG  80   3.119  -8.377  -8.496
  615    HG2  ARG  80           1HG      ARG  80   1.889  -9.805  -6.987
  616    HG3  ARG  80           2HG      ARG  80   0.993  -8.417  -6.364
  617    HD2  ARG  80           1HD      ARG  80  -0.237  -9.791  -8.055
  618    HD3  ARG  80           2HD      ARG  80  -0.094  -8.080  -8.449
  619    HE   ARG  80           HE       ARG  80   2.019  -9.576  -9.627
  620   HH11  ARG  80          1HH1      ARG  80  -1.407  -8.943  -9.955
  621   HH12  ARG  80          2HH1      ARG  80  -1.408  -9.104 -11.686
  622   HH21  ARG  80          1HH2      ARG  80   2.035  -9.808 -11.888
  623   HH22  ARG  80          2HH2      ARG  80   0.562  -9.600 -12.790
  624    H    GLN  81           H        GLN  81   4.320  -5.381  -7.487
  625    HA   GLN  81           HA       GLN  81   6.533  -6.302  -9.046
  626    HB2  GLN  81           1HB      GLN  81   5.742  -3.469  -8.360
  627    HB3  GLN  81           2HB      GLN  81   6.812  -3.967  -9.666
  628    HG2  GLN  81           1HG      GLN  81   4.924  -5.195 -10.689
  629    HG3  GLN  81           2HG      GLN  81   3.871  -4.570  -9.422
  630   HE21  GLN  81          2HE2      GLN  81   2.557  -3.472 -10.826
  631   HE22  GLN  81          1HE2      GLN  81   3.060  -2.052 -11.671
  632    H    ALA  82           H        ALA  82   6.132  -5.241  -5.827
  633    HA   ALA  82           HA       ALA  82   9.007  -4.827  -5.466
  634    HB1  ALA  82           3HB      ALA  82   8.423  -4.119  -3.196
  635    HB2  ALA  82           1HB      ALA  82   6.732  -4.508  -3.509
  636    HB3  ALA  82           2HB      ALA  82   7.520  -3.209  -4.407
  637    H    HIS  83           H        HIS  83   6.746  -7.260  -5.398
  638    HA   HIS  83           HA       HIS  83   6.714  -9.420  -4.757
  639    HB2  HIS  83           1HB      HIS  83   9.638  -8.990  -4.116
  640    HB3  HIS  83           2HB      HIS  83   8.834 -10.553  -4.189
  641    HD1  HIS  83           HD1      HIS  83   7.997 -11.325  -6.610
  642    HD2  HIS  83           HD2      HIS  83  10.480  -7.984  -6.524
  643    HE1  HIS  83           HE1      HIS  83   8.799 -11.012  -8.971
  644    HE2  HIS  83           HE2      HIS  83  10.415  -9.076  -8.871
  645    H    CYS  84           H        CYS  84   6.077  -7.298  -2.898
  646    HA   CYS  84           HA       CYS  84   6.708  -8.564  -0.326
  647    HB2  CYS  84           1HB      CYS  84   5.511  -5.836  -0.885
  648    HB3  CYS  84           2HB      CYS  84   5.934  -6.472   0.704
  649    HG   CYS  84           HG       CYS  84   8.712  -6.816  -0.453
  650    H    LEU  85           H        LEU  85   5.194 -10.254  -1.182
  651    HA   LEU  85           HA       LEU  85   2.372  -9.480  -0.904
  652    HB2  LEU  85           1HB      LEU  85   3.596 -11.856  -2.300
  653    HB3  LEU  85           2HB      LEU  85   1.878 -11.530  -2.183
  654    HG   LEU  85           HG       LEU  85   3.866  -9.743  -3.578
  655   HD11  LEU  85          1HD1      LEU  85   1.884 -11.710  -4.710
  656   HD12  LEU  85          2HD1      LEU  85   3.641 -11.857  -4.746
  657   HD13  LEU  85          3HD1      LEU  85   2.847 -10.565  -5.645
  658   HD21  LEU  85          3HD2      LEU  85   1.875  -8.638  -4.468
  659   HD22  LEU  85          1HD2      LEU  85   1.929  -8.545  -2.708
  660   HD23  LEU  85          2HD2      LEU  85   0.852  -9.696  -3.497
  661    H    MET  86           H        MET  86   1.052 -10.504   0.498
  662    HA   MET  86           HA       MET  86   1.884 -12.951   1.808
  663    HB2  MET  86           1HB      MET  86   1.954 -10.349   3.131
  664    HB3  MET  86           2HB      MET  86   0.921 -11.501   3.966
  665    HG2  MET  86           1HG      MET  86   3.793 -11.982   3.212
  666    HG3  MET  86           2HG      MET  86   3.226 -11.495   4.808
  667    HE1  MET  86           3HE      MET  86   0.639 -13.120   5.333
  668    HE2  MET  86           1HE      MET  86   1.969 -13.036   6.489
  669    HE3  MET  86           2HE      MET  86   1.273 -14.597   6.056
  670    H    GLU  87           H        GLU  87   0.013 -13.451   3.522
  671    HA   GLU  87           HA       GLU  87  -2.570 -12.839   2.271
  672    HB2  GLU  87           1HB      GLU  87  -1.198 -15.223   1.893
  673    HB3  GLU  87           2HB      GLU  87  -2.309 -15.605   3.200
  674    HG2  GLU  87           1HG      GLU  87  -3.280 -14.275   0.704
  675    HG3  GLU  87           2HG      GLU  87  -3.034 -16.018   0.764
  676    H    ASP  88           H        ASP  88  -4.347 -13.905   3.770
  677    HA   ASP  88           HA       ASP  88  -4.191 -12.781   6.348
  678    HB2  ASP  88           1HB      ASP  88  -6.332 -13.221   5.267
  679    HB3  ASP  88           2HB      ASP  88  -6.014 -14.951   5.276
  680    H    LYS  89           H        LYS  89  -3.596 -16.026   5.151
  681    HA   LYS  89           HA       LYS  89  -2.968 -17.020   7.803
  682    HB2  LYS  89           1HB      LYS  89  -2.758 -18.369   5.103
  683    HB3  LYS  89           2HB      LYS  89  -2.550 -19.160   6.660
  684    HG2  LYS  89           1HG      LYS  89  -5.082 -17.868   5.657
  685    HG3  LYS  89           2HG      LYS  89  -4.755 -19.601   5.736
  686    HD2  LYS  89           1HD      LYS  89  -4.585 -19.489   8.154
  687    HD3  LYS  89           2HD      LYS  89  -4.806 -17.740   8.109
  688    HE2  LYS  89           1HE      LYS  89  -6.836 -19.760   7.160
  689    HE3  LYS  89           2HE      LYS  89  -6.857 -18.977   8.739
  690    HZ1  LYS  89           3HZ      LYS  89  -7.116 -17.623   6.105
  691    HZ2  LYS  89           1HZ      LYS  89  -7.042 -16.820   7.598
  692    HZ3  LYS  89           2HZ      LYS  89  -8.345 -17.849   7.245
  693    H    ALA  90           H        ALA  90  -0.941 -17.383   8.588
  694    HA   ALA  90           HA       ALA  90   1.078 -15.681   7.510
  695    HB1  ALA  90           3HB      ALA  90   0.688 -15.904   9.915
  696    HB2  ALA  90           1HB      ALA  90   2.358 -16.272   9.482
  697    HB3  ALA  90           2HB      ALA  90   1.231 -17.580   9.842
  698    H    GLU  91           H        GLU  91   3.357 -16.376   7.367
  699    HA   GLU  91           HA       GLU  91   3.628 -18.440   5.408
  700    HB2  GLU  91           1HB      GLU  91   4.905 -16.183   5.691
  701    HB3  GLU  91           2HB      GLU  91   5.908 -17.073   6.821
  702    HG2  GLU  91           1HG      GLU  91   5.477 -17.974   3.990
  703    HG3  GLU  91           2HG      GLU  91   6.756 -16.854   4.451
  704    H    ALA  92           H        ALA  92   4.181 -20.519   5.714
  705    HA   ALA  92           HA       ALA  92   4.996 -21.348   8.422
  706    HB1  ALA  92           3HB      ALA  92   3.368 -22.894   6.407
  707    HB2  ALA  92           1HB      ALA  92   2.745 -22.106   7.856
  708    HB3  ALA  92           2HB      ALA  92   3.853 -23.470   8.002
  709    HA   PRO  93           HA       PRO  93   8.762 -22.258   6.176
  710    HB2  PRO  93           1HB      PRO  93  10.036 -23.386   8.347
  711    HB3  PRO  93           2HB      PRO  93   9.984 -21.656   7.993
  712    HG2  PRO  93           1HG      PRO  93   8.307 -23.256   9.883
  713    HG3  PRO  93           2HG      PRO  93   9.006 -21.640  10.095
  714    HD2  PRO  93           1HD      PRO  93   6.414 -21.982   9.497
  715    HD3  PRO  93           2HD      PRO  93   7.348 -20.621   8.836
  716    H    ASN  94           H        ASN  94   8.271 -24.760   8.660
  717    HA   ASN  94           HA       ASN  94   8.583 -26.759   6.522
  718    HB2  ASN  94           1HB      ASN  94  10.476 -26.692   8.091
  719    HB3  ASN  94           2HB      ASN  94   9.374 -26.955   9.438
  720   HD21  ASN  94          2HD2      ASN  94  10.381 -28.846  10.063
  721   HD22  ASN  94          1HD2      ASN  94  10.253 -30.315   9.149
  722    H    THR  95           H        THR  95   7.172 -28.403   6.366
  723    HA   THR  95           HA       THR  95   5.159 -28.738   8.481
  724    HB   THR  95           HB       THR  95   4.487 -28.824   5.532
  725    HG1  THR  95           HG1      THR  95   4.855 -26.683   5.905
  726   HG21  THR  95          3HG2      THR  95   2.718 -28.679   7.979
  727   HG22  THR  95          1HG2      THR  95   3.003 -30.121   7.006
  728   HG23  THR  95          2HG2      THR  95   2.171 -28.734   6.303
  729    H    ILE  96           H        ILE  96   4.121 -30.887   8.384
  730    HA   ILE  96           HA       ILE  96   6.127 -32.891   7.712
  731    HB   ILE  96           HB       ILE  96   4.720 -34.443   9.040
  732   HG12  ILE  96          1HG1      ILE  96   3.067 -31.971   9.618
  733   HG13  ILE  96          2HG1      ILE  96   2.547 -33.336   8.635
  734   HG21  ILE  96          1HG2      ILE  96   5.475 -31.877  10.433
  735   HG22  ILE  96          2HG2      ILE  96   6.549 -33.233  10.086
  736   HG23  ILE  96          3HG2      ILE  96   5.212 -33.435  11.218
  737   HD11  ILE  96          3HD1      ILE  96   2.706 -34.794  10.593
  738   HD12  ILE  96          1HD1      ILE  96   1.589 -33.453  10.851
  739   HD13  ILE  96          2HD1      ILE  96   3.200 -33.410  11.571
  740    H    ALA  97           H        ALA  97   4.918 -35.145   7.229
  741    HA   ALA  97           HA       ALA  97   3.576 -34.681   4.672
  742    HB1  ALA  97           3HB      ALA  97   5.553 -36.134   4.702
  743    HB2  ALA  97           1HB      ALA  97   4.111 -37.002   4.177
  744    HB3  ALA  97           2HB      ALA  97   4.727 -37.227   5.814
  745    H    SER  98           H        SER  98   1.500 -35.052   4.357
  746    HA   SER  98           HA       SER  98   0.061 -36.860   6.167
  747    HB2  SER  98           1HB      SER  98  -0.336 -34.505   6.892
  748    HB3  SER  98           2HB      SER  98  -0.965 -34.146   5.286
  749    HG   SER  98           HG       SER  98  -2.730 -35.335   5.675
  750    H    GLY  99           H        GLY  99  -1.636 -37.991   5.186
  751    HA2  GLY  99           1HA      GLY  99  -2.163 -37.439   2.352
  752    HA3  GLY  99           2HA      GLY  99  -1.530 -39.023   2.779
  753    H    SER 100           H        SER 100  -2.864 -39.551   5.103
  754    HA   SER 100           HA       SER 100  -5.705 -39.383   4.397
  755    HB2  SER 100           1HB      SER 100  -4.245 -41.907   5.228
  756    HB3  SER 100           2HB      SER 100  -5.987 -41.768   4.985
  757    HG   SER 100           HG       SER 100  -5.615 -41.332   2.805
  Start of MODEL   16
    1    H1   MET   1           1H       MET   1   1.360  25.682   1.094
    2    H2   MET   1           2H       MET   1   0.558  24.670   2.191
    3    H3   MET   1           3H       MET   1   1.461  25.986   2.761
    4    HA   MET   1           HA       MET   1  -0.921  26.410   2.831
    5    HB2  MET   1           1HB      MET   1   0.726  28.046   0.898
    6    HB3  MET   1           2HB      MET   1  -0.862  28.546   1.465
    7    HG2  MET   1           1HG      MET   1  -0.034  28.526   3.769
    8    HG3  MET   1           2HG      MET   1   1.558  28.053   3.182
    9    HE1  MET   1           3HE      MET   1   0.872  30.595   5.066
   10    HE2  MET   1           1HE      MET   1   1.964  31.794   4.373
   11    HE3  MET   1           2HE      MET   1   2.510  30.133   4.606
   12    H    GLU   2           H        GLU   2  -2.588  25.333   2.075
   13    HA   GLU   2           HA       GLU   2  -3.038  25.303  -0.831
   14    HB2  GLU   2           1HB      GLU   2  -3.395  22.996   1.090
   15    HB3  GLU   2           2HB      GLU   2  -3.990  23.004  -0.566
   16    HG2  GLU   2           1HG      GLU   2  -1.814  23.027  -1.458
   17    HG3  GLU   2           2HG      GLU   2  -1.099  23.442   0.098
   18    H    VAL   3           H        VAL   3  -4.751  26.540  -1.143
   19    HA   VAL   3           HA       VAL   3  -6.560  27.189   0.969
   20    HB   VAL   3           HB       VAL   3  -6.792  27.874  -1.968
   21   HG11  VAL   3          1HG1      VAL   3  -8.024  29.146   0.475
   22   HG12  VAL   3          2HG1      VAL   3  -8.867  28.208  -0.758
   23   HG13  VAL   3          3HG1      VAL   3  -8.148  29.764  -1.172
   24   HG21  VAL   3          3HG2      VAL   3  -5.702  29.990  -1.399
   25   HG22  VAL   3          1HG2      VAL   3  -4.646  28.615  -1.078
   26   HG23  VAL   3          2HG2      VAL   3  -5.466  29.425   0.255
   27    H    GLN   4           H        GLN   4  -8.291  26.105   1.548
   28    HA   GLN   4           HA       GLN   4 -10.192  24.873   1.520
   29    HB2  GLN   4           1HB      GLN   4 -10.077  25.186  -1.486
   30    HB3  GLN   4           2HB      GLN   4 -11.467  24.651  -0.554
   31    HG2  GLN   4           1HG      GLN   4 -11.632  26.825   0.500
   32    HG3  GLN   4           2HG      GLN   4 -10.184  27.366  -0.349
   33   HE21  GLN   4          2HE2      GLN   4 -12.839  28.500  -0.429
   34   HE22  GLN   4          1HE2      GLN   4 -13.355  28.433  -2.087
   35    H    SER   5           H        SER   5  -7.498  23.689   1.252
   36    HA   SER   5           HA       SER   5  -7.525  21.414  -0.375
   37    HB2  SER   5           1HB      SER   5  -5.891  20.539   1.450
   38    HB3  SER   5           2HB      SER   5  -5.430  21.960   0.512
   39    HG   SER   5           HG       SER   5  -5.675  23.207   2.228
   40    H    MET   6           H        MET   6  -8.300  19.377  -0.132
   41    HA   MET   6           HA       MET   6 -10.602  19.143   1.556
   42    HB2  MET   6           1HB      MET   6  -9.290  17.102  -0.250
   43    HB3  MET   6           2HB      MET   6 -10.873  16.933   0.498
   44    HG2  MET   6           1HG      MET   6 -11.654  18.903  -0.738
   45    HG3  MET   6           2HG      MET   6 -10.076  19.028  -1.513
   46    HE1  MET   6           3HE      MET   6 -13.036  15.541  -2.153
   47    HE2  MET   6           1HE      MET   6 -13.383  16.964  -1.168
   48    HE3  MET   6           2HE      MET   6 -12.171  15.800  -0.636
   49    H    LEU   7           H        LEU   7 -10.996  17.465   3.088
   50    HA   LEU   7           HA       LEU   7  -8.741  17.163   4.853
   51    HB2  LEU   7           1HB      LEU   7 -11.578  16.185   5.175
   52    HB3  LEU   7           2HB      LEU   7 -10.363  16.262   6.435
   53    HG   LEU   7           HG       LEU   7 -11.610  18.623   5.026
   54   HD11  LEU   7          1HD1      LEU   7 -12.609  19.090   7.203
   55   HD12  LEU   7          2HD1      LEU   7 -11.885  17.621   7.857
   56   HD13  LEU   7          3HD1      LEU   7 -13.113  17.513   6.596
   57   HD21  LEU   7          3HD2      LEU   7 -10.379  19.981   6.652
   58   HD22  LEU   7          1HD2      LEU   7  -9.291  19.078   5.598
   59   HD23  LEU   7          2HD2      LEU   7  -9.573  18.530   7.251
   60    H    LEU   8           H        LEU   8  -7.446  15.465   4.937
   61    HA   LEU   8           HA       LEU   8  -8.212  12.960   3.677
   62    HB2  LEU   8           1HB      LEU   8  -5.677  13.755   5.121
   63    HB3  LEU   8           2HB      LEU   8  -5.929  12.229   4.296
   64    HG   LEU   8           HG       LEU   8  -5.830  14.957   3.005
   65   HD11  LEU   8          1HD1      LEU   8  -3.805  14.109   1.946
   66   HD12  LEU   8          2HD1      LEU   8  -3.956  12.603   2.852
   67   HD13  LEU   8          3HD1      LEU   8  -3.652  14.119   3.702
   68   HD21  LEU   8          3HD2      LEU   8  -7.442  13.501   1.883
   69   HD22  LEU   8          1HD2      LEU   8  -6.214  12.242   1.751
   70   HD23  LEU   8          2HD2      LEU   8  -6.011  13.765   0.885
   71    H    ASN   9           H        ASN   9  -9.749  12.027   4.891
   72    HA   ASN   9           HA       ASN   9  -9.699  12.058   7.763
   73    HB2  ASN   9           1HB      ASN   9 -11.491  10.533   5.854
   74    HB3  ASN   9           2HB      ASN   9 -11.753  10.703   7.585
   75   HD21  ASN   9          2HD2      ASN   9 -11.872  12.278   4.496
   76   HD22  ASN   9          1HD2      ASN   9 -12.749  13.673   5.021
   77    H    ASP  10           H        ASP  10  -9.479  10.259   9.137
   78    HA   ASP  10           HA       ASP  10  -7.667   8.235   8.174
   79    HB2  ASP  10           1HB      ASP  10  -8.970   8.660  10.873
   80    HB3  ASP  10           2HB      ASP  10  -7.839   7.354  10.530
   81    H    VAL  11           H        VAL  11  -8.641   6.883   6.779
   82    HA   VAL  11           HA       VAL  11 -11.173   5.629   7.584
   83    HB   VAL  11           HB       VAL  11  -9.901   5.722   4.838
   84   HG11  VAL  11          1HG1      VAL  11 -12.081   4.921   4.044
   85   HG12  VAL  11          2HG1      VAL  11 -12.624   4.768   5.716
   86   HG13  VAL  11          3HG1      VAL  11 -11.302   3.762   5.122
   87   HG21  VAL  11          3HG2      VAL  11 -12.216   7.302   5.956
   88   HG22  VAL  11          1HG2      VAL  11 -11.675   7.322   4.278
   89   HG23  VAL  11          2HG2      VAL  11 -10.622   7.936   5.551
   90    H    LYS  12           H        LYS  12 -11.328   3.427   7.778
   91    HA   LYS  12           HA       LYS  12  -8.788   1.981   7.809
   92    HB2  LYS  12           1HB      LYS  12 -11.481   1.443   9.032
   93    HB3  LYS  12           2HB      LYS  12 -10.251   0.191   8.937
   94    HG2  LYS  12           1HG      LYS  12  -8.721   1.627  10.218
   95    HG3  LYS  12           2HG      LYS  12 -10.002   2.835  10.352
   96    HD2  LYS  12           1HD      LYS  12 -11.375   1.332  11.612
   97    HD3  LYS  12           2HD      LYS  12 -10.260  -0.005  11.326
   98    HE2  LYS  12           1HE      LYS  12 -10.008   0.900  13.581
   99    HE3  LYS  12           2HE      LYS  12  -8.543   1.127  12.629
  100    HZ1  LYS  12           3HZ      LYS  12  -9.193   3.085  13.959
  101    HZ2  LYS  12           1HZ      LYS  12 -10.608   3.225  13.035
  102    HZ3  LYS  12           2HZ      LYS  12  -9.091   3.412  12.302
  103    H    TRP  13           H        TRP  13  -8.592  -0.108   6.899
  104    HA   TRP  13           HA       TRP  13  -9.959  -0.339   4.349
  105    HB2  TRP  13           1HB      TRP  13  -7.410  -1.146   5.417
  106    HB3  TRP  13           2HB      TRP  13  -8.234  -2.543   4.736
  107    HD1  TRP  13           HD1      TRP  13  -9.572  -1.366   2.207
  108    HE1  TRP  13           HE1      TRP  13  -8.165  -0.484   0.243
  109    HE3  TRP  13           HE3      TRP  13  -5.187  -0.509   4.683
  110    HZ2  TRP  13           HZ2      TRP  13  -5.531   0.441  -0.200
  111    HZ3  TRP  13           HZ3      TRP  13  -3.271   0.371   3.418
  112    HH2  TRP  13           HH2      TRP  13  -3.440   0.836   1.028
  113    H    GLU  14           H        GLU  14 -11.345  -1.938   3.778
  114    HA   GLU  14           HA       GLU  14 -12.662  -3.448   5.792
  115    HB2  GLU  14           1HB      GLU  14 -12.750  -3.672   2.779
  116    HB3  GLU  14           2HB      GLU  14 -13.842  -4.507   3.876
  117    HG2  GLU  14           1HG      GLU  14 -13.578  -1.522   3.588
  118    HG3  GLU  14           2HG      GLU  14 -14.870  -2.518   2.918
  119    H    LYS  15           H        LYS  15 -10.276  -4.176   3.318
  120    HA   LYS  15           HA       LYS  15  -9.937  -6.853   4.465
  121    HB2  LYS  15           1HB      LYS  15  -9.237  -5.794   1.724
  122    HB3  LYS  15           2HB      LYS  15  -8.776  -7.387   2.309
  123    HG2  LYS  15           1HG      LYS  15 -11.592  -6.384   1.957
  124    HG3  LYS  15           2HG      LYS  15 -10.742  -7.507   0.892
  125    HD2  LYS  15           1HD      LYS  15 -10.543  -9.101   2.745
  126    HD3  LYS  15           2HD      LYS  15 -11.406  -7.979   3.799
  127    HE2  LYS  15           1HE      LYS  15 -13.366  -8.130   2.352
  128    HE3  LYS  15           2HE      LYS  15 -12.502  -9.239   1.289
  129    HZ1  LYS  15           3HZ      LYS  15 -13.214  -9.736   4.128
  130    HZ2  LYS  15           1HZ      LYS  15 -12.317 -10.790   3.152
  131    HZ3  LYS  15           2HZ      LYS  15 -13.935 -10.454   2.773
  132    HA   PRO  16           HA       PRO  16  -6.172  -5.175   6.143
  133    HB2  PRO  16           1HB      PRO  16  -5.539  -7.960   6.805
  134    HB3  PRO  16           2HB      PRO  16  -5.802  -6.586   7.881
  135    HG2  PRO  16           1HG      PRO  16  -7.572  -8.608   7.675
  136    HG3  PRO  16           2HG      PRO  16  -8.072  -6.936   7.991
  137    HD2  PRO  16           1HD      PRO  16  -8.149  -8.489   5.432
  138    HD3  PRO  16           2HD      PRO  16  -9.341  -7.352   6.100
  139    H    VAL  17           H        VAL  17  -4.142  -4.932   5.418
  140    HA   VAL  17           HA       VAL  17  -3.121  -6.874   3.449
  141    HB   VAL  17           HB       VAL  17  -2.438  -3.930   3.622
  142   HG11  VAL  17          1HG1      VAL  17  -1.299  -4.299   1.486
  143   HG12  VAL  17          2HG1      VAL  17  -1.683  -6.018   1.581
  144   HG13  VAL  17          3HG1      VAL  17  -0.607  -5.287   2.773
  145   HG21  VAL  17          3HG2      VAL  17  -3.686  -3.702   1.515
  146   HG22  VAL  17          1HG2      VAL  17  -4.723  -4.222   2.843
  147   HG23  VAL  17          2HG2      VAL  17  -4.182  -5.390   1.637
  148    H    THR  18           H        THR  18  -1.355  -7.949   4.085
  149    HA   THR  18           HA       THR  18   0.075  -6.952   6.460
  150    HB   THR  18           HB       THR  18  -0.043  -9.797   5.434
  151    HG1  THR  18           HG1      THR  18  -2.110  -9.217   6.120
  152   HG21  THR  18          3HG2      THR  18   0.810  -8.654   8.092
  153   HG22  THR  18          1HG2      THR  18   1.891  -9.273   6.846
  154   HG23  THR  18          2HG2      THR  18   0.772 -10.364   7.662
  155    H    ILE  19           H        ILE  19   1.724  -5.758   5.596
  156    HA   ILE  19           HA       ILE  19   3.185  -6.796   3.299
  157    HB   ILE  19           HB       ILE  19   3.431  -4.194   4.825
  158   HG12  ILE  19          1HG1      ILE  19   1.419  -4.589   3.314
  159   HG13  ILE  19          2HG1      ILE  19   2.382  -3.154   2.972
  160   HG21  ILE  19          1HG2      ILE  19   4.929  -5.083   2.364
  161   HG22  ILE  19          2HG2      ILE  19   5.615  -4.844   3.970
  162   HG23  ILE  19          3HG2      ILE  19   4.978  -3.468   3.071
  163   HD11  ILE  19          3HD1      ILE  19   1.718  -4.305   0.940
  164   HD12  ILE  19          1HD1      ILE  19   2.543  -5.764   1.489
  165   HD13  ILE  19          2HD1      ILE  19   3.469  -4.302   1.142
  166    H    SER  20           H        SER  20   4.532  -8.391   3.864
  167    HA   SER  20           HA       SER  20   6.069  -8.203   6.305
  168    HB2  SER  20           1HB      SER  20   7.048 -10.420   5.144
  169    HB3  SER  20           2HB      SER  20   5.535 -10.414   6.051
  170    HG   SER  20           HG       SER  20   4.443 -10.684   4.257
  171    H    LEU  21           H        LEU  21   7.603  -6.730   6.199
  172    HA   LEU  21           HA       LEU  21   8.936  -6.066   3.755
  173    HB2  LEU  21           1HB      LEU  21   9.284  -5.141   6.598
  174    HB3  LEU  21           2HB      LEU  21  10.273  -4.547   5.278
  175    HG   LEU  21           HG       LEU  21   7.272  -4.272   5.432
  176   HD11  LEU  21          1HD1      LEU  21   8.415  -2.949   7.150
  177   HD12  LEU  21          2HD1      LEU  21   7.706  -1.923   5.903
  178   HD13  LEU  21          3HD1      LEU  21   9.443  -2.234   5.907
  179   HD21  LEU  21          3HD2      LEU  21   8.156  -4.361   3.147
  180   HD22  LEU  21          1HD2      LEU  21   9.293  -3.071   3.539
  181   HD23  LEU  21          2HD2      LEU  21   7.558  -2.752   3.547
  182    H    GLN  22           H        GLN  22  11.318  -5.812   3.725
  183    HA   GLN  22           HA       GLN  22  12.585  -8.321   3.972
  184    HB2  GLN  22           1HB      GLN  22  13.812  -5.589   3.544
  185    HB3  GLN  22           2HB      GLN  22  14.590  -7.132   3.213
  186    HG2  GLN  22           1HG      GLN  22  13.053  -7.611   1.455
  187    HG3  GLN  22           2HG      GLN  22  12.058  -6.219   1.877
  188   HE21  GLN  22          2HE2      GLN  22  13.345  -6.916  -0.643
  189   HE22  GLN  22          1HE2      GLN  22  14.352  -5.563  -1.045
  190    H    ASN  23           H        ASN  23  12.000  -5.879   6.198
  191    HA   ASN  23           HA       ASN  23  14.206  -6.195   7.957
  192    HB2  ASN  23           1HB      ASN  23  11.372  -5.318   8.571
  193    HB3  ASN  23           2HB      ASN  23  12.775  -5.074   9.606
  194   HD21  ASN  23          2HD2      ASN  23  14.178  -3.420   9.171
  195   HD22  ASN  23          1HD2      ASN  23  13.883  -2.226   7.950
  196    H    GLY  24           H        GLY  24  11.581  -8.185   7.155
  197    HA2  GLY  24           1HA      GLY  24  11.333 -10.407   7.839
  198    HA3  GLY  24           2HA      GLY  24  12.349 -10.075   9.232
  199    H    ALA  25           H        ALA  25   9.584  -8.108   8.338
  200    HA   ALA  25           HA       ALA  25   7.982  -9.313  10.459
  201    HB1  ALA  25           3HB      ALA  25   9.300  -7.569  11.566
  202    HB2  ALA  25           1HB      ALA  25   7.580  -7.179  11.558
  203    HB3  ALA  25           2HB      ALA  25   8.672  -6.376  10.429
  204    HA   PRO  26           HA       PRO  26   4.870  -8.237   7.357
  205    HB2  PRO  26           1HB      PRO  26   3.089  -9.816   9.030
  206    HB3  PRO  26           2HB      PRO  26   3.634 -10.132   7.383
  207    HG2  PRO  26           1HG      PRO  26   4.397 -11.643   9.492
  208    HG3  PRO  26           2HG      PRO  26   5.425 -11.379   8.072
  209    HD2  PRO  26           1HD      PRO  26   5.526 -10.039  10.757
  210    HD3  PRO  26           2HD      PRO  26   6.864 -10.636   9.747
  211    H    ARG  27           H        ARG  27   4.258  -6.178   7.641
  212    HA   ARG  27           HA       ARG  27   2.976  -5.381  10.145
  213    HB2  ARG  27           1HB      ARG  27   3.845  -3.731   7.761
  214    HB3  ARG  27           2HB      ARG  27   3.136  -3.081   9.232
  215    HG2  ARG  27           1HG      ARG  27   5.047  -4.008  10.506
  216    HG3  ARG  27           2HG      ARG  27   5.773  -4.509   8.979
  217    HD2  ARG  27           1HD      ARG  27   6.715  -2.394   9.732
  218    HD3  ARG  27           2HD      ARG  27   5.815  -2.180   8.232
  219    HE   ARG  27           HE       ARG  27   4.315  -0.839   9.343
  220   HH11  ARG  27          1HH1      ARG  27   6.347  -2.470  11.678
  221   HH12  ARG  27          2HH1      ARG  27   5.795  -1.520  13.021
  222   HH21  ARG  27          1HH2      ARG  27   3.602   0.429  11.089
  223   HH22  ARG  27          2HH2      ARG  27   4.209   0.121  12.693
  224    H    ILE  28           H        ILE  28   0.868  -5.604  10.298
  225    HA   ILE  28           HA       ILE  28  -0.788  -5.820   7.925
  226    HB   ILE  28           HB       ILE  28  -1.661  -5.870  10.820
  227   HG12  ILE  28          1HG1      ILE  28  -0.987  -8.197   9.005
  228   HG13  ILE  28          2HG1      ILE  28   0.027  -7.626  10.327
  229   HG21  ILE  28          1HG2      ILE  28  -3.617  -7.054   9.940
  230   HG22  ILE  28          2HG2      ILE  28  -2.989  -6.871   8.303
  231   HG23  ILE  28          3HG2      ILE  28  -3.460  -5.448   9.232
  232   HD11  ILE  28          3HD1      ILE  28  -1.250  -9.595  10.961
  233   HD12  ILE  28          1HD1      ILE  28  -2.753  -8.748  10.599
  234   HD13  ILE  28          2HD1      ILE  28  -1.724  -8.195  11.921
  235    H    PHE  29           H        PHE  29  -1.655  -4.104   6.989
  236    HA   PHE  29           HA       PHE  29  -2.097  -1.676   8.577
  237    HB2  PHE  29           1HB      PHE  29  -2.278  -2.022   5.576
  238    HB3  PHE  29           2HB      PHE  29  -2.312  -0.503   6.461
  239    HD1  PHE  29           HD1      PHE  29  -0.244   0.296   7.606
  240    HD2  PHE  29           HD2      PHE  29  -0.264  -3.076   5.015
  241    HE1  PHE  29           HE1      PHE  29   2.206   0.450   7.386
  242    HE2  PHE  29           HE2      PHE  29   2.173  -2.926   4.795
  243    HZ   PHE  29           HZ       PHE  29   3.414  -1.171   5.968
  244    H    ASN  30           H        ASN  30  -4.031  -1.695   9.537
  245    HA   ASN  30           HA       ASN  30  -6.352  -2.629   7.999
  246    HB2  ASN  30           1HB      ASN  30  -6.000  -2.006  10.935
  247    HB3  ASN  30           2HB      ASN  30  -7.568  -2.337  10.206
  248   HD21  ASN  30          2HD2      ASN  30  -8.023  -4.422   9.469
  249   HD22  ASN  30          1HD2      ASN  30  -7.099  -5.789   9.986
  250    H    GLY  31           H        GLY  31  -4.666   0.151   8.802
  251    HA2  GLY  31           1HA      GLY  31  -7.016   1.816   8.155
  252    HA3  GLY  31           2HA      GLY  31  -5.647   2.377   9.107
  253    H    VAL  32           H        VAL  32  -6.969   3.066   6.381
  254    HA   VAL  32           HA       VAL  32  -5.002   2.515   4.399
  255    HB   VAL  32           HB       VAL  32  -7.070   4.718   4.364
  256   HG11  VAL  32          1HG1      VAL  32  -5.373   4.976   2.655
  257   HG12  VAL  32          2HG1      VAL  32  -6.901   4.489   1.922
  258   HG13  VAL  32          3HG1      VAL  32  -5.610   3.308   2.136
  259   HG21  VAL  32          3HG2      VAL  32  -7.315   1.858   3.435
  260   HG22  VAL  32          1HG2      VAL  32  -8.510   3.129   3.170
  261   HG23  VAL  32          2HG2      VAL  32  -8.148   2.587   4.809
  262    H    TYR  33           H        TYR  33  -5.571   5.159   6.622
  263    HA   TYR  33           HA       TYR  33  -3.804   7.027   5.446
  264    HB2  TYR  33           1HB      TYR  33  -5.562   7.686   7.023
  265    HB3  TYR  33           2HB      TYR  33  -4.769   6.778   8.304
  266    HD1  TYR  33           HD2      TYR  33  -4.284   9.658   5.998
  267    HD2  TYR  33           HD1      TYR  33  -3.165   7.793   9.653
  268    HE1  TYR  33           HE2      TYR  33  -3.000  11.661   6.620
  269    HE2  TYR  33           HE1      TYR  33  -1.881   9.787  10.286
  270    HH   TYR  33           HH       TYR  33  -0.812  11.678   9.264
  271    H    GLU  34           H        GLU  34  -3.415   4.510   7.869
  272    HA   GLU  34           HA       GLU  34  -0.775   5.079   8.644
  273    HB2  GLU  34           1HB      GLU  34  -2.327   2.489   8.574
  274    HB3  GLU  34           2HB      GLU  34  -0.731   2.640   9.299
  275    HG2  GLU  34           1HG      GLU  34  -1.490   3.892  11.055
  276    HG3  GLU  34           2HG      GLU  34  -2.871   4.516  10.155
  277    H    ALA  35           H        ALA  35  -2.073   3.102   6.018
  278    HA   ALA  35           HA       ALA  35   0.474   2.201   5.094
  279    HB1  ALA  35           3HB      ALA  35  -0.736   1.408   3.130
  280    HB2  ALA  35           1HB      ALA  35  -2.164   2.310   3.637
  281    HB3  ALA  35           2HB      ALA  35  -1.577   0.965   4.615
  282    H    PHE  36           H        PHE  36  -1.624   4.903   4.341
  283    HA   PHE  36           HA       PHE  36  -0.393   5.885   2.048
  284    HB2  PHE  36           1HB      PHE  36  -2.523   6.738   2.943
  285    HB3  PHE  36           2HB      PHE  36  -1.671   7.444   4.309
  286    HD1  PHE  36           HD1      PHE  36  -2.056   7.616   0.632
  287    HD2  PHE  36           HD2      PHE  36  -0.705   9.579   4.160
  288    HE1  PHE  36           HE1      PHE  36  -1.758   9.701  -0.642
  289    HE2  PHE  36           HE2      PHE  36  -0.404  11.662   2.889
  290    HZ   PHE  36           HZ       PHE  36  -0.933  11.726   0.486
  291    H    ASP  37           H        ASP  37   0.249   6.754   5.447
  292    HA   ASP  37           HA       ASP  37   2.475   8.397   4.952
  293    HB2  ASP  37           1HB      ASP  37   1.543   6.852   7.351
  294    HB3  ASP  37           2HB      ASP  37   3.099   7.672   7.377
  295    H    PHE  38           H        PHE  38   2.203   4.939   5.535
  296    HA   PHE  38           HA       PHE  38   4.904   4.290   5.772
  297    HB2  PHE  38           1HB      PHE  38   3.136   2.713   6.311
  298    HB3  PHE  38           2HB      PHE  38   2.609   2.681   4.634
  299    HD1  PHE  38           HD1      PHE  38   5.580   1.950   6.757
  300    HD2  PHE  38           HD2      PHE  38   3.378   1.022   3.233
  301    HE1  PHE  38           HE1      PHE  38   7.062   0.032   6.335
  302    HE2  PHE  38           HE2      PHE  38   4.859  -0.890   2.807
  303    HZ   PHE  38           HZ       PHE  38   6.698  -1.390   4.357
  304    H    LEU  39           H        LEU  39   2.855   4.466   2.878
  305    HA   LEU  39           HA       LEU  39   4.796   3.608   1.034
  306    HB2  LEU  39           1HB      LEU  39   2.422   5.422   0.621
  307    HB3  LEU  39           2HB      LEU  39   3.356   4.692  -0.669
  308    HG   LEU  39           HG       LEU  39   1.722   3.193   1.380
  309   HD11  LEU  39          1HD1      LEU  39   1.248   3.697  -1.553
  310   HD12  LEU  39          2HD1      LEU  39   0.339   4.399  -0.214
  311   HD13  LEU  39          3HD1      LEU  39   0.270   2.663  -0.512
  312   HD21  LEU  39          3HD2      LEU  39   3.267   2.210  -1.016
  313   HD22  LEU  39          1HD2      LEU  39   2.196   1.231  -0.013
  314   HD23  LEU  39          2HD2      LEU  39   3.668   1.915   0.675
  315    H    GLN  40           H        GLN  40   4.063   6.789   2.341
  316    HA   GLN  40           HA       GLN  40   5.767   8.158   0.473
  317    HB2  GLN  40           1HB      GLN  40   4.351   9.041   2.979
  318    HB3  GLN  40           2HB      GLN  40   5.404  10.110   2.066
  319    HG2  GLN  40           1HG      GLN  40   3.971   9.826   0.101
  320    HG3  GLN  40           2HG      GLN  40   2.905   8.782   1.041
  321   HE21  GLN  40          2HE2      GLN  40   2.452  11.389  -0.286
  322   HE22  GLN  40          1HE2      GLN  40   1.827  12.421   0.955
  323    H    HIS  41           H        HIS  41   6.074   6.960   3.760
  324    HA   HIS  41           HA       HIS  41   8.391   8.405   4.444
  325    HB2  HIS  41           1HB      HIS  41   7.271   5.804   5.475
  326    HB3  HIS  41           2HB      HIS  41   8.750   6.510   6.119
  327    HD1  HIS  41           HD1      HIS  41   6.555   6.199   8.088
  328    HD2  HIS  41           HD2      HIS  41   6.886   9.564   5.659
  329    HE1  HIS  41           HE1      HIS  41   5.274   8.024   9.266
  330    HE2  HIS  41           HE2      HIS  41   5.415  10.029   7.736
  331    H    GLU  42           H        GLU  42   8.240   4.910   3.709
  332    HA   GLU  42           HA       GLU  42  10.311   5.138   1.784
  333    HB2  GLU  42           1HB      GLU  42  11.731   5.385   3.731
  334    HB3  GLU  42           2HB      GLU  42  11.058   3.925   4.446
  335    HG2  GLU  42           1HG      GLU  42  12.209   2.536   3.044
  336    HG3  GLU  42           2HG      GLU  42  12.320   3.741   1.762
  337    H    TRP  43           H        TRP  43   8.682   4.047   0.620
  338    HA   TRP  43           HA       TRP  43   8.477   1.191   1.092
  339    HB2  TRP  43           1HB      TRP  43   6.644   2.433  -0.036
  340    HB3  TRP  43           2HB      TRP  43   7.745   2.850  -1.343
  341    HD1  TRP  43           HD1      TRP  43   8.211   1.019  -3.183
  342    HE1  TRP  43           HE1      TRP  43   7.121  -1.246  -3.730
  343    HE3  TRP  43           HE3      TRP  43   5.527   0.344   1.119
  344    HZ2  TRP  43           HZ2      TRP  43   5.357  -3.071  -2.506
  345    HZ3  TRP  43           HZ3      TRP  43   4.163  -1.690   1.346
  346    HH2  TRP  43           HH2      TRP  43   4.080  -3.362  -0.430
  347    HA   PRO  44           HA       PRO  44  12.472   0.365  -0.638
  348    HB2  PRO  44           1HB      PRO  44  12.141  -2.254  -1.323
  349    HB3  PRO  44           2HB      PRO  44  12.376  -1.697   0.337
  350    HG2  PRO  44           1HG      PRO  44   9.839  -2.404  -1.084
  351    HG3  PRO  44           2HG      PRO  44  10.351  -2.820   0.562
  352    HD2  PRO  44           1HD      PRO  44   8.615  -0.821   0.072
  353    HD3  PRO  44           2HD      PRO  44   9.794  -0.736   1.397
  354    H    ALA  45           H        ALA  45   9.994   1.025  -2.510
  355    HA   ALA  45           HA       ALA  45  11.528   0.994  -4.913
  356    HB1  ALA  45           3HB      ALA  45  10.679  -1.302  -5.012
  357    HB2  ALA  45           1HB      ALA  45   9.974  -0.309  -6.287
  358    HB3  ALA  45           2HB      ALA  45   9.027  -0.704  -4.851
  359    H    ARG  46           H        ARG  46  11.047   3.227  -4.160
  360    HA   ARG  46           HA       ARG  46   8.307   4.076  -4.813
  361    HB2  ARG  46           1HB      ARG  46   8.763   6.082  -3.512
  362    HB3  ARG  46           2HB      ARG  46   9.076   4.645  -2.554
  363    HG2  ARG  46           1HG      ARG  46  11.524   4.952  -3.206
  364    HG3  ARG  46           2HG      ARG  46  11.046   6.565  -3.741
  365    HD2  ARG  46           1HD      ARG  46  10.054   6.911  -1.458
  366    HD3  ARG  46           2HD      ARG  46  10.815   5.397  -0.977
  367    HE   ARG  46           HE       ARG  46  12.282   7.808  -1.845
  368   HH11  ARG  46          1HH1      ARG  46  12.129   4.815  -0.031
  369   HH12  ARG  46          2HH1      ARG  46  13.576   5.138   0.873
  370   HH21  ARG  46          1HH2      ARG  46  14.183   8.227  -0.697
  371   HH22  ARG  46          2HH2      ARG  46  14.747   7.092   0.494
  372    H    GLY  47           H        GLY  47   7.903   5.598  -6.348
  373    HA2  GLY  47           1HA      GLY  47   8.889   7.405  -7.770
  374    HA3  GLY  47           2HA      GLY  47  10.213   6.283  -8.063
  375    H    ASP  48           H        ASP  48   8.019   4.137  -7.965
  376    HA   ASP  48           HA       ASP  48   7.614   4.102 -10.825
  377    HB2  ASP  48           1HB      ASP  48   8.418   2.063  -9.960
  378    HB3  ASP  48           2HB      ASP  48   7.301   2.100  -8.601
  379    H    ARG  49           H        ARG  49   5.591   3.886 -11.824
  380    HA   ARG  49           HA       ARG  49   3.629   5.565 -10.629
  381    HB2  ARG  49           1HB      ARG  49   3.667   4.038 -13.223
  382    HB3  ARG  49           2HB      ARG  49   2.342   5.087 -12.738
  383    HG2  ARG  49           1HG      ARG  49   3.885   6.983 -12.631
  384    HG3  ARG  49           2HG      ARG  49   5.204   5.926 -13.139
  385    HD2  ARG  49           1HD      ARG  49   4.061   5.478 -15.236
  386    HD3  ARG  49           2HD      ARG  49   2.704   6.481 -14.728
  387    HE   ARG  49           HE       ARG  49   4.730   8.219 -14.574
  388   HH11  ARG  49          1HH1      ARG  49   3.900   5.905 -17.067
  389   HH12  ARG  49          2HH1      ARG  49   4.455   6.924 -18.368
  390   HH21  ARG  49          1HH2      ARG  49   5.488   9.538 -16.283
  391   HH22  ARG  49          2HH2      ARG  49   5.359   8.972 -17.922
  392    H    ALA  50           H        ALA  50   4.083   2.169 -10.531
  393    HA   ALA  50           HA       ALA  50   1.245   1.586 -10.223
  394    HB1  ALA  50           3HB      ALA  50   3.638  -0.191  -9.738
  395    HB2  ALA  50           1HB      ALA  50   2.704  -0.104 -11.232
  396    HB3  ALA  50           2HB      ALA  50   1.952  -0.706  -9.755
  397    H    HIS  51           H        HIS  51   4.142   1.800  -8.246
  398    HA   HIS  51           HA       HIS  51   2.975   1.429  -5.728
  399    HB2  HIS  51           1HB      HIS  51   5.370   1.499  -5.908
  400    HB3  HIS  51           2HB      HIS  51   5.329   3.114  -6.606
  401    HD1  HIS  51           HD1      HIS  51   5.702   4.986  -5.020
  402    HD2  HIS  51           HD2      HIS  51   4.443   1.517  -3.088
  403    HE1  HIS  51           HE1      HIS  51   5.800   5.501  -2.559
  404    HE2  HIS  51           HE2      HIS  51   5.171   3.349  -1.415
  405    H    GLU  52           H        GLU  52   3.134   4.222  -7.845
  406    HA   GLU  52           HA       GLU  52   2.075   6.029  -5.889
  407    HB2  GLU  52           1HB      GLU  52   3.583   6.645  -7.844
  408    HB3  GLU  52           2HB      GLU  52   2.159   6.478  -8.866
  409    HG2  GLU  52           1HG      GLU  52   1.025   8.215  -7.627
  410    HG3  GLU  52           2HG      GLU  52   2.388   8.343  -6.515
  411    H    GLN  53           H        GLN  53   0.778   4.072  -8.507
  412    HA   GLN  53           HA       GLN  53  -1.815   5.041  -8.650
  413    HB2  GLN  53           1HB      GLN  53  -1.089   3.316 -10.166
  414    HB3  GLN  53           2HB      GLN  53  -0.786   2.203  -8.840
  415    HG2  GLN  53           1HG      GLN  53  -2.795   1.535  -9.931
  416    HG3  GLN  53           2HG      GLN  53  -3.223   2.198  -8.357
  417   HE21  GLN  53          2HE2      GLN  53  -4.308   4.180  -8.254
  418   HE22  GLN  53          1HE2      GLN  53  -5.113   4.850  -9.634
  419    H    ALA  54           H        ALA  54  -0.471   2.631  -6.416
  420    HA   ALA  54           HA       ALA  54  -2.825   2.280  -4.893
  421    HB1  ALA  54           3HB      ALA  54  -1.362   1.279  -3.208
  422    HB2  ALA  54           1HB      ALA  54   0.050   1.913  -4.054
  423    HB3  ALA  54           2HB      ALA  54  -0.966   0.695  -4.825
  424    H    LEU  55           H        LEU  55  -0.029   4.412  -4.507
  425    HA   LEU  55           HA       LEU  55  -0.699   5.546  -2.041
  426    HB2  LEU  55           1HB      LEU  55   1.497   5.760  -3.100
  427    HB3  LEU  55           2HB      LEU  55   0.803   6.760  -4.360
  428    HG   LEU  55           HG       LEU  55   0.247   8.472  -2.643
  429   HD11  LEU  55          1HD1      LEU  55   1.277   8.312  -0.437
  430   HD12  LEU  55          2HD1      LEU  55   1.849   6.686  -0.817
  431   HD13  LEU  55          3HD1      LEU  55   0.118   7.009  -0.699
  432   HD21  LEU  55          3HD2      LEU  55   3.148   7.665  -2.798
  433   HD22  LEU  55          1HD2      LEU  55   2.544   9.255  -2.330
  434   HD23  LEU  55          2HD2      LEU  55   2.278   8.657  -3.968
  435    H    ARG  56           H        ARG  56  -1.471   6.616  -5.335
  436    HA   ARG  56           HA       ARG  56  -2.835   8.970  -4.642
  437    HB2  ARG  56           1HB      ARG  56  -3.105   7.152  -7.039
  438    HB3  ARG  56           2HB      ARG  56  -3.937   8.695  -6.901
  439    HG2  ARG  56           1HG      ARG  56  -1.800   9.853  -6.776
  440    HG3  ARG  56           2HG      ARG  56  -0.949   8.309  -6.860
  441    HD2  ARG  56           1HD      ARG  56  -1.962   7.901  -9.070
  442    HD3  ARG  56           2HD      ARG  56  -2.739   9.481  -8.988
  443    HE   ARG  56           HE       ARG  56   0.105   9.630  -8.650
  444   HH11  ARG  56          1HH1      ARG  56  -2.447   9.396 -11.030
  445   HH12  ARG  56          2HH1      ARG  56  -1.518  10.150 -12.289
  446   HH21  ARG  56          1HH2      ARG  56   1.346  10.571 -10.292
  447   HH22  ARG  56          2HH2      ARG  56   0.663  10.793 -11.878
  448    H    LEU  57           H        LEU  57  -3.954   5.642  -5.020
  449    HA   LEU  57           HA       LEU  57  -6.703   6.236  -4.633
  450    HB2  LEU  57           1HB      LEU  57  -5.156   3.674  -4.330
  451    HB3  LEU  57           2HB      LEU  57  -6.895   3.781  -4.145
  452    HG   LEU  57           HG       LEU  57  -5.354   4.414  -6.661
  453   HD11  LEU  57          1HD1      LEU  57  -5.412   2.036  -6.115
  454   HD12  LEU  57          2HD1      LEU  57  -6.395   2.399  -7.535
  455   HD13  LEU  57          3HD1      LEU  57  -7.169   2.110  -5.976
  456   HD21  LEU  57          3HD2      LEU  57  -8.323   4.378  -6.123
  457   HD22  LEU  57          1HD2      LEU  57  -7.568   4.582  -7.704
  458   HD23  LEU  57          2HD2      LEU  57  -7.342   5.805  -6.454
  459    H    CYS  58           H        CYS  58  -4.066   5.363  -2.450
  460    HA   CYS  58           HA       CYS  58  -5.587   5.003  -0.124
  461    HB2  CYS  58           1HB      CYS  58  -2.784   6.106  -0.425
  462    HB3  CYS  58           2HB      CYS  58  -3.501   5.599   1.101
  463    HG   CYS  58           HG       CYS  58  -2.868   3.557  -1.574
  464    H    ARG  59           H        ARG  59  -4.180   7.918  -1.552
  465    HA   ARG  59           HA       ARG  59  -5.046   9.747   0.407
  466    HB2  ARG  59           1HB      ARG  59  -3.380  10.215  -1.413
  467    HB3  ARG  59           2HB      ARG  59  -4.716  10.270  -2.555
  468    HG2  ARG  59           1HG      ARG  59  -5.686  12.148  -1.265
  469    HG3  ARG  59           2HG      ARG  59  -4.257  12.125  -0.227
  470    HD2  ARG  59           1HD      ARG  59  -2.869  12.460  -2.281
  471    HD3  ARG  59           2HD      ARG  59  -4.366  12.693  -3.181
  472    HE   ARG  59           HE       ARG  59  -3.810  14.414  -0.870
  473   HH11  ARG  59          1HH1      ARG  59  -4.283  14.038  -4.323
  474   HH12  ARG  59          2HH1      ARG  59  -4.273  15.747  -4.637
  475   HH21  ARG  59          1HH2      ARG  59  -3.807  16.650  -1.282
  476   HH22  ARG  59          2HH2      ARG  59  -3.982  17.227  -2.912
  477    H    ALA  60           H        ALA  60  -6.536   8.620  -2.600
  478    HA   ALA  60           HA       ALA  60  -8.847  10.236  -2.425
  479    HB1  ALA  60           3HB      ALA  60  -8.094   9.236  -4.518
  480    HB2  ALA  60           1HB      ALA  60  -9.762   8.790  -4.160
  481    HB3  ALA  60           2HB      ALA  60  -8.461   7.630  -3.888
  482    H    SER  61           H        SER  61  -8.017   7.142  -1.032
  483    HA   SER  61           HA       SER  61 -10.645   6.404  -0.249
  484    HB2  SER  61           1HB      SER  61  -7.987   5.639   0.988
  485    HB3  SER  61           2HB      SER  61  -9.528   4.832   1.282
  486    HG   SER  61           HG       SER  61  -8.116   5.000  -1.180
  487    H    LEU  62           H        LEU  62  -8.081   8.313   1.221
  488    HA   LEU  62           HA       LEU  62  -9.354   8.719   3.728
  489    HB2  LEU  62           1HB      LEU  62  -7.406  10.577   2.362
  490    HB3  LEU  62           2HB      LEU  62  -7.719  10.447   4.082
  491    HG   LEU  62           HG       LEU  62  -6.364   8.368   2.361
  492   HD11  LEU  62          1HD1      LEU  62  -4.972  10.312   2.786
  493   HD12  LEU  62          2HD1      LEU  62  -4.386   8.912   3.687
  494   HD13  LEU  62          3HD1      LEU  62  -5.291  10.178   4.516
  495   HD21  LEU  62          3HD2      LEU  62  -6.907   8.368   5.327
  496   HD22  LEU  62          1HD2      LEU  62  -5.955   7.172   4.449
  497   HD23  LEU  62          2HD2      LEU  62  -7.683   7.329   4.133
  498    H    MET  63           H        MET  63  -9.785   9.994   0.598
  499    HA   MET  63           HA       MET  63 -11.283  12.332   1.450
  500    HB2  MET  63           1HB      MET  63 -10.809  11.159  -1.298
  501    HB3  MET  63           2HB      MET  63 -11.590  12.701  -0.975
  502    HG2  MET  63           1HG      MET  63  -9.592  13.668  -0.203
  503    HG3  MET  63           2HG      MET  63  -8.789  12.103  -0.082
  504    HE1  MET  63           3HE      MET  63 -10.226  14.824  -2.543
  505    HE2  MET  63           1HE      MET  63 -11.081  13.360  -3.026
  506    HE3  MET  63           2HE      MET  63  -9.890  14.085  -4.108
  507    H    GLY  64           H        GLY  64 -11.898   9.121   1.320
  508    HA2  GLY  64           1HA      GLY  64 -13.850   7.915   1.478
  509    HA3  GLY  64           2HA      GLY  64 -14.727   9.437   1.467
  510    H    ASP  65           H        ASP  65 -12.552   8.846  -1.131
  511    HA   ASP  65           HA       ASP  65 -14.848   8.729  -2.941
  512    HB2  ASP  65           1HB      ASP  65 -13.055  10.448  -3.261
  513    HB3  ASP  65           2HB      ASP  65 -11.929   9.141  -3.617
  514    H    VAL  66           H        VAL  66 -12.028   6.911  -1.971
  515    HA   VAL  66           HA       VAL  66 -12.842   4.722  -3.762
  516    HB   VAL  66           HB       VAL  66 -10.145   5.206  -2.472
  517   HG11  VAL  66          1HG1      VAL  66 -10.655   2.821  -2.695
  518   HG12  VAL  66          2HG1      VAL  66  -9.369   3.314  -3.797
  519   HG13  VAL  66          3HG1      VAL  66 -11.004   3.061  -4.407
  520   HG21  VAL  66          3HG2      VAL  66 -11.020   5.400  -5.353
  521   HG22  VAL  66          1HG2      VAL  66  -9.368   5.588  -4.764
  522   HG23  VAL  66          2HG2      VAL  66 -10.608   6.752  -4.297
  523    H    ALA  67           H        ALA  67 -14.055   3.284  -2.731
  524    HA   ALA  67           HA       ALA  67 -13.937   3.095   0.151
  525    HB1  ALA  67           3HB      ALA  67 -16.095   3.184  -0.997
  526    HB2  ALA  67           1HB      ALA  67 -15.921   1.714  -0.036
  527    HB3  ALA  67           2HB      ALA  67 -15.732   1.650  -1.790
  528    H    GLY  68           H        GLY  68 -11.878   2.130   0.425
  529    HA2  GLY  68           1HA      GLY  68 -10.743   0.342   1.273
  530    HA3  GLY  68           2HA      GLY  68 -12.267  -0.516   1.233
  531    H    GLU  69           H        GLU  69 -12.752  -1.855  -0.545
  532    HA   GLU  69           HA       GLU  69 -10.562  -3.463  -1.170
  533    HB2  GLU  69           1HB      GLU  69 -12.904  -4.235  -0.983
  534    HB3  GLU  69           2HB      GLU  69 -13.256  -3.462  -2.523
  535    HG2  GLU  69           1HG      GLU  69 -11.682  -4.923  -3.644
  536    HG3  GLU  69           2HG      GLU  69 -11.257  -5.671  -2.106
  537    H    ILE  70           H        ILE  70 -12.014  -0.882  -3.050
  538    HA   ILE  70           HA       ILE  70 -10.895  -1.513  -5.550
  539    HB   ILE  70           HB       ILE  70 -11.373   1.251  -4.421
  540   HG12  ILE  70          1HG1      ILE  70 -13.214  -0.530  -6.031
  541   HG13  ILE  70          2HG1      ILE  70 -13.378  -0.189  -4.312
  542   HG21  ILE  70          1HG2      ILE  70 -11.583   1.920  -6.777
  543   HG22  ILE  70          2HG2      ILE  70 -11.153   0.282  -7.270
  544   HG23  ILE  70          3HG2      ILE  70  -9.980   1.283  -6.415
  545   HD11  ILE  70          3HD1      ILE  70 -13.738   2.172  -4.823
  546   HD12  ILE  70          1HD1      ILE  70 -14.928   1.138  -5.612
  547   HD13  ILE  70          2HD1      ILE  70 -13.595   1.817  -6.545
  548    H    ALA  71           H        ALA  71  -9.666   0.596  -2.962
  549    HA   ALA  71           HA       ALA  71  -7.135   1.078  -4.105
  550    HB1  ALA  71           3HB      ALA  71  -7.938   1.094  -1.195
  551    HB2  ALA  71           1HB      ALA  71  -8.037   2.460  -2.305
  552    HB3  ALA  71           2HB      ALA  71  -6.465   1.798  -1.861
  553    H    ARG  72           H        ARG  72  -8.369  -1.437  -1.975
  554    HA   ARG  72           HA       ARG  72  -6.023  -2.782  -1.332
  555    HB2  ARG  72           1HB      ARG  72  -8.041  -3.473  -0.283
  556    HB3  ARG  72           2HB      ARG  72  -8.829  -3.770  -1.826
  557    HG2  ARG  72           1HG      ARG  72  -6.979  -5.558  -2.143
  558    HG3  ARG  72           2HG      ARG  72  -6.798  -5.423  -0.392
  559    HD2  ARG  72           1HD      ARG  72  -9.078  -6.045  -0.038
  560    HD3  ARG  72           2HD      ARG  72  -9.426  -5.952  -1.765
  561    HE   ARG  72           HE       ARG  72  -7.474  -7.910  -0.744
  562   HH11  ARG  72          1HH1      ARG  72 -10.500  -7.209  -2.376
  563   HH12  ARG  72          2HH1      ARG  72 -10.694  -8.821  -2.981
  564   HH21  ARG  72          1HH2      ARG  72  -7.716  -9.997  -1.527
  565   HH22  ARG  72          2HH2      ARG  72  -9.101 -10.424  -2.495
  566    H    THR  73           H        THR  73  -8.164  -3.265  -4.121
  567    HA   THR  73           HA       THR  73  -6.853  -5.380  -5.338
  568    HB   THR  73           HB       THR  73  -8.237  -3.124  -6.806
  569    HG1  THR  73           HG1      THR  73  -9.579  -3.948  -5.121
  570   HG21  THR  73          3HG2      THR  73  -8.812  -4.870  -8.422
  571   HG22  THR  73          1HG2      THR  73  -7.920  -6.056  -7.467
  572   HG23  THR  73          2HG2      THR  73  -7.062  -4.724  -8.245
  573    H    ALA  74           H        ALA  74  -6.348  -1.886  -5.806
  574    HA   ALA  74           HA       ALA  74  -4.234  -2.298  -7.706
  575    HB1  ALA  74           3HB      ALA  74  -5.641  -0.308  -7.776
  576    HB2  ALA  74           1HB      ALA  74  -3.934   0.105  -7.615
  577    HB3  ALA  74           2HB      ALA  74  -4.999   0.197  -6.213
  578    H    PHE  75           H        PHE  75  -4.406  -1.812  -4.231
  579    HA   PHE  75           HA       PHE  75  -1.703  -1.131  -3.815
  580    HB2  PHE  75           1HB      PHE  75  -3.618  -0.954  -2.137
  581    HB3  PHE  75           2HB      PHE  75  -3.420  -2.680  -1.868
  582    HD1  PHE  75           HD2      PHE  75  -1.952   0.628  -1.389
  583    HD2  PHE  75           HD1      PHE  75  -1.495  -3.542  -0.667
  584    HE1  PHE  75           HE2      PHE  75  -0.201   1.110   0.266
  585    HE2  PHE  75           HE1      PHE  75   0.262  -3.064   0.998
  586    HZ   PHE  75           HZ       PHE  75   0.908  -0.733   1.457
  587    H    VAL  76           H        VAL  76  -3.411  -4.228  -3.865
  588    HA   VAL  76           HA       VAL  76  -1.186  -5.873  -3.319
  589    HB   VAL  76           HB       VAL  76  -3.678  -6.517  -4.914
  590   HG11  VAL  76          1HG1      VAL  76  -3.186  -8.859  -4.391
  591   HG12  VAL  76          2HG1      VAL  76  -1.677  -8.368  -3.620
  592   HG13  VAL  76          3HG1      VAL  76  -1.900  -8.127  -5.353
  593   HG21  VAL  76          3HG2      VAL  76  -4.198  -5.773  -2.659
  594   HG22  VAL  76          1HG2      VAL  76  -3.047  -6.930  -1.992
  595   HG23  VAL  76          2HG2      VAL  76  -4.496  -7.504  -2.818
  596    H    ALA  77           H        ALA  77  -2.538  -4.598  -6.328
  597    HA   ALA  77           HA       ALA  77  -0.871  -5.905  -8.148
  598    HB1  ALA  77           3HB      ALA  77  -2.812  -4.587  -8.820
  599    HB2  ALA  77           1HB      ALA  77  -1.360  -4.071  -9.678
  600    HB3  ALA  77           2HB      ALA  77  -1.980  -3.107  -8.338
  601    H    ALA  78           H        ALA  78  -0.370  -2.877  -6.368
  602    HA   ALA  78           HA       ALA  78   2.159  -2.282  -7.503
  603    HB1  ALA  78           3HB      ALA  78   0.780  -0.593  -6.395
  604    HB2  ALA  78           1HB      ALA  78   2.388  -0.679  -5.681
  605    HB3  ALA  78           2HB      ALA  78   1.015  -1.411  -4.850
  606    H    SER  79           H        SER  79   1.144  -4.082  -4.651
  607    HA   SER  79           HA       SER  79   3.737  -4.406  -3.543
  608    HB2  SER  79           1HB      SER  79   1.260  -6.095  -3.119
  609    HB3  SER  79           2HB      SER  79   2.682  -6.053  -2.075
  610    HG   SER  79           HG       SER  79   0.843  -3.949  -2.584
  611    H    ARG  80           H        ARG  80   2.055  -5.974  -6.104
  612    HA   ARG  80           HA       ARG  80   3.298  -8.477  -6.164
  613    HB2  ARG  80           1HB      ARG  80   1.439  -7.982  -7.633
  614    HB3  ARG  80           2HB      ARG  80   2.357  -6.715  -8.435
  615    HG2  ARG  80           1HG      ARG  80   3.973  -8.510  -9.161
  616    HG3  ARG  80           2HG      ARG  80   2.796  -9.684  -8.573
  617    HD2  ARG  80           1HD      ARG  80   1.141  -8.879 -10.125
  618    HD3  ARG  80           2HD      ARG  80   2.202  -7.564 -10.634
  619    HE   ARG  80           HE       ARG  80   3.073 -10.338 -11.020
  620   HH11  ARG  80          1HH1      ARG  80   1.989  -7.297 -12.402
  621   HH12  ARG  80          2HH1      ARG  80   2.548  -7.689 -14.002
  622   HH21  ARG  80          1HH2      ARG  80   3.809 -10.839 -13.130
  623   HH22  ARG  80          2HH2      ARG  80   3.567  -9.693 -14.412
  624    H    GLN  81           H        GLN  81   4.402  -5.324  -7.225
  625    HA   GLN  81           HA       GLN  81   6.651  -6.275  -8.694
  626    HB2  GLN  81           1HB      GLN  81   6.080  -3.536  -7.553
  627    HB3  GLN  81           2HB      GLN  81   7.339  -3.909  -8.725
  628    HG2  GLN  81           1HG      GLN  81   5.641  -4.616 -10.329
  629    HG3  GLN  81           2HG      GLN  81   4.380  -4.246  -9.157
  630   HE21  GLN  81          2HE2      GLN  81   5.770  -1.855  -8.202
  631   HE22  GLN  81          1HE2      GLN  81   5.547  -0.651  -9.430
  632    H    ALA  82           H        ALA  82   6.034  -5.852  -5.370
  633    HA   ALA  82           HA       ALA  82   8.843  -5.669  -4.642
  634    HB1  ALA  82           3HB      ALA  82   8.033  -5.660  -2.334
  635    HB2  ALA  82           1HB      ALA  82   6.393  -5.967  -2.905
  636    HB3  ALA  82           2HB      ALA  82   7.197  -4.449  -3.307
  637    H    HIS  83           H        HIS  83   6.767  -8.032  -5.630
  638    HA   HIS  83           HA       HIS  83   6.828 -10.292  -5.703
  639    HB2  HIS  83           1HB      HIS  83   9.652  -9.876  -4.710
  640    HB3  HIS  83           2HB      HIS  83   9.012 -11.415  -5.280
  641    HD1  HIS  83           HD1      HIS  83  10.636  -8.371  -6.422
  642    HD2  HIS  83           HD2      HIS  83   8.252 -11.338  -8.105
  643    HE1  HIS  83           HE1      HIS  83  10.916  -8.140  -8.911
  644    HE2  HIS  83           HE2      HIS  83   9.610 -10.056  -9.900
  645    H    CYS  84           H        CYS  84   5.961  -8.918  -3.252
  646    HA   CYS  84           HA       CYS  84   6.057 -11.245  -1.506
  647    HB2  CYS  84           1HB      CYS  84   7.789  -9.549  -0.755
  648    HB3  CYS  84           2HB      CYS  84   6.456  -8.449  -0.424
  649    HG   CYS  84           HG       CYS  84   7.071  -9.352   2.046
  650    H    LEU  85           H        LEU  85   3.965 -11.637  -2.197
  651    HA   LEU  85           HA       LEU  85   1.935  -9.629  -1.576
  652    HB2  LEU  85           1HB      LEU  85   1.783 -12.238  -3.078
  653    HB3  LEU  85           2HB      LEU  85   0.390 -11.230  -2.728
  654    HG   LEU  85           HG       LEU  85   2.767 -10.410  -4.393
  655   HD11  LEU  85          1HD1      LEU  85   1.365 -12.081  -5.493
  656   HD12  LEU  85          2HD1      LEU  85   1.207 -10.505  -6.267
  657   HD13  LEU  85          3HD1      LEU  85  -0.061 -11.089  -5.187
  658   HD21  LEU  85          3HD2      LEU  85   1.429  -8.437  -4.929
  659   HD22  LEU  85          1HD2      LEU  85   1.777  -8.529  -3.203
  660   HD23  LEU  85          2HD2      LEU  85   0.181  -8.976  -3.806
  661    H    MET  86           H        MET  86   0.851  -9.706   0.204
  662    HA   MET  86           HA       MET  86   0.069 -12.158   1.473
  663    HB2  MET  86           1HB      MET  86   2.362 -11.975   2.311
  664    HB3  MET  86           2HB      MET  86   2.060 -10.329   2.841
  665    HG2  MET  86           1HG      MET  86   0.523 -11.096   4.521
  666    HG3  MET  86           2HG      MET  86   0.643 -12.751   3.929
  667    HE1  MET  86           3HE      MET  86   4.328 -13.683   4.843
  668    HE2  MET  86           1HE      MET  86   3.728 -13.044   3.314
  669    HE3  MET  86           2HE      MET  86   2.801 -14.266   4.184
  670    H    GLU  87           H        GLU  87  -2.027 -11.467   1.393
  671    HA   GLU  87           HA       GLU  87  -2.730  -8.878   2.511
  672    HB2  GLU  87           1HB      GLU  87  -4.476 -11.113   1.462
  673    HB3  GLU  87           2HB      GLU  87  -5.044  -9.521   1.944
  674    HG2  GLU  87           1HG      GLU  87  -3.680  -8.515   0.170
  675    HG3  GLU  87           2HG      GLU  87  -3.169 -10.129  -0.327
  676    H    ASP  88           H        ASP  88  -3.987 -12.124   3.035
  677    HA   ASP  88           HA       ASP  88  -4.129 -11.671   5.902
  678    HB2  ASP  88           1HB      ASP  88  -5.185 -13.922   5.946
  679    HB3  ASP  88           2HB      ASP  88  -6.018 -12.817   4.857
  680    H    LYS  89           H        LYS  89  -3.055 -13.116   7.376
  681    HA   LYS  89           HA       LYS  89  -0.346 -13.605   6.601
  682    HB2  LYS  89           1HB      LYS  89  -1.904 -14.019   9.131
  683    HB3  LYS  89           2HB      LYS  89  -0.271 -14.642   8.966
  684    HG2  LYS  89           1HG      LYS  89   0.533 -12.359   8.539
  685    HG3  LYS  89           2HG      LYS  89  -1.114 -11.761   8.783
  686    HD2  LYS  89           1HD      LYS  89  -1.137 -12.478  11.039
  687    HD3  LYS  89           2HD      LYS  89   0.342 -13.412  10.830
  688    HE2  LYS  89           1HE      LYS  89   1.580 -11.314  10.465
  689    HE3  LYS  89           2HE      LYS  89   0.089 -10.412  10.755
  690    HZ1  LYS  89           3HZ      LYS  89   1.355 -12.256  12.709
  691    HZ2  LYS  89           1HZ      LYS  89  -0.011 -11.288  12.975
  692    HZ3  LYS  89           2HZ      LYS  89   1.509 -10.565  12.739
  693    H    ALA  90           H        ALA  90   0.765 -15.655   6.998
  694    HA   ALA  90           HA       ALA  90  -0.758 -17.965   6.128
  695    HB1  ALA  90           3HB      ALA  90   1.516 -17.628   5.278
  696    HB2  ALA  90           1HB      ALA  90   1.391 -19.136   6.182
  697    HB3  ALA  90           2HB      ALA  90   2.148 -17.725   6.922
  698    H    GLU  91           H        GLU  91  -0.074 -16.383   8.969
  699    HA   GLU  91           HA       GLU  91  -0.224 -18.648  10.752
  700    HB2  GLU  91           1HB      GLU  91  -0.766 -15.805  11.567
  701    HB3  GLU  91           2HB      GLU  91  -0.043 -17.102  12.508
  702    HG2  GLU  91           1HG      GLU  91   1.954 -16.968  11.038
  703    HG3  GLU  91           2HG      GLU  91   1.230 -15.560  10.263
  704    H    ALA  92           H        ALA  92  -2.136 -19.722  10.487
  705    HA   ALA  92           HA       ALA  92  -4.591 -18.094  10.559
  706    HB1  ALA  92           3HB      ALA  92  -4.257 -19.198   8.399
  707    HB2  ALA  92           1HB      ALA  92  -5.683 -19.819   9.232
  708    HB3  ALA  92           2HB      ALA  92  -4.192 -20.763   9.212
  709    HA   PRO  93           HA       PRO  93  -5.123 -20.506  14.378
  710    HB2  PRO  93           1HB      PRO  93  -7.079 -18.400  14.946
  711    HB3  PRO  93           2HB      PRO  93  -5.653 -18.876  15.872
  712    HG2  PRO  93           1HG      PRO  93  -5.776 -16.536  14.543
  713    HG3  PRO  93           2HG      PRO  93  -4.263 -17.446  14.720
  714    HD2  PRO  93           1HD      PRO  93  -6.121 -17.304  12.366
  715    HD3  PRO  93           2HD      PRO  93  -4.345 -17.248  12.400
  716    H    ASN  94           H        ASN  94  -7.146 -19.443  11.853
  717    HA   ASN  94           HA       ASN  94  -9.560 -20.733  12.732
  718    HB2  ASN  94           1HB      ASN  94  -8.834 -19.736   9.965
  719    HB3  ASN  94           2HB      ASN  94 -10.447 -20.142  10.542
  720   HD21  ASN  94          2HD2      ASN  94  -9.323 -17.638   9.467
  721   HD22  ASN  94          1HD2      ASN  94  -9.627 -16.434  10.683
  722    H    THR  95           H        THR  95  -8.608 -22.804  13.166
  723    HA   THR  95           HA       THR  95  -7.889 -24.356  10.787
  724    HB   THR  95           HB       THR  95  -7.235 -26.053  12.693
  725    HG1  THR  95           HG1      THR  95  -6.932 -23.562  14.048
  726   HG21  THR  95          3HG2      THR  95  -5.661 -25.038  11.118
  727   HG22  THR  95          1HG2      THR  95  -4.983 -25.077  12.745
  728   HG23  THR  95          2HG2      THR  95  -5.624 -23.569  12.093
  729    H    ILE  96           H        ILE  96  -9.127 -25.977  10.079
  730    HA   ILE  96           HA       ILE  96 -11.698 -26.401  11.376
  731    HB   ILE  96           HB       ILE  96 -10.622 -27.613   8.819
  732   HG12  ILE  96          1HG1      ILE  96 -12.476 -25.251   9.201
  733   HG13  ILE  96          2HG1      ILE  96 -10.786 -25.143   8.719
  734   HG21  ILE  96          1HG2      ILE  96 -12.978 -28.110   8.340
  735   HG22  ILE  96          2HG2      ILE  96 -13.423 -27.481   9.925
  736   HG23  ILE  96          3HG2      ILE  96 -12.416 -28.923   9.801
  737   HD11  ILE  96          3HD1      ILE  96 -12.985 -26.474   7.157
  738   HD12  ILE  96          1HD1      ILE  96 -11.293 -26.367   6.673
  739   HD13  ILE  96          2HD1      ILE  96 -12.264 -24.903   6.815
  740    H    ALA  97           H        ALA  97 -11.978 -27.964  12.825
  741    HA   ALA  97           HA       ALA  97  -9.990 -30.068  13.065
  742    HB1  ALA  97           3HB      ALA  97 -10.752 -28.924  15.089
  743    HB2  ALA  97           1HB      ALA  97 -11.124 -30.647  15.144
  744    HB3  ALA  97           2HB      ALA  97 -12.397 -29.480  14.785
  745    H    SER  98           H        SER  98 -10.406 -31.279  11.210
  746    HA   SER  98           HA       SER  98 -12.983 -32.305  10.583
  747    HB2  SER  98           1HB      SER  98 -10.320 -33.446   9.715
  748    HB3  SER  98           2HB      SER  98 -11.873 -33.581   8.887
  749    HG   SER  98           HG       SER  98 -11.620 -31.649   8.060
  750    H    GLY  99           H        GLY  99 -13.926 -33.461  12.180
  751    HA2  GLY  99           1HA      GLY  99 -12.901 -36.088  12.707
  752    HA3  GLY  99           2HA      GLY  99 -12.829 -35.029  14.107
  753    H    SER 100           H        SER 100 -14.532 -37.417  12.931
  754    HA   SER 100           HA       SER 100 -16.767 -36.953  14.572
  755    HB2  SER 100           1HB      SER 100 -18.478 -37.062  12.634
  756    HB3  SER 100           2HB      SER 100 -17.718 -35.510  12.979
  757    HG   SER 100           HG       SER 100 -16.252 -36.957  11.207
  Start of MODEL   17
    1    H1   MET   1           1H       MET   1  -6.023  24.884   7.676
    2    H2   MET   1           2H       MET   1  -6.517  23.457   6.911
    3    H3   MET   1           3H       MET   1  -5.844  23.391   8.464
    4    HA   MET   1           HA       MET   1  -8.236  23.122   8.556
    5    HB2  MET   1           1HB      MET   1  -7.307  25.807   9.608
    6    HB3  MET   1           2HB      MET   1  -8.710  24.914  10.178
    7    HG2  MET   1           1HG      MET   1  -7.287  23.140  11.001
    8    HG3  MET   1           2HG      MET   1  -5.864  23.954  10.353
    9    HE1  MET   1           3HE      MET   1  -5.067  26.375  11.191
   10    HE2  MET   1           1HE      MET   1  -5.783  27.221  12.563
   11    HE3  MET   1           2HE      MET   1  -6.695  27.041  11.063
   12    H    GLU   2           H        GLU   2  -7.419  24.569   5.962
   13    HA   GLU   2           HA       GLU   2  -9.989  25.902   5.546
   14    HB2  GLU   2           1HB      GLU   2  -7.328  27.025   4.624
   15    HB3  GLU   2           2HB      GLU   2  -8.909  27.717   4.298
   16    HG2  GLU   2           1HG      GLU   2  -8.430  29.024   6.047
   17    HG3  GLU   2           2HG      GLU   2  -8.950  27.635   7.000
   18    H    VAL   3           H        VAL   3  -9.654  26.584   2.885
   19    HA   VAL   3           HA       VAL   3  -9.746  24.076   1.552
   20    HB   VAL   3           HB       VAL   3  -9.454  26.844   0.360
   21   HG11  VAL   3          1HG1      VAL   3 -10.319  24.249  -0.915
   22   HG12  VAL   3          2HG1      VAL   3  -8.820  25.121  -1.235
   23   HG13  VAL   3          3HG1      VAL   3 -10.369  25.836  -1.684
   24   HG21  VAL   3          3HG2      VAL   3 -11.450  26.645   1.735
   25   HG22  VAL   3          1HG2      VAL   3 -11.913  25.177   0.877
   26   HG23  VAL   3          2HG2      VAL   3 -11.880  26.721   0.026
   27    H    GLN   4           H        GLN   4  -7.275  26.492   2.052
   28    HA   GLN   4           HA       GLN   4  -5.287  25.647   0.318
   29    HB2  GLN   4           1HB      GLN   4  -5.190  27.670   1.739
   30    HB3  GLN   4           2HB      GLN   4  -4.956  26.654   3.153
   31    HG2  GLN   4           1HG      GLN   4  -2.836  25.869   2.259
   32    HG3  GLN   4           2HG      GLN   4  -3.080  26.839   0.805
   33   HE21  GLN   4          2HE2      GLN   4  -1.218  28.030   1.142
   34   HE22  GLN   4          1HE2      GLN   4  -1.109  29.234   2.382
   35    H    SER   5           H        SER   5  -5.323  24.807   3.788
   36    HA   SER   5           HA       SER   5  -4.233  22.163   3.075
   37    HB2  SER   5           1HB      SER   5  -4.050  23.552   5.761
   38    HB3  SER   5           2HB      SER   5  -3.169  22.115   5.235
   39    HG   SER   5           HG       SER   5  -2.336  23.612   3.509
   40    H    MET   6           H        MET   6  -5.772  20.656   3.115
   41    HA   MET   6           HA       MET   6  -8.197  21.159   4.675
   42    HB2  MET   6           1HB      MET   6  -7.631  19.128   2.508
   43    HB3  MET   6           2HB      MET   6  -9.185  19.361   3.297
   44    HG2  MET   6           1HG      MET   6  -9.328  21.611   2.405
   45    HG3  MET   6           2HG      MET   6  -7.739  21.435   1.663
   46    HE1  MET   6           3HE      MET   6  -7.219  19.768  -0.347
   47    HE2  MET   6           1HE      MET   6  -8.414  18.664  -1.030
   48    HE3  MET   6           2HE      MET   6  -7.838  18.430   0.621
   49    H    LEU   7           H        LEU   7  -9.263  19.197   5.646
   50    HA   LEU   7           HA       LEU   7  -7.331  17.870   7.346
   51    HB2  LEU   7           1HB      LEU   7 -10.347  17.777   7.329
   52    HB3  LEU   7           2HB      LEU   7  -9.325  17.030   8.542
   53    HG   LEU   7           HG       LEU   7  -9.551  19.995   8.010
   54   HD11  LEU   7          1HD1      LEU   7 -10.622  20.073  10.204
   55   HD12  LEU   7          2HD1      LEU   7 -10.535  18.315  10.312
   56   HD13  LEU   7          3HD1      LEU   7 -11.537  19.075   9.075
   57   HD21  LEU   7          3HD2      LEU   7  -8.184  20.236  10.035
   58   HD22  LEU   7          1HD2      LEU   7  -7.312  19.408   8.744
   59   HD23  LEU   7          2HD2      LEU   7  -7.976  18.486  10.093
   60    H    LEU   8           H        LEU   8  -6.920  15.710   7.407
   61    HA   LEU   8           HA       LEU   8  -7.757  14.192   5.059
   62    HB2  LEU   8           1HB      LEU   8  -5.667  13.586   7.157
   63    HB3  LEU   8           2HB      LEU   8  -5.975  12.622   5.725
   64    HG   LEU   8           HG       LEU   8  -5.010  15.484   5.703
   65   HD11  LEU   8          1HD1      LEU   8  -3.318  13.973   6.586
   66   HD12  LEU   8          2HD1      LEU   8  -2.874  14.554   4.983
   67   HD13  LEU   8          3HD1      LEU   8  -3.511  12.922   5.183
   68   HD21  LEU   8          3HD2      LEU   8  -6.321  14.917   3.732
   69   HD22  LEU   8          1HD2      LEU   8  -5.337  13.475   3.475
   70   HD23  LEU   8          2HD2      LEU   8  -4.613  15.076   3.319
   71    H    ASN   9           H        ASN   9  -9.178  12.565   5.156
   72    HA   ASN   9           HA       ASN   9 -10.487  12.082   7.689
   73    HB2  ASN   9           1HB      ASN   9 -11.119  10.985   4.939
   74    HB3  ASN   9           2HB      ASN   9 -12.123  10.797   6.373
   75   HD21  ASN   9          2HD2      ASN   9 -11.164  12.865   3.810
   76   HD22  ASN   9          1HD2      ASN   9 -12.240  14.171   4.168
   77    H    ASP  10           H        ASP  10 -10.058  10.465   8.986
   78    HA   ASP  10           HA       ASP  10  -8.247   8.374   8.193
   79    HB2  ASP  10           1HB      ASP  10  -8.655   7.572  10.573
   80    HB3  ASP  10           2HB      ASP  10  -7.940   9.170  10.407
   81    H    VAL  11           H        VAL  11  -8.953   6.738   7.033
   82    HA   VAL  11           HA       VAL  11 -11.721   5.833   7.367
   83    HB   VAL  11           HB       VAL  11  -9.818   5.263   5.084
   84   HG11  VAL  11          1HG1      VAL  11 -11.818   4.460   3.915
   85   HG12  VAL  11          2HG1      VAL  11 -12.775   4.731   5.372
   86   HG13  VAL  11          3HG1      VAL  11 -11.491   3.520   5.372
   87   HG21  VAL  11          3HG2      VAL  11 -11.186   6.835   3.794
   88   HG22  VAL  11          1HG2      VAL  11 -10.400   7.623   5.162
   89   HG23  VAL  11          2HG2      VAL  11 -12.114   7.214   5.246
   90    H    LYS  12           H        LYS  12 -11.978   4.114   8.596
   91    HA   LYS  12           HA       LYS  12  -9.869   2.386   9.371
   92    HB2  LYS  12           1HB      LYS  12 -12.847   1.879   9.552
   93    HB3  LYS  12           2HB      LYS  12 -11.588   1.092  10.494
   94    HG2  LYS  12           1HG      LYS  12 -11.056   3.210  11.568
   95    HG3  LYS  12           2HG      LYS  12 -12.303   4.011  10.612
   96    HD2  LYS  12           1HD      LYS  12 -13.987   2.505  11.632
   97    HD3  LYS  12           2HD      LYS  12 -12.715   1.827  12.650
   98    HE2  LYS  12           1HE      LYS  12 -13.685   4.683  12.618
   99    HE3  LYS  12           2HE      LYS  12 -13.931   3.494  13.896
  100    HZ1  LYS  12           3HZ      LYS  12 -12.155   4.971  14.496
  101    HZ2  LYS  12           1HZ      LYS  12 -11.331   4.658  13.046
  102    HZ3  LYS  12           2HZ      LYS  12 -11.506   3.428  14.202
  103    H    TRP  13           H        TRP  13  -9.128   0.559   8.431
  104    HA   TRP  13           HA       TRP  13 -10.300  -0.113   5.853
  105    HB2  TRP  13           1HB      TRP  13  -7.715   0.160   6.565
  106    HB3  TRP  13           2HB      TRP  13  -7.907  -1.574   6.816
  107    HD1  TRP  13           HD1      TRP  13 -10.152  -1.462   4.222
  108    HE1  TRP  13           HE1      TRP  13  -9.107  -1.653   1.878
  109    HE3  TRP  13           HE3      TRP  13  -5.324  -0.268   5.389
  110    HZ2  TRP  13           HZ2      TRP  13  -6.573  -1.340   0.684
  111    HZ3  TRP  13           HZ3      TRP  13  -3.651  -0.239   3.587
  112    HH2  TRP  13           HH2      TRP  13  -4.265  -0.764   1.284
  113    H    GLU  14           H        GLU  14 -11.971  -1.419   6.007
  114    HA   GLU  14           HA       GLU  14 -12.424  -3.289   8.073
  115    HB2  GLU  14           1HB      GLU  14 -14.226  -2.276   6.727
  116    HB3  GLU  14           2HB      GLU  14 -13.653  -3.145   5.311
  117    HG2  GLU  14           1HG      GLU  14 -14.134  -5.271   6.454
  118    HG3  GLU  14           2HG      GLU  14 -14.779  -4.363   7.820
  119    H    LYS  15           H        LYS  15 -11.547  -3.736   4.667
  120    HA   LYS  15           HA       LYS  15 -10.336  -6.316   5.391
  121    HB2  LYS  15           1HB      LYS  15 -11.292  -5.374   2.674
  122    HB3  LYS  15           2HB      LYS  15 -10.579  -6.943   3.024
  123    HG2  LYS  15           1HG      LYS  15 -12.453  -7.539   4.414
  124    HG3  LYS  15           2HG      LYS  15 -13.147  -5.929   4.225
  125    HD2  LYS  15           1HD      LYS  15 -13.342  -6.341   1.795
  126    HD3  LYS  15           2HD      LYS  15 -12.736  -7.978   2.050
  127    HE2  LYS  15           1HE      LYS  15 -14.635  -8.501   3.452
  128    HE3  LYS  15           2HE      LYS  15 -15.218  -6.843   3.331
  129    HZ1  LYS  15           3HZ      LYS  15 -15.485  -7.182   0.928
  130    HZ2  LYS  15           1HZ      LYS  15 -16.435  -8.260   1.836
  131    HZ3  LYS  15           2HZ      LYS  15 -15.003  -8.797   1.101
  132    HA   PRO  16           HA       PRO  16  -7.033  -3.299   4.557
  133    HB2  PRO  16           1HB      PRO  16  -5.427  -3.928   6.586
  134    HB3  PRO  16           2HB      PRO  16  -6.940  -3.052   6.857
  135    HG2  PRO  16           1HG      PRO  16  -6.322  -5.945   7.278
  136    HG3  PRO  16           2HG      PRO  16  -7.281  -4.844   8.282
  137    HD2  PRO  16           1HD      PRO  16  -8.326  -6.650   6.456
  138    HD3  PRO  16           2HD      PRO  16  -9.174  -5.219   7.074
  139    H    VAL  17           H        VAL  17  -4.493  -3.660   4.720
  140    HA   VAL  17           HA       VAL  17  -3.923  -6.137   3.247
  141    HB   VAL  17           HB       VAL  17  -2.500  -3.473   3.049
  142   HG11  VAL  17          1HG1      VAL  17  -1.246  -4.511   1.209
  143   HG12  VAL  17          2HG1      VAL  17  -2.032  -6.053   1.551
  144   HG13  VAL  17          3HG1      VAL  17  -0.955  -5.328   2.745
  145   HG21  VAL  17          3HG2      VAL  17  -3.397  -3.394   0.778
  146   HG22  VAL  17          1HG2      VAL  17  -4.690  -3.454   1.974
  147   HG23  VAL  17          2HG2      VAL  17  -4.262  -4.902   1.065
  148    H    THR  18           H        THR  18  -2.827  -7.542   4.402
  149    HA   THR  18           HA       THR  18  -0.955  -6.701   6.456
  150    HB   THR  18           HB       THR  18  -1.521  -9.495   5.431
  151    HG1  THR  18           HG1      THR  18  -3.093  -9.608   7.034
  152   HG21  THR  18          3HG2      THR  18  -0.680 -10.174   7.648
  153   HG22  THR  18          1HG2      THR  18  -0.328  -8.487   8.021
  154   HG23  THR  18          2HG2      THR  18   0.544  -9.303   6.724
  155    H    ILE  19           H        ILE  19   0.754  -5.727   5.506
  156    HA   ILE  19           HA       ILE  19   1.722  -6.751   2.963
  157    HB   ILE  19           HB       ILE  19   1.386  -4.367   3.048
  158   HG12  ILE  19          1HG1      ILE  19   4.351  -4.946   3.128
  159   HG13  ILE  19          2HG1      ILE  19   3.307  -5.223   1.737
  160   HG21  ILE  19          1HG2      ILE  19   2.651  -2.897   4.544
  161   HG22  ILE  19          2HG2      ILE  19   3.322  -4.313   5.355
  162   HG23  ILE  19          3HG2      ILE  19   1.590  -3.992   5.435
  163   HD11  ILE  19          3HD1      ILE  19   3.909  -2.566   3.012
  164   HD12  ILE  19          1HD1      ILE  19   2.832  -2.825   1.640
  165   HD13  ILE  19          2HD1      ILE  19   4.555  -3.169   1.484
  166    H    SER  20           H        SER  20   3.148  -8.285   3.007
  167    HA   SER  20           HA       SER  20   4.856  -8.667   5.295
  168    HB2  SER  20           1HB      SER  20   4.757 -10.211   2.686
  169    HB3  SER  20           2HB      SER  20   5.539 -10.728   4.183
  170    HG   SER  20           HG       SER  20   2.881 -10.056   4.458
  171    H    LEU  21           H        LEU  21   6.404  -7.126   5.379
  172    HA   LEU  21           HA       LEU  21   7.740  -6.004   3.176
  173    HB2  LEU  21           1HB      LEU  21   8.424  -6.207   6.096
  174    HB3  LEU  21           2HB      LEU  21   9.543  -5.486   4.959
  175    HG   LEU  21           HG       LEU  21   7.759  -3.828   4.361
  176   HD11  LEU  21          1HD1      LEU  21   5.899  -3.526   5.912
  177   HD12  LEU  21          2HD1      LEU  21   6.366  -4.998   6.763
  178   HD13  LEU  21          3HD1      LEU  21   5.808  -5.085   5.092
  179   HD21  LEU  21          3HD2      LEU  21   8.673  -3.934   7.231
  180   HD22  LEU  21          1HD2      LEU  21   8.057  -2.501   6.408
  181   HD23  LEU  21          2HD2      LEU  21   9.559  -3.249   5.869
  182    H    GLN  22           H        GLN  22   9.942  -6.297   2.516
  183    HA   GLN  22           HA       GLN  22  10.614  -8.947   1.923
  184    HB2  GLN  22           1HB      GLN  22  12.330  -6.457   1.875
  185    HB3  GLN  22           2HB      GLN  22  12.772  -7.990   1.134
  186    HG2  GLN  22           1HG      GLN  22  10.972  -7.839  -0.427
  187    HG3  GLN  22           2HG      GLN  22  10.303  -6.435   0.404
  188   HE21  GLN  22          2HE2      GLN  22  11.177  -6.765  -2.381
  189   HE22  GLN  22          1HE2      GLN  22  12.371  -5.544  -2.644
  190    H    ASN  23           H        ASN  23  11.111  -7.152   4.741
  191    HA   ASN  23           HA       ASN  23  13.432  -8.563   5.707
  192    HB2  ASN  23           1HB      ASN  23  11.473  -6.714   7.087
  193    HB3  ASN  23           2HB      ASN  23  12.934  -7.355   7.831
  194   HD21  ASN  23          2HD2      ASN  23  14.877  -6.457   7.361
  195   HD22  ASN  23          1HD2      ASN  23  15.067  -5.049   6.363
  196    H    GLY  24           H        GLY  24  10.420  -9.606   5.167
  197    HA2  GLY  24           1HA      GLY  24   9.380 -11.553   5.846
  198    HA3  GLY  24           2HA      GLY  24  10.666 -11.786   7.021
  199    H    ALA  25           H        ALA  25   8.562  -8.976   6.711
  200    HA   ALA  25           HA       ALA  25   7.324  -9.674   9.281
  201    HB1  ALA  25           3HB      ALA  25   8.485  -6.976   8.600
  202    HB2  ALA  25           1HB      ALA  25   9.177  -8.141   9.729
  203    HB3  ALA  25           2HB      ALA  25   7.620  -7.390  10.080
  204    HA   PRO  26           HA       PRO  26   3.817  -8.326   6.753
  205    HB2  PRO  26           1HB      PRO  26   2.169  -9.814   8.588
  206    HB3  PRO  26           2HB      PRO  26   2.551 -10.190   6.908
  207    HG2  PRO  26           1HG      PRO  26   3.412 -11.676   9.044
  208    HG3  PRO  26           2HG      PRO  26   4.244 -11.610   7.480
  209    HD2  PRO  26           1HD      PRO  26   4.872 -10.159  10.025
  210    HD3  PRO  26           2HD      PRO  26   5.976 -10.911   8.853
  211    H    ARG  27           H        ARG  27   3.373  -6.246   7.194
  212    HA   ARG  27           HA       ARG  27   2.496  -5.520   9.892
  213    HB2  ARG  27           1HB      ARG  27   3.246  -3.833   7.505
  214    HB3  ARG  27           2HB      ARG  27   2.561  -3.166   8.979
  215    HG2  ARG  27           1HG      ARG  27   4.479  -4.145  10.231
  216    HG3  ARG  27           2HG      ARG  27   5.185  -4.604   8.680
  217    HD2  ARG  27           1HD      ARG  27   5.220  -2.268   7.991
  218    HD3  ARG  27           2HD      ARG  27   4.474  -1.794   9.516
  219    HE   ARG  27           HE       ARG  27   6.955  -3.256   9.787
  220   HH11  ARG  27          1HH1      ARG  27   5.450  -0.098   9.522
  221   HH12  ARG  27          2HH1      ARG  27   6.794   0.746  10.230
  222   HH21  ARG  27          1HH2      ARG  27   8.721  -2.153  10.708
  223   HH22  ARG  27          2HH2      ARG  27   8.667  -0.424  10.889
  224    H    ILE  28           H        ILE  28   0.425  -5.481  10.349
  225    HA   ILE  28           HA       ILE  28  -1.548  -5.503   8.211
  226    HB   ILE  28           HB       ILE  28  -1.950  -5.681  11.206
  227   HG12  ILE  28          1HG1      ILE  28  -1.892  -7.855   9.101
  228   HG13  ILE  28          2HG1      ILE  28  -0.647  -7.566  10.310
  229   HG21  ILE  28          1HG2      ILE  28  -3.857  -6.265   8.943
  230   HG22  ILE  28          2HG2      ILE  28  -3.925  -4.870  10.020
  231   HG23  ILE  28          3HG2      ILE  28  -4.182  -6.492  10.661
  232   HD11  ILE  28          3HD1      ILE  28  -2.053  -9.434  10.938
  233   HD12  ILE  28          1HD1      ILE  28  -3.484  -8.408  10.858
  234   HD13  ILE  28          2HD1      ILE  28  -2.248  -8.101  12.078
  235    H    PHE  29           H        PHE  29  -2.357  -3.668   7.453
  236    HA   PHE  29           HA       PHE  29  -2.082  -1.194   8.891
  237    HB2  PHE  29           1HB      PHE  29  -3.525  -1.840   6.311
  238    HB3  PHE  29           2HB      PHE  29  -3.328  -0.217   6.964
  239    HD1  PHE  29           HD1      PHE  29  -0.668   0.094   7.744
  240    HD2  PHE  29           HD2      PHE  29  -2.175  -2.231   4.512
  241    HE1  PHE  29           HE1      PHE  29   1.494   0.306   6.588
  242    HE2  PHE  29           HE2      PHE  29  -0.015  -2.027   3.355
  243    HZ   PHE  29           HZ       PHE  29   1.823  -0.759   4.392
  244    H    ASN  30           H        ASN  30  -3.497  -0.256  10.203
  245    HA   ASN  30           HA       ASN  30  -5.981  -1.648  10.795
  246    HB2  ASN  30           1HB      ASN  30  -4.721   0.796  12.067
  247    HB3  ASN  30           2HB      ASN  30  -6.152  -0.038  12.668
  248   HD21  ASN  30          2HD2      ASN  30  -2.707  -0.204  12.219
  249   HD22  ASN  30          1HD2      ASN  30  -2.433  -1.530  13.301
  250    H    GLY  31           H        GLY  31  -4.868   1.178   9.174
  251    HA2  GLY  31           1HA      GLY  31  -7.585   1.721   8.264
  252    HA3  GLY  31           2HA      GLY  31  -6.715   3.038   9.045
  253    H    VAL  32           H        VAL  32  -7.580   3.293   6.447
  254    HA   VAL  32           HA       VAL  32  -5.659   2.447   4.539
  255    HB   VAL  32           HB       VAL  32  -7.576   4.766   4.274
  256   HG11  VAL  32          1HG1      VAL  32  -5.905   4.743   2.537
  257   HG12  VAL  32          2HG1      VAL  32  -7.446   4.212   1.866
  258   HG13  VAL  32          3HG1      VAL  32  -6.193   3.030   2.234
  259   HG21  VAL  32          3HG2      VAL  32  -8.779   2.752   4.948
  260   HG22  VAL  32          1HG2      VAL  32  -8.018   1.848   3.639
  261   HG23  VAL  32          2HG2      VAL  32  -9.135   3.164   3.270
  262    H    TYR  33           H        TYR  33  -5.912   5.251   6.614
  263    HA   TYR  33           HA       TYR  33  -4.058   6.881   5.222
  264    HB2  TYR  33           1HB      TYR  33  -5.610   7.798   6.918
  265    HB3  TYR  33           2HB      TYR  33  -4.732   6.929   8.175
  266    HD1  TYR  33           HD1      TYR  33  -4.646   9.751   5.851
  267    HD2  TYR  33           HD2      TYR  33  -2.519   7.672   8.892
  268    HE1  TYR  33           HE1      TYR  33  -3.089  11.639   6.043
  269    HE2  TYR  33           HE2      TYR  33  -0.956   9.561   9.097
  270    HH   TYR  33           HH       TYR  33  -0.153  11.460   7.502
  271    H    GLU  34           H        GLU  34  -3.756   4.444   7.724
  272    HA   GLU  34           HA       GLU  34  -1.064   4.859   8.394
  273    HB2  GLU  34           1HB      GLU  34  -2.598   3.479   9.722
  274    HB3  GLU  34           2HB      GLU  34  -2.677   2.303   8.419
  275    HG2  GLU  34           1HG      GLU  34  -0.412   1.677   8.732
  276    HG3  GLU  34           2HG      GLU  34  -0.130   3.022   9.837
  277    H    ALA  35           H        ALA  35  -2.594   2.992   5.837
  278    HA   ALA  35           HA       ALA  35  -0.238   1.786   4.832
  279    HB1  ALA  35           3HB      ALA  35  -1.548   1.318   2.841
  280    HB2  ALA  35           1HB      ALA  35  -2.786   2.461   3.365
  281    HB3  ALA  35           2HB      ALA  35  -2.496   0.988   4.293
  282    H    PHE  36           H        PHE  36  -2.055   4.663   3.842
  283    HA   PHE  36           HA       PHE  36  -0.430   5.541   1.766
  284    HB2  PHE  36           1HB      PHE  36  -2.633   6.488   2.236
  285    HB3  PHE  36           2HB      PHE  36  -2.044   7.159   3.751
  286    HD1  PHE  36           HD2      PHE  36  -1.566   7.332   0.071
  287    HD2  PHE  36           HD1      PHE  36  -1.144   9.302   3.820
  288    HE1  PHE  36           HE2      PHE  36  -0.956   9.411  -1.095
  289    HE2  PHE  36           HE1      PHE  36  -0.534  11.386   2.662
  290    HZ   PHE  36           HZ       PHE  36  -0.439  11.439   0.202
  291    H    ASP  37           H        ASP  37  -0.246   6.265   5.225
  292    HA   ASP  37           HA       ASP  37   1.943   8.039   5.075
  293    HB2  ASP  37           1HB      ASP  37   0.515   8.036   7.020
  294    HB3  ASP  37           2HB      ASP  37   0.896   6.350   7.354
  295    H    PHE  38           H        PHE  38   1.762   4.542   5.694
  296    HA   PHE  38           HA       PHE  38   4.474   4.118   6.246
  297    HB2  PHE  38           1HB      PHE  38   2.769   2.418   6.683
  298    HB3  PHE  38           2HB      PHE  38   2.488   2.232   4.955
  299    HD1  PHE  38           HD1      PHE  38   5.354   2.138   7.346
  300    HD2  PHE  38           HD2      PHE  38   3.467   0.410   3.942
  301    HE1  PHE  38           HE1      PHE  38   7.095   0.404   7.261
  302    HE2  PHE  38           HE2      PHE  38   5.207  -1.322   3.855
  303    HZ   PHE  38           HZ       PHE  38   7.022  -1.326   5.515
  304    H    LEU  39           H        LEU  39   2.745   4.296   3.192
  305    HA   LEU  39           HA       LEU  39   4.818   3.370   1.518
  306    HB2  LEU  39           1HB      LEU  39   2.580   5.302   0.914
  307    HB3  LEU  39           2HB      LEU  39   3.576   4.505  -0.289
  308    HG   LEU  39           HG       LEU  39   1.710   3.120   1.635
  309   HD11  LEU  39          1HD1      LEU  39   0.371   2.649  -0.349
  310   HD12  LEU  39          2HD1      LEU  39   1.482   3.603  -1.330
  311   HD13  LEU  39          3HD1      LEU  39   0.522   4.384  -0.074
  312   HD21  LEU  39          3HD2      LEU  39   3.687   1.785   1.065
  313   HD22  LEU  39          1HD2      LEU  39   3.336   2.012  -0.649
  314   HD23  LEU  39          2HD2      LEU  39   2.214   1.113   0.370
  315    H    GLN  40           H        GLN  40   4.155   6.476   2.950
  316    HA   GLN  40           HA       GLN  40   6.146   7.842   1.357
  317    HB2  GLN  40           1HB      GLN  40   4.547   8.732   3.766
  318    HB3  GLN  40           2HB      GLN  40   5.644   9.767   2.864
  319    HG2  GLN  40           1HG      GLN  40   4.275   9.527   0.877
  320    HG3  GLN  40           2HG      GLN  40   3.193   8.433   1.738
  321   HE21  GLN  40          2HE2      GLN  40   2.735  11.061   0.445
  322   HE22  GLN  40          1HE2      GLN  40   2.015  12.044   1.675
  323    H    HIS  41           H        HIS  41   6.001   6.079   4.290
  324    HA   HIS  41           HA       HIS  41   8.357   7.241   5.460
  325    HB2  HIS  41           1HB      HIS  41   6.647   4.867   6.150
  326    HB3  HIS  41           2HB      HIS  41   8.176   5.151   6.969
  327    HD1  HIS  41           HD1      HIS  41   7.108   5.626   9.230
  328    HD2  HIS  41           HD2      HIS  41   5.771   8.139   6.204
  329    HE1  HIS  41           HE1      HIS  41   5.807   7.443  10.382
  330    HE2  HIS  41           HE2      HIS  41   4.757   8.745   8.497
  331    H    GLU  42           H        GLU  42   7.759   3.834   4.574
  332    HA   GLU  42           HA       GLU  42  10.319   3.747   3.199
  333    HB2  GLU  42           1HB      GLU  42   9.744   2.210   5.722
  334    HB3  GLU  42           2HB      GLU  42  10.930   1.655   4.549
  335    HG2  GLU  42           1HG      GLU  42  12.213   3.679   4.829
  336    HG3  GLU  42           2HG      GLU  42  10.994   4.331   5.922
  337    H    TRP  43           H        TRP  43   8.611   3.464   1.525
  338    HA   TRP  43           HA       TRP  43   7.614   0.750   1.311
  339    HB2  TRP  43           1HB      TRP  43   6.198   2.445   0.374
  340    HB3  TRP  43           2HB      TRP  43   7.529   3.136  -0.544
  341    HD1  TRP  43           HD1      TRP  43   7.751   2.377  -2.968
  342    HE1  TRP  43           HE1      TRP  43   6.693   0.549  -4.432
  343    HE3  TRP  43           HE3      TRP  43   5.198  -0.186   0.653
  344    HZ2  TRP  43           HZ2      TRP  43   5.007  -1.686  -4.101
  345    HZ3  TRP  43           HZ3      TRP  43   3.890  -2.158  -0.012
  346    HH2  TRP  43           HH2      TRP  43   3.796  -2.891  -2.338
  347    HA   PRO  44           HA       PRO  44  11.365  -1.209   0.083
  348    HB2  PRO  44           1HB      PRO  44   9.488  -2.384  -1.941
  349    HB3  PRO  44           2HB      PRO  44  10.729  -3.183  -0.967
  350    HG2  PRO  44           1HG      PRO  44   8.137  -3.257  -0.279
  351    HG3  PRO  44           2HG      PRO  44   9.427  -3.190   0.933
  352    HD2  PRO  44           1HD      PRO  44   7.469  -1.135   0.181
  353    HD3  PRO  44           2HD      PRO  44   8.467  -1.260   1.642
  354    H    ALA  45           H        ALA  45   9.371  -0.547  -2.828
  355    HA   ALA  45           HA       ALA  45  11.815   0.529  -4.075
  356    HB1  ALA  45           3HB      ALA  45   9.514  -0.868  -5.435
  357    HB2  ALA  45           1HB      ALA  45  11.096  -1.571  -5.098
  358    HB3  ALA  45           2HB      ALA  45  10.951  -0.225  -6.228
  359    H    ARG  46           H        ARG  46  11.514   2.678  -3.620
  360    HA   ARG  46           HA       ARG  46   8.980   3.917  -4.402
  361    HB2  ARG  46           1HB      ARG  46  11.307   4.898  -2.755
  362    HB3  ARG  46           2HB      ARG  46  10.006   5.960  -3.284
  363    HG2  ARG  46           1HG      ARG  46   8.388   4.652  -2.065
  364    HG3  ARG  46           2HG      ARG  46   9.633   3.485  -1.612
  365    HD2  ARG  46           1HD      ARG  46   9.686   6.402  -0.861
  366    HD3  ARG  46           2HD      ARG  46   9.049   5.126   0.175
  367    HE   ARG  46           HE       ARG  46  11.612   4.350  -0.522
  368   HH11  ARG  46          1HH1      ARG  46  10.135   7.059   1.136
  369   HH12  ARG  46          2HH1      ARG  46  11.477   7.297   2.208
  370   HH21  ARG  46          1HH2      ARG  46  13.386   4.670   0.903
  371   HH22  ARG  46          2HH2      ARG  46  13.317   5.959   2.073
  372    H    GLY  47           H        GLY  47   8.829   5.524  -5.933
  373    HA2  GLY  47           1HA      GLY  47  10.128   7.234  -7.209
  374    HA3  GLY  47           2HA      GLY  47  11.246   5.931  -7.576
  375    H    ASP  48           H        ASP  48   9.066   3.979  -7.951
  376    HA   ASP  48           HA       ASP  48   8.625   4.668 -10.739
  377    HB2  ASP  48           1HB      ASP  48   9.509   2.395  -9.744
  378    HB3  ASP  48           2HB      ASP  48   7.793   2.046  -9.557
  379    H    ARG  49           H        ARG  49   6.463   3.234 -11.423
  380    HA   ARG  49           HA       ARG  49   4.358   5.055 -10.841
  381    HB2  ARG  49           1HB      ARG  49   4.192   2.366 -12.214
  382    HB3  ARG  49           2HB      ARG  49   3.058   3.701 -12.366
  383    HG2  ARG  49           1HG      ARG  49   4.509   4.955 -13.670
  384    HG3  ARG  49           2HG      ARG  49   5.926   4.046 -13.137
  385    HD2  ARG  49           1HD      ARG  49   5.033   2.062 -14.330
  386    HD3  ARG  49           2HD      ARG  49   3.721   3.066 -14.945
  387    HE   ARG  49           HE       ARG  49   5.201   4.099 -16.393
  388   HH11  ARG  49          1HH1      ARG  49   6.933   1.997 -14.192
  389   HH12  ARG  49          2HH1      ARG  49   8.404   2.016 -15.115
  390   HH21  ARG  49          1HH2      ARG  49   7.152   4.141 -17.611
  391   HH22  ARG  49          2HH2      ARG  49   8.540   3.264 -17.032
  392    H    ALA  50           H        ALA  50   5.231   1.859  -9.710
  393    HA   ALA  50           HA       ALA  50   2.800   1.054  -8.598
  394    HB1  ALA  50           3HB      ALA  50   5.579   0.411  -7.611
  395    HB2  ALA  50           1HB      ALA  50   4.714  -0.446  -8.887
  396    HB3  ALA  50           2HB      ALA  50   4.106  -0.481  -7.233
  397    H    HIS  51           H        HIS  51   5.562   2.614  -6.964
  398    HA   HIS  51           HA       HIS  51   4.294   3.048  -4.509
  399    HB2  HIS  51           1HB      HIS  51   6.691   3.302  -4.721
  400    HB3  HIS  51           2HB      HIS  51   6.493   4.622  -5.865
  401    HD1  HIS  51           HD1      HIS  51   6.668   6.886  -4.896
  402    HD2  HIS  51           HD2      HIS  51   5.595   4.056  -2.039
  403    HE1  HIS  51           HE1      HIS  51   6.629   8.117  -2.700
  404    HE2  HIS  51           HE2      HIS  51   6.171   6.343  -0.969
  405    H    GLU  52           H        GLU  52   4.383   5.037  -7.434
  406    HA   GLU  52           HA       GLU  52   3.184   7.331  -6.331
  407    HB2  GLU  52           1HB      GLU  52   4.381   7.333  -8.470
  408    HB3  GLU  52           2HB      GLU  52   3.115   6.344  -9.184
  409    HG2  GLU  52           1HG      GLU  52   1.501   8.159  -8.742
  410    HG3  GLU  52           2HG      GLU  52   2.830   9.151  -8.141
  411    H    GLN  53           H        GLN  53   1.712   4.688  -8.238
  412    HA   GLN  53           HA       GLN  53  -0.898   5.791  -8.050
  413    HB2  GLN  53           1HB      GLN  53   0.019   3.014  -8.799
  414    HB3  GLN  53           2HB      GLN  53  -1.646   3.570  -8.921
  415    HG2  GLN  53           1HG      GLN  53  -0.837   5.388 -10.434
  416    HG3  GLN  53           2HG      GLN  53   0.742   4.606 -10.425
  417   HE21  GLN  53          2HE2      GLN  53  -1.089   5.105 -12.625
  418   HE22  GLN  53          1HE2      GLN  53  -1.426   3.556 -13.325
  419    H    ALA  54           H        ALA  54   0.903   3.494  -6.108
  420    HA   ALA  54           HA       ALA  54  -1.204   2.526  -4.529
  421    HB1  ALA  54           3HB      ALA  54   1.063   1.579  -4.494
  422    HB2  ALA  54           1HB      ALA  54   0.491   1.977  -2.873
  423    HB3  ALA  54           2HB      ALA  54   1.649   3.032  -3.685
  424    H    LEU  55           H        LEU  55   0.758   5.450  -4.285
  425    HA   LEU  55           HA       LEU  55  -0.337   6.430  -1.879
  426    HB2  LEU  55           1HB      LEU  55   0.842   7.897  -4.240
  427    HB3  LEU  55           2HB      LEU  55   0.412   8.665  -2.725
  428    HG   LEU  55           HG       LEU  55   2.489   6.495  -3.031
  429   HD11  LEU  55          1HD1      LEU  55   2.819   9.461  -2.590
  430   HD12  LEU  55          2HD1      LEU  55   3.150   8.606  -4.095
  431   HD13  LEU  55          3HD1      LEU  55   4.113   8.264  -2.659
  432   HD21  LEU  55          3HD2      LEU  55   3.076   7.074  -0.728
  433   HD22  LEU  55          1HD2      LEU  55   1.414   6.494  -0.841
  434   HD23  LEU  55          2HD2      LEU  55   1.737   8.219  -0.673
  435    H    ARG  56           H        ARG  56  -1.191   7.015  -5.275
  436    HA   ARG  56           HA       ARG  56  -3.288   8.807  -4.872
  437    HB2  ARG  56           1HB      ARG  56  -2.376   8.436  -7.076
  438    HB3  ARG  56           2HB      ARG  56  -2.886   6.754  -7.051
  439    HG2  ARG  56           1HG      ARG  56  -5.222   7.452  -7.051
  440    HG3  ARG  56           2HG      ARG  56  -4.720   9.144  -7.058
  441    HD2  ARG  56           1HD      ARG  56  -3.658   8.852  -9.213
  442    HD3  ARG  56           2HD      ARG  56  -4.037   7.130  -9.198
  443    HE   ARG  56           HE       ARG  56  -6.474   8.057  -9.056
  444   HH11  ARG  56          1HH1      ARG  56  -3.830   9.423 -10.910
  445   HH12  ARG  56          2HH1      ARG  56  -4.862  10.025 -12.169
  446   HH21  ARG  56          1HH2      ARG  56  -7.823   8.829 -10.729
  447   HH22  ARG  56          2HH2      ARG  56  -7.112   9.650 -12.090
  448    H    LEU  57           H        LEU  57  -3.354   5.269  -5.047
  449    HA   LEU  57           HA       LEU  57  -6.108   4.887  -4.881
  450    HB2  LEU  57           1HB      LEU  57  -3.883   3.167  -3.784
  451    HB3  LEU  57           2HB      LEU  57  -5.544   2.646  -3.992
  452    HG   LEU  57           HG       LEU  57  -3.840   3.597  -6.287
  453   HD11  LEU  57          1HD1      LEU  57  -2.780   1.658  -5.245
  454   HD12  LEU  57          2HD1      LEU  57  -3.453   1.259  -6.826
  455   HD13  LEU  57          3HD1      LEU  57  -4.299   0.767  -5.357
  456   HD21  LEU  57          3HD2      LEU  57  -6.380   1.975  -6.165
  457   HD22  LEU  57          1HD2      LEU  57  -5.501   2.409  -7.630
  458   HD23  LEU  57          2HD2      LEU  57  -6.252   3.666  -6.649
  459    H    CYS  58           H        CYS  58  -3.718   5.010  -2.247
  460    HA   CYS  58           HA       CYS  58  -5.635   4.721  -0.176
  461    HB2  CYS  58           1HB      CYS  58  -2.880   5.954  -0.004
  462    HB3  CYS  58           2HB      CYS  58  -3.819   5.285   1.327
  463    HG   CYS  58           HG       CYS  58  -2.169   3.637  -1.147
  464    H    ARG  59           H        ARG  59  -4.069   7.500  -1.678
  465    HA   ARG  59           HA       ARG  59  -4.993   9.521   0.022
  466    HB2  ARG  59           1HB      ARG  59  -3.217   9.753  -1.698
  467    HB3  ARG  59           2HB      ARG  59  -4.447   9.669  -2.948
  468    HG2  ARG  59           1HG      ARG  59  -5.460  11.732  -2.013
  469    HG3  ARG  59           2HG      ARG  59  -4.099  11.837  -0.891
  470    HD2  ARG  59           1HD      ARG  59  -2.551  11.887  -2.797
  471    HD3  ARG  59           2HD      ARG  59  -3.922  11.820  -3.902
  472    HE   ARG  59           HE       ARG  59  -3.253  14.090  -2.135
  473   HH11  ARG  59          1HH1      ARG  59  -4.998  12.756  -4.856
  474   HH12  ARG  59          2HH1      ARG  59  -5.340  14.305  -5.565
  475   HH21  ARG  59          1HH2      ARG  59  -3.710  16.125  -3.038
  476   HH22  ARG  59          2HH2      ARG  59  -4.635  16.237  -4.509
  477    H    ALA  60           H        ALA  60  -6.376   8.262  -3.005
  478    HA   ALA  60           HA       ALA  60  -8.656   9.923  -3.013
  479    HB1  ALA  60           3HB      ALA  60  -8.293   7.197  -4.250
  480    HB2  ALA  60           1HB      ALA  60  -7.877   8.737  -5.001
  481    HB3  ALA  60           2HB      ALA  60  -9.563   8.355  -4.649
  482    H    SER  61           H        SER  61  -7.994   6.777  -1.588
  483    HA   SER  61           HA       SER  61 -10.634   6.153  -0.827
  484    HB2  SER  61           1HB      SER  61  -8.686   4.557  -0.898
  485    HB3  SER  61           2HB      SER  61  -8.102   5.302   0.588
  486    HG   SER  61           HG       SER  61 -10.544   4.748   1.143
  487    H    LEU  62           H        LEU  62  -8.122   8.105   0.657
  488    HA   LEU  62           HA       LEU  62  -9.444   8.430   3.171
  489    HB2  LEU  62           1HB      LEU  62  -7.305  10.112   1.863
  490    HB3  LEU  62           2HB      LEU  62  -7.809  10.238   3.537
  491    HG   LEU  62           HG       LEU  62  -6.512   7.818   2.285
  492   HD11  LEU  62          1HD1      LEU  62  -5.412   9.892   4.175
  493   HD12  LEU  62          2HD1      LEU  62  -4.959   9.673   2.484
  494   HD13  LEU  62          3HD1      LEU  62  -4.583   8.420   3.667
  495   HD21  LEU  62          3HD2      LEU  62  -8.042   7.227   4.089
  496   HD22  LEU  62          1HD2      LEU  62  -7.257   8.398   5.150
  497   HD23  LEU  62          2HD2      LEU  62  -6.364   6.987   4.580
  498    H    MET  63           H        MET  63  -9.900   9.764   0.081
  499    HA   MET  63           HA       MET  63 -11.363  12.072   1.112
  500    HB2  MET  63           1HB      MET  63 -10.809  11.175  -1.724
  501    HB3  MET  63           2HB      MET  63 -11.693  12.631  -1.292
  502    HG2  MET  63           1HG      MET  63  -8.824  12.059  -0.590
  503    HG3  MET  63           2HG      MET  63  -9.374  13.097  -1.905
  504    HE1  MET  63           3HE      MET  63 -11.169  15.979   0.096
  505    HE2  MET  63           1HE      MET  63 -11.916  14.494  -0.496
  506    HE3  MET  63           2HE      MET  63 -10.757  15.361  -1.504
  507    H    GLY  64           H        GLY  64 -11.896   8.874   0.631
  508    HA2  GLY  64           1HA      GLY  64 -13.917   7.741   0.925
  509    HA3  GLY  64           2HA      GLY  64 -14.779   9.238   0.605
  510    H    ASP  65           H        ASP  65 -12.359   8.591  -1.682
  511    HA   ASP  65           HA       ASP  65 -14.349   8.167  -3.723
  512    HB2  ASP  65           1HB      ASP  65 -12.342   9.600  -4.076
  513    HB3  ASP  65           2HB      ASP  65 -11.335   8.160  -3.976
  514    H    VAL  66           H        VAL  66 -11.936   6.265  -2.061
  515    HA   VAL  66           HA       VAL  66 -12.711   3.905  -3.633
  516    HB   VAL  66           HB       VAL  66 -10.273   4.289  -1.879
  517   HG11  VAL  66          1HG1      VAL  66  -9.503   2.165  -2.858
  518   HG12  VAL  66          2HG1      VAL  66 -11.062   1.989  -3.665
  519   HG13  VAL  66          3HG1      VAL  66 -10.972   1.969  -1.904
  520   HG21  VAL  66          3HG2      VAL  66  -9.009   4.288  -3.979
  521   HG22  VAL  66          1HG2      VAL  66 -10.154   5.628  -3.912
  522   HG23  VAL  66          2HG2      VAL  66 -10.521   4.204  -4.885
  523    H    ALA  67           H        ALA  67 -13.767   2.277  -2.688
  524    HA   ALA  67           HA       ALA  67 -14.771   2.632  -0.015
  525    HB1  ALA  67           3HB      ALA  67 -16.196   1.841  -1.835
  526    HB2  ALA  67           1HB      ALA  67 -16.146   0.686  -0.502
  527    HB3  ALA  67           2HB      ALA  67 -15.216   0.380  -1.968
  528    H    GLY  68           H        GLY  68 -11.865   1.995  -0.336
  529    HA2  GLY  68           1HA      GLY  68 -10.387   0.973   1.116
  530    HA3  GLY  68           2HA      GLY  68 -11.750   0.173   1.877
  531    H    GLU  69           H        GLU  69 -12.803  -1.449   0.081
  532    HA   GLU  69           HA       GLU  69 -11.046  -3.622   0.036
  533    HB2  GLU  69           1HB      GLU  69 -13.544  -3.170  -1.603
  534    HB3  GLU  69           2HB      GLU  69 -12.729  -4.718  -1.415
  535    HG2  GLU  69           1HG      GLU  69 -13.138  -4.630   0.997
  536    HG3  GLU  69           2HG      GLU  69 -13.984  -3.097   0.792
  537    H    ILE  70           H        ILE  70 -11.975  -1.426  -2.585
  538    HA   ILE  70           HA       ILE  70 -10.549  -2.661  -4.656
  539    HB   ILE  70           HB       ILE  70 -11.206   0.268  -4.296
  540   HG12  ILE  70          1HG1      ILE  70 -12.654  -1.923  -5.803
  541   HG13  ILE  70          2HG1      ILE  70 -13.170  -1.228  -4.270
  542   HG21  ILE  70          1HG2      ILE  70 -10.922   0.462  -6.712
  543   HG22  ILE  70          2HG2      ILE  70 -10.432  -1.230  -6.797
  544   HG23  ILE  70          3HG2      ILE  70  -9.426  -0.062  -5.938
  545   HD11  ILE  70          3HD1      ILE  70 -12.939   0.247  -6.882
  546   HD12  ILE  70          1HD1      ILE  70 -13.477   0.932  -5.347
  547   HD13  ILE  70          2HD1      ILE  70 -14.432  -0.322  -6.136
  548    H    ALA  71           H        ALA  71  -9.559  -0.379  -2.180
  549    HA   ALA  71           HA       ALA  71  -7.065   0.335  -3.273
  550    HB1  ALA  71           3HB      ALA  71  -8.143   1.601  -1.468
  551    HB2  ALA  71           1HB      ALA  71  -6.498   1.127  -1.046
  552    HB3  ALA  71           2HB      ALA  71  -7.870   0.252  -0.365
  553    H    ARG  72           H        ARG  72  -8.061  -2.303  -1.128
  554    HA   ARG  72           HA       ARG  72  -5.500  -3.305  -0.555
  555    HB2  ARG  72           1HB      ARG  72  -7.319  -4.124   0.748
  556    HB3  ARG  72           2HB      ARG  72  -8.198  -4.656  -0.679
  557    HG2  ARG  72           1HG      ARG  72  -6.539  -6.387  -1.083
  558    HG3  ARG  72           2HG      ARG  72  -5.608  -5.839   0.308
  559    HD2  ARG  72           1HD      ARG  72  -7.349  -6.484   1.813
  560    HD3  ARG  72           2HD      ARG  72  -8.449  -6.822   0.477
  561    HE   ARG  72           HE       ARG  72  -6.678  -8.588  -0.130
  562   HH11  ARG  72          1HH1      ARG  72  -7.405  -7.624   3.159
  563   HH12  ARG  72          2HH1      ARG  72  -7.072  -9.190   3.823
  564   HH21  ARG  72          1HH2      ARG  72  -6.228 -10.636   0.733
  565   HH22  ARG  72          2HH2      ARG  72  -6.403 -10.911   2.437
  566    H    THR  73           H        THR  73  -7.810  -4.262  -3.092
  567    HA   THR  73           HA       THR  73  -6.265  -6.310  -4.194
  568    HB   THR  73           HB       THR  73  -8.178  -4.570  -5.753
  569    HG1  THR  73           HG1      THR  73  -9.814  -5.553  -4.758
  570   HG21  THR  73          3HG2      THR  73  -7.455  -7.497  -5.969
  571   HG22  THR  73          1HG2      THR  73  -6.917  -6.220  -7.060
  572   HG23  THR  73          2HG2      THR  73  -8.626  -6.645  -6.975
  573    H    ALA  74           H        ALA  74  -6.546  -2.905  -5.191
  574    HA   ALA  74           HA       ALA  74  -4.725  -3.142  -7.355
  575    HB1  ALA  74           3HB      ALA  74  -5.620  -0.666  -5.884
  576    HB2  ALA  74           1HB      ALA  74  -6.441  -1.404  -7.261
  577    HB3  ALA  74           2HB      ALA  74  -4.831  -0.712  -7.461
  578    H    PHE  75           H        PHE  75  -4.336  -2.512  -3.958
  579    HA   PHE  75           HA       PHE  75  -1.720  -1.421  -4.068
  580    HB2  PHE  75           1HB      PHE  75  -3.239  -1.234  -2.098
  581    HB3  PHE  75           2HB      PHE  75  -3.014  -2.953  -1.799
  582    HD1  PHE  75           HD2      PHE  75  -1.263   0.294  -1.957
  583    HD2  PHE  75           HD1      PHE  75  -1.152  -3.734  -0.594
  584    HE1  PHE  75           HE2      PHE  75   0.716   0.814  -0.596
  585    HE2  PHE  75           HE1      PHE  75   0.831  -3.224   0.772
  586    HZ   PHE  75           HZ       PHE  75   1.768  -0.947   0.770
  587    H    VAL  76           H        VAL  76  -2.974  -4.706  -3.607
  588    HA   VAL  76           HA       VAL  76  -0.500  -5.994  -3.251
  589    HB   VAL  76           HB       VAL  76  -3.028  -7.120  -4.485
  590   HG11  VAL  76          1HG1      VAL  76  -0.671  -8.548  -3.255
  591   HG12  VAL  76          2HG1      VAL  76  -1.065  -8.498  -4.972
  592   HG13  VAL  76          3HG1      VAL  76  -2.151  -9.305  -3.843
  593   HG21  VAL  76          3HG2      VAL  76  -3.497  -7.974  -2.242
  594   HG22  VAL  76          1HG2      VAL  76  -3.398  -6.213  -2.249
  595   HG23  VAL  76          2HG2      VAL  76  -2.051  -7.170  -1.631
  596    H    ALA  77           H        ALA  77  -2.328  -5.176  -6.151
  597    HA   ALA  77           HA       ALA  77  -0.691  -6.465  -8.035
  598    HB1  ALA  77           3HB      ALA  77  -1.683  -4.955  -9.677
  599    HB2  ALA  77           1HB      ALA  77  -2.319  -3.950  -8.376
  600    HB3  ALA  77           2HB      ALA  77  -2.907  -5.599  -8.583
  601    H    ALA  78           H        ALA  78  -0.506  -3.249  -6.577
  602    HA   ALA  78           HA       ALA  78   1.722  -2.382  -8.137
  603    HB1  ALA  78           3HB      ALA  78   1.850  -0.525  -6.555
  604    HB2  ALA  78           1HB      ALA  78   0.704  -1.342  -5.493
  605    HB3  ALA  78           2HB      ALA  78   0.190  -0.791  -7.088
  606    H    SER  79           H        SER  79   1.326  -3.968  -5.030
  607    HA   SER  79           HA       SER  79   3.957  -3.731  -4.082
  608    HB2  SER  79           1HB      SER  79   1.963  -5.954  -3.575
  609    HB3  SER  79           2HB      SER  79   3.388  -5.601  -2.596
  610    HG   SER  79           HG       SER  79   1.188  -3.849  -3.034
  611    H    ARG  80           H        ARG  80   2.556  -5.787  -6.495
  612    HA   ARG  80           HA       ARG  80   4.454  -7.858  -6.520
  613    HB2  ARG  80           1HB      ARG  80   2.297  -7.967  -7.713
  614    HB3  ARG  80           2HB      ARG  80   2.868  -6.746  -8.843
  615    HG2  ARG  80           1HG      ARG  80   4.648  -8.255  -9.574
  616    HG3  ARG  80           2HG      ARG  80   4.064  -9.482  -8.450
  617    HD2  ARG  80           1HD      ARG  80   1.879  -9.432  -9.634
  618    HD3  ARG  80           2HD      ARG  80   2.593  -8.335 -10.815
  619    HE   ARG  80           HE       ARG  80   4.210 -10.617 -10.622
  620   HH11  ARG  80          1HH1      ARG  80   1.036  -9.677 -11.765
  621   HH12  ARG  80          2HH1      ARG  80   0.957 -10.938 -12.966
  622   HH21  ARG  80          1HH2      ARG  80   4.113 -12.276 -12.168
  623   HH22  ARG  80          2HH2      ARG  80   2.712 -12.426 -13.195
  624    H    GLN  81           H        GLN  81   4.435  -4.669  -7.990
  625    HA   GLN  81           HA       GLN  81   6.652  -5.144  -9.716
  626    HB2  GLN  81           1HB      GLN  81   4.826  -3.335  -9.899
  627    HB3  GLN  81           2HB      GLN  81   5.792  -2.432  -8.739
  628    HG2  GLN  81           1HG      GLN  81   6.330  -1.690 -10.948
  629    HG3  GLN  81           2HG      GLN  81   7.710  -2.568 -10.290
  630   HE21  GLN  81          2HE2      GLN  81   8.574  -3.112 -12.265
  631   HE22  GLN  81          1HE2      GLN  81   7.825  -4.249 -13.338
  632    H    ALA  82           H        ALA  82   6.385  -4.608  -6.387
  633    HA   ALA  82           HA       ALA  82   9.212  -3.810  -6.194
  634    HB1  ALA  82           3HB      ALA  82   7.642  -2.353  -5.005
  635    HB2  ALA  82           1HB      ALA  82   8.729  -3.180  -3.888
  636    HB3  ALA  82           2HB      ALA  82   7.065  -3.737  -4.074
  637    H    HIS  83           H        HIS  83   7.450  -6.496  -6.373
  638    HA   HIS  83           HA       HIS  83   7.684  -8.674  -5.802
  639    HB2  HIS  83           1HB      HIS  83  10.458  -7.779  -4.995
  640    HB3  HIS  83           2HB      HIS  83   9.944  -9.459  -5.085
  641    HD1  HIS  83           HD1      HIS  83  11.776  -7.146  -6.967
  642    HD2  HIS  83           HD2      HIS  83   8.790  -9.882  -7.927
  643    HE1  HIS  83           HE1      HIS  83  11.998  -7.560  -9.442
  644    HE2  HIS  83           HE2      HIS  83  10.108  -9.126 -10.025
  645    H    CYS  84           H        CYS  84   6.820  -6.619  -3.779
  646    HA   CYS  84           HA       CYS  84   7.493  -8.002  -1.281
  647    HB2  CYS  84           1HB      CYS  84   7.635  -5.451  -1.551
  648    HB3  CYS  84           2HB      CYS  84   5.876  -5.466  -1.579
  649    HG   CYS  84           HG       CYS  84   6.373  -7.119   1.035
  650    H    LEU  85           H        LEU  85   6.155  -9.771  -2.389
  651    HA   LEU  85           HA       LEU  85   3.274  -9.246  -2.256
  652    HB2  LEU  85           1HB      LEU  85   4.887 -11.305  -3.733
  653    HB3  LEU  85           2HB      LEU  85   3.144 -11.402  -3.587
  654    HG   LEU  85           HG       LEU  85   4.650  -9.133  -4.889
  655   HD11  LEU  85          1HD1      LEU  85   3.769 -10.036  -6.976
  656   HD12  LEU  85          2HD1      LEU  85   3.042 -11.381  -6.097
  657   HD13  LEU  85          3HD1      LEU  85   4.798 -11.214  -6.163
  658   HD21  LEU  85          3HD2      LEU  85   2.550  -8.412  -3.890
  659   HD22  LEU  85          1HD2      LEU  85   1.698  -9.729  -4.698
  660   HD23  LEU  85          2HD2      LEU  85   2.427  -8.436  -5.649
  661    H    MET  86           H        MET  86   2.083 -10.108  -0.730
  662    HA   MET  86           HA       MET  86   2.934 -12.588   0.577
  663    HB2  MET  86           1HB      MET  86   2.044 -10.753   2.009
  664    HB3  MET  86           2HB      MET  86   0.527 -10.824   1.124
  665    HG2  MET  86           1HG      MET  86   0.264 -13.175   1.873
  666    HG3  MET  86           2HG      MET  86   1.712 -12.976   2.860
  667    HE1  MET  86           3HE      MET  86  -2.010 -11.862   2.283
  668    HE2  MET  86           1HE      MET  86  -1.141 -10.330   2.167
  669    HE3  MET  86           2HE      MET  86  -2.214 -10.635   3.534
  670    H    GLU  87           H        GLU  87   1.938 -14.524   0.085
  671    HA   GLU  87           HA       GLU  87   0.574 -14.660  -2.399
  672    HB2  GLU  87           1HB      GLU  87   1.136 -16.737  -0.298
  673    HB3  GLU  87           2HB      GLU  87   0.276 -17.105  -1.783
  674    HG2  GLU  87           1HG      GLU  87   2.304 -16.170  -2.997
  675    HG3  GLU  87           2HG      GLU  87   3.128 -16.261  -1.438
  676    H    ASP  88           H        ASP  88  -0.710 -13.652   0.406
  677    HA   ASP  88           HA       ASP  88  -2.834 -13.359   1.175
  678    HB2  ASP  88           1HB      ASP  88  -3.566 -13.124  -1.144
  679    HB3  ASP  88           2HB      ASP  88  -3.648 -14.871  -1.321
  680    H    LYS  89           H        LYS  89  -1.907 -16.549   0.123
  681    HA   LYS  89           HA       LYS  89  -3.670 -18.143   1.576
  682    HB2  LYS  89           1HB      LYS  89  -0.763 -18.745   1.021
  683    HB3  LYS  89           2HB      LYS  89  -2.058 -19.908   1.274
  684    HG2  LYS  89           1HG      LYS  89  -3.033 -19.440  -0.810
  685    HG3  LYS  89           2HG      LYS  89  -2.089 -17.960  -1.008
  686    HD2  LYS  89           1HD      LYS  89  -0.035 -19.342  -1.110
  687    HD3  LYS  89           2HD      LYS  89  -1.043 -20.789  -1.040
  688    HE2  LYS  89           1HE      LYS  89  -2.111 -20.186  -3.123
  689    HE3  LYS  89           2HE      LYS  89  -1.225 -18.662  -3.171
  690    HZ1  LYS  89           3HZ      LYS  89   0.838 -19.894  -3.361
  691    HZ2  LYS  89           1HZ      LYS  89  -0.221 -20.330  -4.614
  692    HZ3  LYS  89           2HZ      LYS  89  -0.002 -21.367  -3.290
  693    H    ALA  90           H        ALA  90  -0.914 -16.310   2.616
  694    HA   ALA  90           HA       ALA  90  -0.313 -17.657   5.015
  695    HB1  ALA  90           3HB      ALA  90   0.858 -15.620   5.662
  696    HB2  ALA  90           1HB      ALA  90   0.061 -14.734   4.361
  697    HB3  ALA  90           2HB      ALA  90   1.199 -16.029   3.979
  698    H    GLU  91           H        GLU  91  -2.820 -15.433   4.156
  699    HA   GLU  91           HA       GLU  91  -3.987 -15.735   6.805
  700    HB2  GLU  91           1HB      GLU  91  -2.688 -13.597   6.799
  701    HB3  GLU  91           2HB      GLU  91  -3.693 -13.034   5.474
  702    HG2  GLU  91           1HG      GLU  91  -5.579 -12.852   6.821
  703    HG3  GLU  91           2HG      GLU  91  -4.901 -13.899   8.070
  704    H    ALA  92           H        ALA  92  -5.586 -16.989   6.006
  705    HA   ALA  92           HA       ALA  92  -6.710 -16.459   3.405
  706    HB1  ALA  92           3HB      ALA  92  -6.121 -18.726   4.043
  707    HB2  ALA  92           1HB      ALA  92  -7.847 -18.597   3.704
  708    HB3  ALA  92           2HB      ALA  92  -7.279 -18.667   5.372
  709    HA   PRO  93           HA       PRO  93 -10.368 -14.529   5.168
  710    HB2  PRO  93           1HB      PRO  93 -11.055 -13.569   2.594
  711    HB3  PRO  93           2HB      PRO  93 -10.269 -12.667   3.887
  712    HG2  PRO  93           1HG      PRO  93  -9.114 -13.369   1.443
  713    HG3  PRO  93           2HG      PRO  93  -8.248 -12.810   2.882
  714    HD2  PRO  93           1HD      PRO  93  -8.617 -15.580   1.847
  715    HD3  PRO  93           2HD      PRO  93  -7.239 -14.864   2.711
  716    H    ASN  94           H        ASN  94  -9.977 -17.232   3.440
  717    HA   ASN  94           HA       ASN  94 -12.570 -17.504   2.218
  718    HB2  ASN  94           1HB      ASN  94 -11.891 -19.697   1.572
  719    HB3  ASN  94           2HB      ASN  94 -10.473 -18.670   1.403
  720   HD21  ASN  94          2HD2      ASN  94 -10.756 -21.577   1.803
  721   HD22  ASN  94          1HD2      ASN  94  -9.812 -21.946   3.207
  722    H    THR  95           H        THR  95 -11.540 -17.562   5.337
  723    HA   THR  95           HA       THR  95 -12.883 -19.733   6.491
  724    HB   THR  95           HB       THR  95 -12.917 -18.122   8.532
  725    HG1  THR  95           HG1      THR  95 -11.083 -16.505   7.993
  726   HG21  THR  95          3HG2      THR  95 -10.525 -18.506   8.920
  727   HG22  THR  95          1HG2      THR  95 -10.310 -18.892   7.213
  728   HG23  THR  95          2HG2      THR  95 -11.295 -19.939   8.235
  729    H    ILE  96           H        ILE  96 -13.946 -16.534   5.553
  730    HA   ILE  96           HA       ILE  96 -16.522 -16.672   6.747
  731    HB   ILE  96           HB       ILE  96 -15.648 -15.018   4.370
  732   HG12  ILE  96          1HG1      ILE  96 -15.650 -14.297   7.311
  733   HG13  ILE  96          2HG1      ILE  96 -14.214 -14.703   6.379
  734   HG21  ILE  96          1HG2      ILE  96 -18.058 -15.116   4.597
  735   HG22  ILE  96          2HG2      ILE  96 -17.476 -13.518   5.062
  736   HG23  ILE  96          3HG2      ILE  96 -17.940 -14.683   6.303
  737   HD11  ILE  96          3HD1      ILE  96 -14.432 -12.308   6.650
  738   HD12  ILE  96          1HD1      ILE  96 -16.028 -12.351   5.898
  739   HD13  ILE  96          2HD1      ILE  96 -14.596 -12.759   4.953
  740    H    ALA  97           H        ALA  97 -15.234 -17.493   3.571
  741    HA   ALA  97           HA       ALA  97 -17.748 -18.063   2.366
  742    HB1  ALA  97           3HB      ALA  97 -14.998 -19.006   1.559
  743    HB2  ALA  97           1HB      ALA  97 -15.747 -17.490   1.059
  744    HB3  ALA  97           2HB      ALA  97 -16.449 -19.028   0.555
  745    H    SER  98           H        SER  98 -18.903 -19.909   2.299
  746    HA   SER  98           HA       SER  98 -18.410 -21.913   4.242
  747    HB2  SER  98           1HB      SER  98 -20.278 -22.233   1.901
  748    HB3  SER  98           2HB      SER  98 -20.446 -22.874   3.535
  749    HG   SER  98           HG       SER  98 -20.760 -20.724   4.274
  750    H    GLY  99           H        GLY  99 -18.334 -21.990   0.680
  751    HA2  GLY  99           1HA      GLY  99 -16.812 -24.510   0.867
  752    HA3  GLY  99           2HA      GLY  99 -17.813 -24.045  -0.501
  753    H    SER 100           H        SER 100 -14.734 -24.399   0.472
  754    HA   SER 100           HA       SER 100 -13.725 -22.241  -1.253
  755    HB2  SER 100           1HB      SER 100 -12.198 -23.953   0.729
  756    HB3  SER 100           2HB      SER 100 -11.577 -22.550  -0.145
  757    HG   SER 100           HG       SER 100 -13.871 -21.976   1.189
  Start of MODEL   18
    1    H1   MET   1           1H       MET   1  -2.074  22.564  19.472
    2    H2   MET   1           2H       MET   1  -3.241  21.339  19.362
    3    H3   MET   1           3H       MET   1  -1.592  20.941  19.357
    4    HA   MET   1           HA       MET   1  -1.341  21.703  21.602
    5    HB2  MET   1           1HB      MET   1  -4.302  22.280  21.384
    6    HB3  MET   1           2HB      MET   1  -3.417  22.242  22.902
    7    HG2  MET   1           1HG      MET   1  -2.061  24.100  22.219
    8    HG3  MET   1           2HG      MET   1  -2.790  24.091  20.614
    9    HE1  MET   1           3HE      MET   1  -5.142  25.138  24.453
   10    HE2  MET   1           1HE      MET   1  -3.438  24.678  24.456
   11    HE3  MET   1           2HE      MET   1  -4.672  23.495  24.018
   12    H    GLU   2           H        GLU   2  -4.604  20.354  21.247
   13    HA   GLU   2           HA       GLU   2  -3.741  17.955  22.634
   14    HB2  GLU   2           1HB      GLU   2  -6.420  19.010  21.755
   15    HB3  GLU   2           2HB      GLU   2  -6.233  17.360  22.328
   16    HG2  GLU   2           1HG      GLU   2  -7.019  18.803  24.101
   17    HG3  GLU   2           2HG      GLU   2  -5.411  18.187  24.469
   18    H    VAL   3           H        VAL   3  -4.668  18.994  19.435
   19    HA   VAL   3           HA       VAL   3  -4.148  16.263  18.450
   20    HB   VAL   3           HB       VAL   3  -6.040  18.280  17.219
   21   HG11  VAL   3          1HG1      VAL   3  -4.991  16.848  15.559
   22   HG12  VAL   3          2HG1      VAL   3  -6.693  16.428  15.748
   23   HG13  VAL   3          3HG1      VAL   3  -5.450  15.415  16.480
   24   HG21  VAL   3          3HG2      VAL   3  -6.631  15.746  18.745
   25   HG22  VAL   3          1HG2      VAL   3  -7.823  16.732  17.897
   26   HG23  VAL   3          2HG2      VAL   3  -6.960  17.393  19.284
   27    H    GLN   4           H        GLN   4  -2.247  16.235  17.458
   28    HA   GLN   4           HA       GLN   4  -1.083  18.620  16.331
   29    HB2  GLN   4           1HB      GLN   4  -0.127  15.753  16.245
   30    HB3  GLN   4           2HB      GLN   4   0.809  17.151  15.738
   31    HG2  GLN   4           1HG      GLN   4   0.724  18.014  18.039
   32    HG3  GLN   4           2HG      GLN   4  -0.155  16.566  18.529
   33   HE21  GLN   4          2HE2      GLN   4   2.437  17.569  19.420
   34   HE22  GLN   4          1HE2      GLN   4   3.575  16.302  19.106
   35    H    SER   5           H        SER   5  -2.016  15.449  14.996
   36    HA   SER   5           HA       SER   5  -1.776  16.524  12.302
   37    HB2  SER   5           1HB      SER   5  -2.371  13.706  13.232
   38    HB3  SER   5           2HB      SER   5  -2.038  14.198  11.571
   39    HG   SER   5           HG       SER   5  -0.066  15.121  13.086
   40    H    MET   6           H        MET   6  -3.485  17.610  11.585
   41    HA   MET   6           HA       MET   6  -6.180  16.782  12.286
   42    HB2  MET   6           1HB      MET   6  -5.128  19.044  10.584
   43    HB3  MET   6           2HB      MET   6  -6.840  18.724  10.821
   44    HG2  MET   6           1HG      MET   6  -6.606  19.112  13.203
   45    HG3  MET   6           2HG      MET   6  -4.873  19.373  13.003
   46    HE1  MET   6           3HE      MET   6  -5.273  21.659  14.374
   47    HE2  MET   6           1HE      MET   6  -7.019  21.415  14.404
   48    HE3  MET   6           2HE      MET   6  -6.352  22.944  13.831
   49    H    LEU   7           H        LEU   7  -6.383  14.781  11.297
   50    HA   LEU   7           HA       LEU   7  -6.127  14.625   8.402
   51    HB2  LEU   7           1HB      LEU   7  -5.400  12.729   9.810
   52    HB3  LEU   7           2HB      LEU   7  -7.038  12.555  10.409
   53    HG   LEU   7           HG       LEU   7  -7.802  11.991   8.133
   54   HD11  LEU   7          1HD1      LEU   7  -6.118  13.218   6.867
   55   HD12  LEU   7          2HD1      LEU   7  -6.162  11.521   6.387
   56   HD13  LEU   7          3HD1      LEU   7  -4.871  12.108   7.436
   57   HD21  LEU   7          3HD2      LEU   7  -5.507  10.312   9.138
   58   HD22  LEU   7          1HD2      LEU   7  -6.768   9.779   8.026
   59   HD23  LEU   7          2HD2      LEU   7  -7.182  10.217   9.683
   60    H    LEU   8           H        LEU   8  -7.842  14.560   6.999
   61    HA   LEU   8           HA       LEU   8 -10.232  15.819   7.871
   62    HB2  LEU   8           1HB      LEU   8  -9.630  14.460   5.243
   63    HB3  LEU   8           2HB      LEU   8 -10.989  15.523   5.551
   64    HG   LEU   8           HG       LEU   8  -8.079  16.325   5.609
   65   HD11  LEU   8          1HD1      LEU   8 -10.273  16.935   3.634
   66   HD12  LEU   8          2HD1      LEU   8  -8.885  15.882   3.357
   67   HD13  LEU   8          3HD1      LEU   8  -8.645  17.613   3.605
   68   HD21  LEU   8          3HD2      LEU   8 -10.581  17.972   5.958
   69   HD22  LEU   8          1HD2      LEU   8  -8.939  18.606   5.835
   70   HD23  LEU   8          2HD2      LEU   8  -9.395  17.600   7.209
   71    H    ASN   9           H        ASN   9  -9.751  12.632   6.349
   72    HA   ASN   9           HA       ASN   9 -11.976  11.605   7.972
   73    HB2  ASN   9           1HB      ASN   9 -12.765  12.243   5.668
   74    HB3  ASN   9           2HB      ASN   9 -11.643  11.055   5.015
   75   HD21  ASN   9          2HD2      ASN   9 -13.351   9.971   4.067
   76   HD22  ASN   9          1HD2      ASN   9 -14.423   8.964   4.979
   77    H    ASP  10           H        ASP  10 -10.995  10.110   9.202
   78    HA   ASP  10           HA       ASP  10  -8.782   8.578   8.172
   79    HB2  ASP  10           1HB      ASP  10  -8.777   7.482  10.403
   80    HB3  ASP  10           2HB      ASP  10  -8.668   9.235  10.493
   81    H    VAL  11           H        VAL  11  -9.536   7.388   6.522
   82    HA   VAL  11           HA       VAL  11 -11.869   5.692   6.877
   83    HB   VAL  11           HB       VAL  11 -10.086   5.855   4.447
   84   HG11  VAL  11          1HG1      VAL  11 -12.967   5.049   4.791
   85   HG12  VAL  11          2HG1      VAL  11 -11.610   3.959   4.504
   86   HG13  VAL  11          3HG1      VAL  11 -12.093   5.116   3.263
   87   HG21  VAL  11          3HG2      VAL  11 -10.838   8.102   5.006
   88   HG22  VAL  11          1HG2      VAL  11 -12.505   7.533   5.087
   89   HG23  VAL  11          2HG2      VAL  11 -11.640   7.514   3.549
   90    H    LYS  12           H        LYS  12 -11.584   3.792   7.844
   91    HA   LYS  12           HA       LYS  12  -8.981   2.509   7.585
   92    HB2  LYS  12           1HB      LYS  12 -11.191   2.133   9.594
   93    HB3  LYS  12           2HB      LYS  12  -9.795   1.068   9.500
   94    HG2  LYS  12           1HG      LYS  12  -8.340   3.066   9.834
   95    HG3  LYS  12           2HG      LYS  12  -9.801   4.013  10.115
   96    HD2  LYS  12           1HD      LYS  12 -10.363   2.666  12.030
   97    HD3  LYS  12           2HD      LYS  12  -9.020   1.569  11.700
   98    HE2  LYS  12           1HE      LYS  12  -7.441   3.415  12.077
   99    HE3  LYS  12           2HE      LYS  12  -8.794   4.487  12.440
  100    HZ1  LYS  12           3HZ      LYS  12  -9.346   3.155  14.338
  101    HZ2  LYS  12           1HZ      LYS  12  -7.708   3.588  14.439
  102    HZ3  LYS  12           2HZ      LYS  12  -8.145   2.018  13.961
  103    H    TRP  13           H        TRP  13  -8.908   0.155   7.399
  104    HA   TRP  13           HA       TRP  13 -10.685  -0.682   5.258
  105    HB2  TRP  13           1HB      TRP  13  -7.985  -1.350   6.155
  106    HB3  TRP  13           2HB      TRP  13  -8.933  -2.764   5.713
  107    HD1  TRP  13           HD1      TRP  13 -10.338  -2.171   3.170
  108    HE1  TRP  13           HE1      TRP  13  -9.142  -1.461   1.010
  109    HE3  TRP  13           HE3      TRP  13  -6.001  -0.383   5.201
  110    HZ2  TRP  13           HZ2      TRP  13  -6.681  -0.293   0.263
  111    HZ3  TRP  13           HZ3      TRP  13  -4.275   0.510   3.693
  112    HH2  TRP  13           HH2      TRP  13  -4.609   0.552   1.275
  113    H    GLU  14           H        GLU  14 -10.914  -3.265   5.356
  114    HA   GLU  14           HA       GLU  14 -12.843  -3.906   7.263
  115    HB2  GLU  14           1HB      GLU  14 -11.025  -5.838   5.813
  116    HB3  GLU  14           2HB      GLU  14 -12.579  -6.216   6.538
  117    HG2  GLU  14           1HG      GLU  14 -13.653  -4.688   4.915
  118    HG3  GLU  14           2HG      GLU  14 -12.079  -4.461   4.147
  119    H    LYS  15           H        LYS  15  -9.572  -5.247   7.036
  120    HA   LYS  15           HA       LYS  15  -8.701  -4.891   9.609
  121    HB2  LYS  15           1HB      LYS  15 -10.547  -6.163  10.463
  122    HB3  LYS  15           2HB      LYS  15 -10.262  -7.461   9.318
  123    HG2  LYS  15           1HG      LYS  15  -8.137  -7.964  10.431
  124    HG3  LYS  15           2HG      LYS  15  -8.457  -6.677  11.597
  125    HD2  LYS  15           1HD      LYS  15 -10.417  -7.821  12.396
  126    HD3  LYS  15           2HD      LYS  15 -10.266  -9.043  11.134
  127    HE2  LYS  15           1HE      LYS  15  -8.138  -9.769  12.100
  128    HE3  LYS  15           2HE      LYS  15  -8.296  -8.549  13.363
  129    HZ1  LYS  15           3HZ      LYS  15 -10.308 -10.676  12.912
  130    HZ2  LYS  15           1HZ      LYS  15 -10.174  -9.645  14.248
  131    HZ3  LYS  15           2HZ      LYS  15  -9.007 -10.849  13.989
  132    HA   PRO  16           HA       PRO  16  -6.077  -8.401   7.799
  133    HB2  PRO  16           1HB      PRO  16  -6.853  -9.874   5.701
  134    HB3  PRO  16           2HB      PRO  16  -7.439 -10.203   7.335
  135    HG2  PRO  16           1HG      PRO  16  -8.798  -8.788   5.082
  136    HG3  PRO  16           2HG      PRO  16  -9.470  -9.936   6.253
  137    HD2  PRO  16           1HD      PRO  16  -9.718  -7.194   6.425
  138    HD3  PRO  16           2HD      PRO  16  -9.852  -8.308   7.796
  139    H    VAL  17           H        VAL  17  -5.213  -6.203   7.163
  140    HA   VAL  17           HA       VAL  17  -4.609  -6.256   4.276
  141    HB   VAL  17           HB       VAL  17  -4.317  -3.869   6.113
  142   HG11  VAL  17          1HG1      VAL  17  -4.066  -2.605   4.033
  143   HG12  VAL  17          2HG1      VAL  17  -4.199  -4.100   3.107
  144   HG13  VAL  17          3HG1      VAL  17  -2.825  -3.849   4.183
  145   HG21  VAL  17          3HG2      VAL  17  -6.512  -4.481   4.137
  146   HG22  VAL  17          1HG2      VAL  17  -6.309  -2.962   5.009
  147   HG23  VAL  17          2HG2      VAL  17  -6.671  -4.444   5.893
  148    H    THR  18           H        THR  18  -2.952  -7.740   4.490
  149    HA   THR  18           HA       THR  18  -0.756  -7.091   6.319
  150    HB   THR  18           HB       THR  18  -0.422  -9.631   5.053
  151    HG1  THR  18           HG1      THR  18  -2.366 -10.513   5.185
  152   HG21  THR  18          3HG2      THR  18  -0.576 -10.447   7.359
  153   HG22  THR  18          1HG2      THR  18  -1.215  -8.886   7.873
  154   HG23  THR  18          2HG2      THR  18   0.435  -9.005   7.261
  155    H    ILE  19           H        ILE  19   0.797  -5.937   5.398
  156    HA   ILE  19           HA       ILE  19   1.505  -6.463   2.596
  157    HB   ILE  19           HB       ILE  19   0.995  -4.105   3.284
  158   HG12  ILE  19          1HG1      ILE  19   3.820  -4.624   2.333
  159   HG13  ILE  19          2HG1      ILE  19   2.381  -4.542   1.320
  160   HG21  ILE  19          1HG2      ILE  19   3.516  -4.401   4.910
  161   HG22  ILE  19          2HG2      ILE  19   1.889  -4.094   5.521
  162   HG23  ILE  19          3HG2      ILE  19   2.718  -2.868   4.557
  163   HD11  ILE  19          3HD1      ILE  19   3.606  -2.298   2.899
  164   HD12  ILE  19          1HD1      ILE  19   2.091  -2.188   2.005
  165   HD13  ILE  19          2HD1      ILE  19   3.600  -2.490   1.145
  166    H    SER  20           H        SER  20   3.518  -7.195   2.043
  167    HA   SER  20           HA       SER  20   5.310  -7.824   4.284
  168    HB2  SER  20           1HB      SER  20   4.153  -9.814   3.240
  169    HB3  SER  20           2HB      SER  20   5.007  -9.448   1.743
  170    HG   SER  20           HG       SER  20   6.710 -10.377   2.532
  171    H    LEU  21           H        LEU  21   7.456  -7.375   4.039
  172    HA   LEU  21           HA       LEU  21   8.225  -5.957   1.572
  173    HB2  LEU  21           1HB      LEU  21   8.857  -5.377   4.450
  174    HB3  LEU  21           2HB      LEU  21   9.917  -4.817   3.176
  175    HG   LEU  21           HG       LEU  21   7.979  -3.575   2.194
  176   HD11  LEU  21          1HD1      LEU  21   6.034  -3.152   3.597
  177   HD12  LEU  21          2HD1      LEU  21   6.635  -4.301   4.792
  178   HD13  LEU  21          3HD1      LEU  21   6.161  -4.863   3.189
  179   HD21  LEU  21          3HD2      LEU  21   8.046  -1.778   3.851
  180   HD22  LEU  21          1HD2      LEU  21   9.646  -2.463   3.564
  181   HD23  LEU  21          2HD2      LEU  21   8.753  -2.890   5.023
  182    H    GLN  22           H        GLN  22  10.692  -5.851   1.355
  183    HA   GLN  22           HA       GLN  22  11.729  -8.479   1.205
  184    HB2  GLN  22           1HB      GLN  22  13.223  -5.855   1.022
  185    HB3  GLN  22           2HB      GLN  22  13.812  -7.418   0.478
  186    HG2  GLN  22           1HG      GLN  22  11.957  -7.506  -1.149
  187    HG3  GLN  22           2HG      GLN  22  11.481  -5.886  -0.644
  188   HE21  GLN  22          2HE2      GLN  22  12.322  -6.827  -3.249
  189   HE22  GLN  22          1HE2      GLN  22  13.701  -5.884  -3.687
  190    H    ASN  23           H        ASN  23  11.580  -6.237   3.730
  191    HA   ASN  23           HA       ASN  23  13.886  -7.126   5.192
  192    HB2  ASN  23           1HB      ASN  23  11.480  -5.495   6.036
  193    HB3  ASN  23           2HB      ASN  23  12.881  -5.798   7.057
  194   HD21  ASN  23          2HD2      ASN  23  14.738  -4.657   6.731
  195   HD22  ASN  23          1HD2      ASN  23  14.874  -3.354   5.595
  196    H    GLY  24           H        GLY  24  11.054  -8.605   4.451
  197    HA2  GLY  24           1HA      GLY  24  10.058 -10.520   5.223
  198    HA3  GLY  24           2HA      GLY  24  11.411 -10.696   6.328
  199    H    ALA  25           H        ALA  25   8.859  -8.234   6.028
  200    HA   ALA  25           HA       ALA  25   7.930  -8.950   8.706
  201    HB1  ALA  25           3HB      ALA  25   8.635  -6.132   7.901
  202    HB2  ALA  25           1HB      ALA  25   9.565  -7.151   9.001
  203    HB3  ALA  25           2HB      ALA  25   7.936  -6.634   9.441
  204    HA   PRO  26           HA       PRO  26   4.154  -8.172   6.295
  205    HB2  PRO  26           1HB      PRO  26   2.944 -10.181   7.975
  206    HB3  PRO  26           2HB      PRO  26   3.281 -10.259   6.245
  207    HG2  PRO  26           1HG      PRO  26   4.558 -11.798   8.115
  208    HG3  PRO  26           2HG      PRO  26   5.266 -11.348   6.554
  209    HD2  PRO  26           1HD      PRO  26   5.721 -10.143   9.260
  210    HD3  PRO  26           2HD      PRO  26   6.895 -10.499   7.973
  211    H    ARG  27           H        ARG  27   3.160  -6.387   6.967
  212    HA   ARG  27           HA       ARG  27   2.390  -6.191   9.803
  213    HB2  ARG  27           1HB      ARG  27   3.275  -4.116   7.837
  214    HB3  ARG  27           2HB      ARG  27   2.243  -3.664   9.185
  215    HG2  ARG  27           1HG      ARG  27   3.890  -4.518  10.753
  216    HG3  ARG  27           2HG      ARG  27   4.924  -5.010   9.409
  217    HD2  ARG  27           1HD      ARG  27   5.213  -2.734   8.721
  218    HD3  ARG  27           2HD      ARG  27   4.023  -2.179   9.899
  219    HE   ARG  27           HE       ARG  27   5.567  -2.634  11.639
  220   HH11  ARG  27          1HH1      ARG  27   6.896  -3.070   8.423
  221   HH12  ARG  27          2HH1      ARG  27   8.547  -2.912   8.950
  222   HH21  ARG  27          1HH2      ARG  27   7.727  -2.493  12.334
  223   HH22  ARG  27          2HH2      ARG  27   9.018  -2.608  11.177
  224    H    ILE  28           H        ILE  28   0.366  -5.593  10.357
  225    HA   ILE  28           HA       ILE  28  -1.645  -5.718   8.231
  226    HB   ILE  28           HB       ILE  28  -2.010  -5.824  11.233
  227   HG12  ILE  28          1HG1      ILE  28  -2.076  -8.057   9.188
  228   HG13  ILE  28          2HG1      ILE  28  -0.771  -7.770  10.335
  229   HG21  ILE  28          1HG2      ILE  28  -3.977  -4.982  10.070
  230   HG22  ILE  28          2HG2      ILE  28  -4.273  -6.600  10.707
  231   HG23  ILE  28          3HG2      ILE  28  -3.950  -6.375   8.989
  232   HD11  ILE  28          3HD1      ILE  28  -2.221  -9.570  11.075
  233   HD12  ILE  28          1HD1      ILE  28  -3.610  -8.485  11.035
  234   HD13  ILE  28          2HD1      ILE  28  -2.303  -8.203  12.185
  235    H    PHE  29           H        PHE  29  -2.302  -3.839   7.427
  236    HA   PHE  29           HA       PHE  29  -2.187  -1.405   9.001
  237    HB2  PHE  29           1HB      PHE  29  -3.124  -1.948   6.178
  238    HB3  PHE  29           2HB      PHE  29  -3.186  -0.360   6.934
  239    HD1  PHE  29           HD1      PHE  29  -0.714  -0.011   8.264
  240    HD2  PHE  29           HD2      PHE  29  -1.483  -2.019   4.592
  241    HE1  PHE  29           HE1      PHE  29   1.594   0.436   7.542
  242    HE2  PHE  29           HE2      PHE  29   0.825  -1.581   3.865
  243    HZ   PHE  29           HZ       PHE  29   2.366  -0.352   5.340
  244    H    ASN  30           H        ASN  30  -3.856  -0.449  10.000
  245    HA   ASN  30           HA       ASN  30  -6.339  -1.943  10.181
  246    HB2  ASN  30           1HB      ASN  30  -5.606   0.655  11.557
  247    HB3  ASN  30           2HB      ASN  30  -6.909  -0.445  11.995
  248   HD21  ASN  30          2HD2      ASN  30  -3.533   0.229  12.187
  249   HD22  ASN  30          1HD2      ASN  30  -3.121  -1.070  13.269
  250    H    GLY  31           H        GLY  31  -5.080   1.053   8.908
  251    HA2  GLY  31           1HA      GLY  31  -7.568   1.371   7.399
  252    HA3  GLY  31           2HA      GLY  31  -6.987   2.732   8.351
  253    H    VAL  32           H        VAL  32  -7.240   3.453   5.940
  254    HA   VAL  32           HA       VAL  32  -5.137   2.606   4.176
  255    HB   VAL  32           HB       VAL  32  -6.987   4.962   3.802
  256   HG11  VAL  32          1HG1      VAL  32  -5.121   4.920   2.264
  257   HG12  VAL  32          2HG1      VAL  32  -6.608   4.510   1.412
  258   HG13  VAL  32          3HG1      VAL  32  -5.466   3.241   1.850
  259   HG21  VAL  32          3HG2      VAL  32  -7.442   2.074   3.052
  260   HG22  VAL  32          1HG2      VAL  32  -8.462   3.431   2.572
  261   HG23  VAL  32          2HG2      VAL  32  -8.326   2.988   4.275
  262    H    TYR  33           H        TYR  33  -5.548   5.144   6.512
  263    HA   TYR  33           HA       TYR  33  -3.686   6.967   5.382
  264    HB2  TYR  33           1HB      TYR  33  -5.342   7.665   7.087
  265    HB3  TYR  33           2HB      TYR  33  -4.481   6.705   8.290
  266    HD1  TYR  33           HD1      TYR  33  -4.099   9.573   5.966
  267    HD2  TYR  33           HD2      TYR  33  -2.623   7.602   9.434
  268    HE1  TYR  33           HE1      TYR  33  -2.601  11.472   6.399
  269    HE2  TYR  33           HE2      TYR  33  -1.122   9.499   9.881
  270    HH   TYR  33           HH       TYR  33  -0.017  11.334   8.489
  271    H    GLU  34           H        GLU  34  -3.413   4.427   7.837
  272    HA   GLU  34           HA       GLU  34  -0.698   4.749   8.443
  273    HB2  GLU  34           1HB      GLU  34  -2.347   2.215   8.367
  274    HB3  GLU  34           2HB      GLU  34  -0.772   2.370   9.135
  275    HG2  GLU  34           1HG      GLU  34  -1.601   3.777  10.809
  276    HG3  GLU  34           2HG      GLU  34  -3.087   4.105   9.914
  277    H    ALA  35           H        ALA  35  -2.315   3.003   5.856
  278    HA   ALA  35           HA       ALA  35  -0.057   1.735   4.757
  279    HB1  ALA  35           3HB      ALA  35  -2.367   1.113   4.206
  280    HB2  ALA  35           1HB      ALA  35  -1.414   1.445   2.759
  281    HB3  ALA  35           2HB      ALA  35  -2.566   2.642   3.350
  282    H    PHE  36           H        PHE  36  -1.663   4.793   3.886
  283    HA   PHE  36           HA       PHE  36   0.149   5.534   1.865
  284    HB2  PHE  36           1HB      PHE  36  -2.049   6.579   2.069
  285    HB3  PHE  36           2HB      PHE  36  -1.598   7.277   3.619
  286    HD1  PHE  36           HD2      PHE  36  -0.443   7.209   0.072
  287    HD2  PHE  36           HD1      PHE  36  -0.856   9.451   3.666
  288    HE1  PHE  36           HE2      PHE  36   0.440   9.198  -1.072
  289    HE2  PHE  36           HE1      PHE  36   0.029  11.444   2.527
  290    HZ   PHE  36           HZ       PHE  36   0.678  11.318   0.154
  291    H    ASP  37           H        ASP  37   0.045   6.311   5.322
  292    HA   ASP  37           HA       ASP  37   2.217   8.092   5.351
  293    HB2  ASP  37           1HB      ASP  37   0.602   7.832   7.222
  294    HB3  ASP  37           2HB      ASP  37   1.306   6.260   7.585
  295    H    PHE  38           H        PHE  38   2.044   4.589   5.761
  296    HA   PHE  38           HA       PHE  38   4.752   4.135   6.342
  297    HB2  PHE  38           1HB      PHE  38   2.992   2.438   6.642
  298    HB3  PHE  38           2HB      PHE  38   2.800   2.329   4.896
  299    HD1  PHE  38           HD1      PHE  38   5.414   1.993   7.527
  300    HD2  PHE  38           HD2      PHE  38   3.937   0.676   3.758
  301    HE1  PHE  38           HE1      PHE  38   7.139   0.242   7.466
  302    HE2  PHE  38           HE2      PHE  38   5.662  -1.075   3.692
  303    HZ   PHE  38           HZ       PHE  38   7.264  -1.294   5.548
  304    H    LEU  39           H        LEU  39   3.011   4.152   3.245
  305    HA   LEU  39           HA       LEU  39   5.174   3.480   1.596
  306    HB2  LEU  39           1HB      LEU  39   2.780   5.207   0.964
  307    HB3  LEU  39           2HB      LEU  39   3.869   4.524  -0.226
  308    HG   LEU  39           HG       LEU  39   2.073   2.948   1.620
  309   HD11  LEU  39          1HD1      LEU  39   0.818   4.124  -0.083
  310   HD12  LEU  39          2HD1      LEU  39   0.864   2.399  -0.450
  311   HD13  LEU  39          3HD1      LEU  39   1.901   3.516  -1.336
  312   HD21  LEU  39          3HD2      LEU  39   3.867   2.023  -0.624
  313   HD22  LEU  39          1HD2      LEU  39   2.757   1.012   0.300
  314   HD23  LEU  39          2HD2      LEU  39   4.145   1.755   1.096
  315    H    GLN  40           H        GLN  40   3.923   6.659   2.564
  316    HA   GLN  40           HA       GLN  40   5.809   8.142   1.057
  317    HB2  GLN  40           1HB      GLN  40   3.665   9.080   1.835
  318    HB3  GLN  40           2HB      GLN  40   4.233   8.985   3.496
  319    HG2  GLN  40           1HG      GLN  40   6.007  10.575   2.992
  320    HG3  GLN  40           2HG      GLN  40   5.463  10.658   1.317
  321   HE21  GLN  40          2HE2      GLN  40   5.690  12.746   3.350
  322   HE22  GLN  40          1HE2      GLN  40   4.109  13.449   3.479
  323    H    HIS  41           H        HIS  41   5.769   6.930   4.362
  324    HA   HIS  41           HA       HIS  41   8.059   8.362   5.246
  325    HB2  HIS  41           1HB      HIS  41   6.524   6.016   6.285
  326    HB3  HIS  41           2HB      HIS  41   8.106   6.372   6.967
  327    HD1  HIS  41           HD1      HIS  41   7.117   6.997   9.243
  328    HD2  HIS  41           HD2      HIS  41   5.712   9.330   6.100
  329    HE1  HIS  41           HE1      HIS  41   5.926   8.936  10.315
  330    HE2  HIS  41           HE2      HIS  41   4.871  10.176   8.391
  331    H    GLU  42           H        GLU  42   7.689   4.891   4.459
  332    HA   GLU  42           HA       GLU  42  10.270   4.887   3.202
  333    HB2  GLU  42           1HB      GLU  42  10.917   4.772   5.561
  334    HB3  GLU  42           2HB      GLU  42   9.901   3.353   5.775
  335    HG2  GLU  42           1HG      GLU  42  11.284   2.093   4.243
  336    HG3  GLU  42           2HG      GLU  42  12.271   3.520   3.930
  337    H    TRP  43           H        TRP  43   8.866   4.201   1.505
  338    HA   TRP  43           HA       TRP  43   8.267   1.333   1.616
  339    HB2  TRP  43           1HB      TRP  43   6.528   2.775   0.638
  340    HB3  TRP  43           2HB      TRP  43   7.683   3.391  -0.535
  341    HD1  TRP  43           HD1      TRP  43   7.382   2.337  -2.825
  342    HE1  TRP  43           HE1      TRP  43   6.568   0.077  -3.752
  343    HE3  TRP  43           HE3      TRP  43   6.427  -0.059   1.600
  344    HZ2  TRP  43           HZ2      TRP  43   5.639  -2.384  -2.742
  345    HZ3  TRP  43           HZ3      TRP  43   5.581  -2.360   1.522
  346    HH2  TRP  43           HH2      TRP  43   5.188  -3.498  -0.598
  347    HA   PRO  44           HA       PRO  44  12.456   1.045   0.109
  348    HB2  PRO  44           1HB      PRO  44  12.703  -1.630   0.287
  349    HB3  PRO  44           2HB      PRO  44  12.667  -0.589   1.717
  350    HG2  PRO  44           1HG      PRO  44  10.456  -2.200   0.494
  351    HG3  PRO  44           2HG      PRO  44  10.918  -2.054   2.200
  352    HD2  PRO  44           1HD      PRO  44   8.864  -0.653   1.117
  353    HD3  PRO  44           2HD      PRO  44   9.857  -0.026   2.447
  354    H    ALA  45           H        ALA  45  10.206   1.130  -1.847
  355    HA   ALA  45           HA       ALA  45  11.643  -0.163  -4.022
  356    HB1  ALA  45           3HB      ALA  45   9.956  -1.813  -3.386
  357    HB2  ALA  45           1HB      ALA  45   9.610  -1.132  -4.975
  358    HB3  ALA  45           2HB      ALA  45   8.691  -0.598  -3.567
  359    H    ARG  46           H        ARG  46  11.708   1.099  -5.784
  360    HA   ARG  46           HA       ARG  46   9.775   3.293  -6.028
  361    HB2  ARG  46           1HB      ARG  46  12.786   3.545  -6.061
  362    HB3  ARG  46           2HB      ARG  46  11.713   4.786  -6.694
  363    HG2  ARG  46           1HG      ARG  46  10.995   5.424  -4.625
  364    HG3  ARG  46           2HG      ARG  46  11.261   3.829  -3.919
  365    HD2  ARG  46           1HD      ARG  46  13.413   5.791  -4.708
  366    HD3  ARG  46           2HD      ARG  46  12.858   5.479  -3.061
  367    HE   ARG  46           HE       ARG  46  14.334   3.587  -4.779
  368   HH11  ARG  46          1HH1      ARG  46  13.205   4.596  -1.610
  369   HH12  ARG  46          2HH1      ARG  46  14.106   3.377  -0.755
  370   HH21  ARG  46          1HH2      ARG  46  15.491   1.966  -3.665
  371   HH22  ARG  46          2HH2      ARG  46  15.403   1.878  -1.931
  372    H    GLY  47           H        GLY  47   9.704   4.210  -8.202
  373    HA2  GLY  47           1HA      GLY  47  11.060   3.007 -10.377
  374    HA3  GLY  47           2HA      GLY  47   9.497   2.235 -10.157
  375    H    ASP  48           H        ASP  48   7.645   3.295 -10.756
  376    HA   ASP  48           HA       ASP  48   7.829   6.071 -11.588
  377    HB2  ASP  48           1HB      ASP  48   8.617   4.812 -13.551
  378    HB3  ASP  48           2HB      ASP  48   7.125   3.881 -13.553
  379    H    ARG  49           H        ARG  49   5.381   4.070 -13.023
  380    HA   ARG  49           HA       ARG  49   3.411   5.745 -11.778
  381    HB2  ARG  49           1HB      ARG  49   3.282   3.603 -13.873
  382    HB3  ARG  49           2HB      ARG  49   1.818   4.284 -13.178
  383    HG2  ARG  49           1HG      ARG  49   2.436   6.491 -13.930
  384    HG3  ARG  49           2HG      ARG  49   3.978   5.883 -14.535
  385    HD2  ARG  49           1HD      ARG  49   2.803   4.473 -16.137
  386    HD3  ARG  49           2HD      ARG  49   1.253   5.038 -15.513
  387    HE   ARG  49           HE       ARG  49   2.263   7.342 -16.230
  388   HH11  ARG  49          1HH1      ARG  49   2.503   4.286 -17.914
  389   HH12  ARG  49          2HH1      ARG  49   2.610   5.014 -19.490
  390   HH21  ARG  49          1HH2      ARG  49   2.391   8.313 -18.288
  391   HH22  ARG  49          2HH2      ARG  49   2.548   7.314 -19.702
  392    H    ALA  50           H        ALA  50   4.436   2.413 -11.395
  393    HA   ALA  50           HA       ALA  50   2.197   1.476  -9.975
  394    HB1  ALA  50           3HB      ALA  50   5.074   0.623  -9.668
  395    HB2  ALA  50           1HB      ALA  50   3.933  -0.012 -10.853
  396    HB3  ALA  50           2HB      ALA  50   3.658  -0.282  -9.132
  397    H    HIS  51           H        HIS  51   4.945   3.392  -9.009
  398    HA   HIS  51           HA       HIS  51   4.400   3.219  -6.188
  399    HB2  HIS  51           1HB      HIS  51   6.670   3.674  -7.246
  400    HB3  HIS  51           2HB      HIS  51   6.082   5.291  -7.609
  401    HD1  HIS  51           HD1      HIS  51   6.027   6.985  -5.699
  402    HD2  HIS  51           HD2      HIS  51   7.133   3.157  -4.501
  403    HE1  HIS  51           HE1      HIS  51   6.914   7.233  -3.358
  404    HE2  HIS  51           HE2      HIS  51   7.819   4.953  -2.769
  405    H    GLU  52           H        GLU  52   3.854   5.547  -8.795
  406    HA   GLU  52           HA       GLU  52   2.678   7.596  -7.279
  407    HB2  GLU  52           1HB      GLU  52   2.196   6.823 -10.165
  408    HB3  GLU  52           2HB      GLU  52   1.661   8.327  -9.429
  409    HG2  GLU  52           1HG      GLU  52   3.985   8.948  -9.007
  410    HG3  GLU  52           2HG      GLU  52   4.521   7.441  -9.746
  411    H    GLN  53           H        GLN  53   1.190   4.887  -9.045
  412    HA   GLN  53           HA       GLN  53  -1.480   5.500  -8.528
  413    HB2  GLN  53           1HB      GLN  53  -0.109   2.859  -8.997
  414    HB3  GLN  53           2HB      GLN  53  -1.852   2.996  -8.807
  415    HG2  GLN  53           1HG      GLN  53  -1.919   4.525 -10.730
  416    HG3  GLN  53           2HG      GLN  53  -0.181   4.308 -10.938
  417   HE21  GLN  53          2HE2      GLN  53  -2.426   3.683 -12.719
  418   HE22  GLN  53          1HE2      GLN  53  -2.274   2.005 -13.097
  419    H    ALA  54           H        ALA  54   0.791   3.543  -6.629
  420    HA   ALA  54           HA       ALA  54  -0.958   2.633  -4.673
  421    HB1  ALA  54           3HB      ALA  54   1.931   3.413  -4.296
  422    HB2  ALA  54           1HB      ALA  54   1.358   1.855  -4.892
  423    HB3  ALA  54           2HB      ALA  54   0.989   2.358  -3.241
  424    H    LEU  55           H        LEU  55   0.879   5.663  -4.814
  425    HA   LEU  55           HA       LEU  55  -0.009   6.655  -2.310
  426    HB2  LEU  55           1HB      LEU  55   0.936   8.188  -4.735
  427    HB3  LEU  55           2HB      LEU  55   0.807   8.827  -3.107
  428    HG   LEU  55           HG       LEU  55   2.686   6.639  -4.002
  429   HD11  LEU  55          1HD1      LEU  55   4.435   8.288  -3.569
  430   HD12  LEU  55          2HD1      LEU  55   3.206   9.496  -3.198
  431   HD13  LEU  55          3HD1      LEU  55   3.328   8.834  -4.828
  432   HD21  LEU  55          3HD2      LEU  55   1.955   6.304  -1.704
  433   HD22  LEU  55          1HD2      LEU  55   2.375   7.972  -1.315
  434   HD23  LEU  55          2HD2      LEU  55   3.639   6.824  -1.757
  435    H    ARG  56           H        ARG  56  -1.217   7.001  -5.608
  436    HA   ARG  56           HA       ARG  56  -3.185   8.956  -5.047
  437    HB2  ARG  56           1HB      ARG  56  -3.031   6.932  -7.290
  438    HB3  ARG  56           2HB      ARG  56  -4.152   8.286  -7.239
  439    HG2  ARG  56           1HG      ARG  56  -2.302   9.852  -7.271
  440    HG3  ARG  56           2HG      ARG  56  -1.151   8.516  -7.245
  441    HD2  ARG  56           1HD      ARG  56  -2.022   7.739  -9.404
  442    HD3  ARG  56           2HD      ARG  56  -3.149   9.096  -9.430
  443    HE   ARG  56           HE       ARG  56  -0.796  10.347  -9.163
  444   HH11  ARG  56          1HH1      ARG  56  -1.871   7.870 -11.403
  445   HH12  ARG  56          2HH1      ARG  56  -0.748   8.345 -12.649
  446   HH21  ARG  56          1HH2      ARG  56   0.662  10.959 -10.781
  447   HH22  ARG  56          2HH2      ARG  56   0.710  10.081 -12.278
  448    H    LEU  57           H        LEU  57  -3.357   5.422  -5.309
  449    HA   LEU  57           HA       LEU  57  -6.113   5.128  -4.953
  450    HB2  LEU  57           1HB      LEU  57  -3.857   3.288  -4.162
  451    HB3  LEU  57           2HB      LEU  57  -5.548   2.827  -4.177
  452    HG   LEU  57           HG       LEU  57  -4.089   3.782  -6.637
  453   HD11  LEU  57          1HD1      LEU  57  -3.910   1.434  -7.275
  454   HD12  LEU  57          2HD1      LEU  57  -4.576   0.953  -5.715
  455   HD13  LEU  57          3HD1      LEU  57  -3.011   1.762  -5.793
  456   HD21  LEU  57          3HD2      LEU  57  -6.675   2.275  -6.255
  457   HD22  LEU  57          1HD2      LEU  57  -5.953   2.715  -7.803
  458   HD23  LEU  57          2HD2      LEU  57  -6.524   3.973  -6.707
  459    H    CYS  58           H        CYS  58  -3.503   5.334  -2.584
  460    HA   CYS  58           HA       CYS  58  -5.083   4.738  -0.327
  461    HB2  CYS  58           1HB      CYS  58  -2.520   6.323  -0.525
  462    HB3  CYS  58           2HB      CYS  58  -3.234   5.741   0.974
  463    HG   CYS  58           HG       CYS  58  -1.710   3.956  -1.484
  464    H    ARG  59           H        ARG  59  -4.127   7.870  -1.759
  465    HA   ARG  59           HA       ARG  59  -5.436   9.372   0.278
  466    HB2  ARG  59           1HB      ARG  59  -4.542  10.255  -2.469
  467    HB3  ARG  59           2HB      ARG  59  -5.055  11.327  -1.173
  468    HG2  ARG  59           1HG      ARG  59  -3.155  10.052   0.146
  469    HG3  ARG  59           2HG      ARG  59  -2.540   9.789  -1.486
  470    HD2  ARG  59           1HD      ARG  59  -3.174  12.446  -0.208
  471    HD3  ARG  59           2HD      ARG  59  -1.570  11.794  -0.526
  472    HE   ARG  59           HE       ARG  59  -2.905  11.879  -2.967
  473   HH11  ARG  59          1HH1      ARG  59  -1.744  14.116  -0.522
  474   HH12  ARG  59          2HH1      ARG  59  -1.565  15.440  -1.635
  475   HH21  ARG  59          1HH2      ARG  59  -2.663  13.623  -4.430
  476   HH22  ARG  59          2HH2      ARG  59  -2.085  15.158  -3.857
  477    H    ALA  60           H        ALA  60  -6.411   8.143  -2.860
  478    HA   ALA  60           HA       ALA  60  -8.827   9.573  -3.109
  479    HB1  ALA  60           3HB      ALA  60  -8.187   6.796  -4.109
  480    HB2  ALA  60           1HB      ALA  60  -7.828   8.303  -4.954
  481    HB3  ALA  60           2HB      ALA  60  -9.503   7.827  -4.671
  482    H    SER  61           H        SER  61  -8.075   6.460  -1.597
  483    HA   SER  61           HA       SER  61 -10.692   5.799  -0.825
  484    HB2  SER  61           1HB      SER  61  -8.097   5.040   0.533
  485    HB3  SER  61           2HB      SER  61  -9.645   4.210   0.706
  486    HG   SER  61           HG       SER  61  -7.891   4.288  -1.494
  487    H    LEU  62           H        LEU  62  -8.224   7.788   0.698
  488    HA   LEU  62           HA       LEU  62  -9.499   8.039   3.216
  489    HB2  LEU  62           1HB      LEU  62  -7.445   9.742   1.820
  490    HB3  LEU  62           2HB      LEU  62  -8.016  10.078   3.443
  491    HG   LEU  62           HG       LEU  62  -6.623   7.539   2.588
  492   HD11  LEU  62          1HD1      LEU  62  -5.120   9.457   2.554
  493   HD12  LEU  62          2HD1      LEU  62  -4.743   8.383   3.902
  494   HD13  LEU  62          3HD1      LEU  62  -5.619   9.887   4.190
  495   HD21  LEU  62          3HD2      LEU  62  -8.186   7.186   4.425
  496   HD22  LEU  62          1HD2      LEU  62  -7.464   8.529   5.311
  497   HD23  LEU  62          2HD2      LEU  62  -6.519   7.074   4.990
  498    H    MET  63           H        MET  63 -10.169   9.439   0.171
  499    HA   MET  63           HA       MET  63 -11.722  11.604   1.385
  500    HB2  MET  63           1HB      MET  63 -11.043  10.994  -1.494
  501    HB3  MET  63           2HB      MET  63 -12.090  12.315  -0.994
  502    HG2  MET  63           1HG      MET  63 -10.241  13.290   0.278
  503    HG3  MET  63           2HG      MET  63  -9.195  11.972  -0.245
  504    HE1  MET  63           3HE      MET  63 -10.145  11.545  -3.242
  505    HE2  MET  63           1HE      MET  63  -8.445  11.590  -2.772
  506    HE3  MET  63           2HE      MET  63  -9.016  12.582  -4.114
  507    H    GLY  64           H        GLY  64 -12.113   8.429   0.471
  508    HA2  GLY  64           1HA      GLY  64 -14.142   7.255   0.797
  509    HA3  GLY  64           2HA      GLY  64 -15.025   8.744   0.495
  510    H    ASP  65           H        ASP  65 -12.601   8.387  -1.772
  511    HA   ASP  65           HA       ASP  65 -14.410   8.030  -3.919
  512    HB2  ASP  65           1HB      ASP  65 -11.403   7.954  -3.748
  513    HB3  ASP  65           2HB      ASP  65 -12.259   7.701  -5.264
  514    H    VAL  66           H        VAL  66 -12.481   5.845  -2.046
  515    HA   VAL  66           HA       VAL  66 -13.382   3.616  -3.743
  516    HB   VAL  66           HB       VAL  66 -10.816   3.725  -2.142
  517   HG11  VAL  66          1HG1      VAL  66 -11.839   1.674  -4.102
  518   HG12  VAL  66          2HG1      VAL  66 -11.725   1.477  -2.356
  519   HG13  VAL  66          3HG1      VAL  66 -10.260   1.653  -3.319
  520   HG21  VAL  66          3HG2      VAL  66 -11.215   3.934  -5.127
  521   HG22  VAL  66          1HG2      VAL  66  -9.662   3.835  -4.298
  522   HG23  VAL  66          2HG2      VAL  66 -10.703   5.237  -4.054
  523    H    ALA  67           H        ALA  67 -14.417   1.985  -2.747
  524    HA   ALA  67           HA       ALA  67 -15.237   2.373  -0.009
  525    HB1  ALA  67           3HB      ALA  67 -16.812   1.676  -1.755
  526    HB2  ALA  67           1HB      ALA  67 -16.755   0.527  -0.419
  527    HB3  ALA  67           2HB      ALA  67 -15.930   0.160  -1.935
  528    H    GLY  68           H        GLY  68 -12.403   1.499  -0.695
  529    HA2  GLY  68           1HA      GLY  68 -10.897   0.403   0.717
  530    HA3  GLY  68           2HA      GLY  68 -12.241  -0.469   1.435
  531    H    GLU  69           H        GLU  69 -13.384  -1.614  -0.806
  532    HA   GLU  69           HA       GLU  69 -11.947  -3.970  -1.070
  533    HB2  GLU  69           1HB      GLU  69 -14.035  -2.806  -2.918
  534    HB3  GLU  69           2HB      GLU  69 -13.466  -4.466  -2.987
  535    HG2  GLU  69           1HG      GLU  69 -14.369  -4.933  -0.823
  536    HG3  GLU  69           2HG      GLU  69 -14.778  -3.235  -0.578
  537    H    ILE  70           H        ILE  70 -12.421  -1.586  -3.673
  538    HA   ILE  70           HA       ILE  70 -10.653  -2.711  -5.499
  539    HB   ILE  70           HB       ILE  70 -11.337   0.217  -5.173
  540   HG12  ILE  70          1HG1      ILE  70 -12.639  -1.913  -6.888
  541   HG13  ILE  70          2HG1      ILE  70 -13.321  -1.239  -5.410
  542   HG21  ILE  70          1HG2      ILE  70 -10.273  -1.280  -7.565
  543   HG22  ILE  70          2HG2      ILE  70  -9.388  -0.108  -6.589
  544   HG23  ILE  70          3HG2      ILE  70 -10.775   0.411  -7.549
  545   HD11  ILE  70          3HD1      ILE  70 -14.331  -0.255  -7.389
  546   HD12  ILE  70          1HD1      ILE  70 -12.746   0.288  -7.940
  547   HD13  ILE  70          2HD1      ILE  70 -13.442   0.955  -6.464
  548    H    ALA  71           H        ALA  71 -10.067  -0.475  -2.860
  549    HA   ALA  71           HA       ALA  71  -7.416   0.211  -3.589
  550    HB1  ALA  71           3HB      ALA  71  -8.771   1.603  -2.099
  551    HB2  ALA  71           1HB      ALA  71  -7.240   1.148  -1.349
  552    HB3  ALA  71           2HB      ALA  71  -8.731   0.332  -0.877
  553    H    ARG  72           H        ARG  72  -8.826  -2.362  -1.627
  554    HA   ARG  72           HA       ARG  72  -6.408  -3.147  -0.373
  555    HB2  ARG  72           1HB      ARG  72  -8.679  -3.744   0.451
  556    HB3  ARG  72           2HB      ARG  72  -8.856  -4.835  -0.916
  557    HG2  ARG  72           1HG      ARG  72  -6.947  -6.142  -0.111
  558    HG3  ARG  72           2HG      ARG  72  -6.797  -5.055   1.272
  559    HD2  ARG  72           1HD      ARG  72  -9.058  -5.670   1.989
  560    HD3  ARG  72           2HD      ARG  72  -9.193  -6.765   0.614
  561    HE   ARG  72           HE       ARG  72  -7.040  -7.176   2.563
  562   HH11  ARG  72          1HH1      ARG  72 -10.039  -8.232   1.110
  563   HH12  ARG  72          2HH1      ARG  72  -9.938  -9.843   1.759
  564   HH21  ARG  72          1HH2      ARG  72  -6.907  -9.282   3.436
  565   HH22  ARG  72          2HH2      ARG  72  -8.163 -10.438   3.096
  566    H    THR  73           H        THR  73  -8.104  -4.377  -3.259
  567    HA   THR  73           HA       THR  73  -6.202  -6.417  -3.767
  568    HB   THR  73           HB       THR  73  -7.320  -6.440  -6.050
  569    HG1  THR  73           HG1      THR  73  -9.160  -5.176  -6.294
  570   HG21  THR  73          3HG2      THR  73  -9.066  -6.685  -3.601
  571   HG22  THR  73          1HG2      THR  73  -7.993  -7.934  -4.237
  572   HG23  THR  73          2HG2      THR  73  -9.394  -7.413  -5.174
  573    H    ALA  74           H        ALA  74  -6.697  -3.148  -5.036
  574    HA   ALA  74           HA       ALA  74  -4.656  -3.256  -6.984
  575    HB1  ALA  74           3HB      ALA  74  -6.459  -1.603  -7.030
  576    HB2  ALA  74           1HB      ALA  74  -4.870  -0.841  -7.094
  577    HB3  ALA  74           2HB      ALA  74  -5.789  -0.838  -5.589
  578    H    PHE  75           H        PHE  75  -4.657  -2.361  -3.576
  579    HA   PHE  75           HA       PHE  75  -2.077  -1.241  -3.473
  580    HB2  PHE  75           1HB      PHE  75  -3.821  -1.107  -1.658
  581    HB3  PHE  75           2HB      PHE  75  -3.438  -2.777  -1.251
  582    HD1  PHE  75           HD2      PHE  75  -1.311  -3.346  -0.211
  583    HD2  PHE  75           HD1      PHE  75  -2.316   0.683  -1.139
  584    HE1  PHE  75           HE2      PHE  75   0.512  -2.562   1.239
  585    HE2  PHE  75           HE1      PHE  75  -0.500   1.475   0.315
  586    HZ   PHE  75           HZ       PHE  75   0.917  -0.143   1.505
  587    H    VAL  76           H        VAL  76  -3.225  -4.560  -2.971
  588    HA   VAL  76           HA       VAL  76  -0.755  -5.737  -2.370
  589    HB   VAL  76           HB       VAL  76  -3.137  -6.962  -3.780
  590   HG11  VAL  76          1HG1      VAL  76  -0.797  -8.306  -2.427
  591   HG12  VAL  76          2HG1      VAL  76  -1.141  -8.300  -4.157
  592   HG13  VAL  76          3HG1      VAL  76  -2.234  -9.122  -3.045
  593   HG21  VAL  76          3HG2      VAL  76  -2.340  -6.961  -0.871
  594   HG22  VAL  76          1HG2      VAL  76  -3.702  -7.843  -1.560
  595   HG23  VAL  76          2HG2      VAL  76  -3.691  -6.079  -1.583
  596    H    ALA  77           H        ALA  77  -2.321  -5.062  -5.459
  597    HA   ALA  77           HA       ALA  77  -0.462  -6.393  -7.108
  598    HB1  ALA  77           3HB      ALA  77  -1.409  -5.095  -8.932
  599    HB2  ALA  77           1HB      ALA  77  -2.189  -4.015  -7.777
  600    HB3  ALA  77           2HB      ALA  77  -2.682  -5.705  -7.875
  601    H    ALA  78           H        ALA  78  -0.620  -3.033  -5.974
  602    HA   ALA  78           HA       ALA  78   1.653  -2.150  -7.438
  603    HB1  ALA  78           3HB      ALA  78   0.433  -0.981  -4.940
  604    HB2  ALA  78           1HB      ALA  78  -0.057  -0.613  -6.595
  605    HB3  ALA  78           2HB      ALA  78   1.553  -0.167  -6.032
  606    H    SER  79           H        SER  79   1.220  -3.651  -4.321
  607    HA   SER  79           HA       SER  79   3.806  -2.996  -3.307
  608    HB2  SER  79           1HB      SER  79   1.852  -5.119  -2.400
  609    HB3  SER  79           2HB      SER  79   3.250  -4.549  -1.487
  610    HG   SER  79           HG       SER  79   0.933  -3.086  -2.223
  611    H    ARG  80           H        ARG  80   2.953  -5.048  -5.759
  612    HA   ARG  80           HA       ARG  80   4.481  -7.356  -5.174
  613    HB2  ARG  80           1HB      ARG  80   4.051  -8.059  -7.343
  614    HB3  ARG  80           2HB      ARG  80   2.698  -6.987  -7.021
  615    HG2  ARG  80           1HG      ARG  80   3.897  -5.189  -8.237
  616    HG3  ARG  80           2HG      ARG  80   5.151  -6.362  -8.650
  617    HD2  ARG  80           1HD      ARG  80   3.243  -7.779  -9.606
  618    HD3  ARG  80           2HD      ARG  80   2.270  -6.315  -9.497
  619    HE   ARG  80           HE       ARG  80   4.801  -6.192 -10.971
  620   HH11  ARG  80          1HH1      ARG  80   1.305  -6.182 -10.985
  621   HH12  ARG  80          2HH1      ARG  80   1.175  -5.738 -12.658
  622   HH21  ARG  80          1HH2      ARG  80   4.644  -5.605 -13.179
  623   HH22  ARG  80          2HH2      ARG  80   3.082  -5.415 -13.907
  624    H    GLN  81           H        GLN  81   5.412  -4.193  -5.920
  625    HA   GLN  81           HA       GLN  81   7.847  -4.489  -7.242
  626    HB2  GLN  81           1HB      GLN  81   7.039  -2.540  -5.079
  627    HB3  GLN  81           2HB      GLN  81   8.525  -2.410  -6.006
  628    HG2  GLN  81           1HG      GLN  81   7.237  -2.164  -8.054
  629    HG3  GLN  81           2HG      GLN  81   5.739  -2.315  -7.134
  630   HE21  GLN  81          2HE2      GLN  81   6.814  -0.124  -8.786
  631   HE22  GLN  81          1HE2      GLN  81   6.814   1.265  -7.756
  632    H    ALA  82           H        ALA  82   6.991  -4.990  -3.877
  633    HA   ALA  82           HA       ALA  82   9.663  -5.193  -2.909
  634    HB1  ALA  82           3HB      ALA  82   7.786  -4.580  -1.460
  635    HB2  ALA  82           1HB      ALA  82   8.647  -5.991  -0.846
  636    HB3  ALA  82           2HB      ALA  82   7.101  -6.191  -1.671
  637    H    HIS  83           H        HIS  83   7.654  -7.291  -4.665
  638    HA   HIS  83           HA       HIS  83   7.775  -9.466  -5.296
  639    HB2  HIS  83           1HB      HIS  83  10.640  -8.928  -4.560
  640    HB3  HIS  83           2HB      HIS  83  10.129 -10.525  -5.098
  641    HD1  HIS  83           HD1      HIS  83  11.727  -7.767  -6.455
  642    HD2  HIS  83           HD2      HIS  83   8.453 -10.017  -7.681
  643    HE1  HIS  83           HE1      HIS  83  11.525  -7.379  -8.930
  644    HE2  HIS  83           HE2      HIS  83   9.733  -8.989  -9.672
  645    H    CYS  84           H        CYS  84   6.836  -8.929  -2.692
  646    HA   CYS  84           HA       CYS  84   7.013 -11.553  -1.581
  647    HB2  CYS  84           1HB      CYS  84   9.053 -10.385  -0.644
  648    HB3  CYS  84           2HB      CYS  84   7.957  -9.267   0.161
  649    HG   CYS  84           HG       CYS  84   8.129 -12.642   0.719
  650    H    LEU  85           H        LEU  85   4.856 -11.698  -1.722
  651    HA   LEU  85           HA       LEU  85   3.272  -9.834  -0.073
  652    HB2  LEU  85           1HB      LEU  85   2.388 -11.337  -2.547
  653    HB3  LEU  85           2HB      LEU  85   1.376 -10.290  -1.572
  654    HG   LEU  85           HG       LEU  85   3.801  -9.359  -3.108
  655   HD11  LEU  85          1HD1      LEU  85   2.198  -8.368  -4.662
  656   HD12  LEU  85          2HD1      LEU  85   0.871  -9.122  -3.779
  657   HD13  LEU  85          3HD1      LEU  85   2.052 -10.125  -4.622
  658   HD21  LEU  85          3HD2      LEU  85   2.902  -7.126  -2.662
  659   HD22  LEU  85          1HD2      LEU  85   3.284  -7.981  -1.166
  660   HD23  LEU  85          2HD2      LEU  85   1.608  -7.841  -1.699
  661    H    MET  86           H        MET  86   1.070 -11.015   0.527
  662    HA   MET  86           HA       MET  86   1.668 -13.438   1.867
  663    HB2  MET  86           1HB      MET  86  -0.888 -11.993   1.279
  664    HB3  MET  86           2HB      MET  86  -0.923 -13.605   1.981
  665    HG2  MET  86           1HG      MET  86   0.629 -12.676   3.769
  666    HG3  MET  86           2HG      MET  86   0.206 -11.083   3.140
  667    HE1  MET  86           3HE      MET  86  -1.099 -14.351   4.868
  668    HE2  MET  86           1HE      MET  86  -2.068 -14.302   3.394
  669    HE3  MET  86           2HE      MET  86  -2.834 -14.046   4.962
  670    H    GLU  87           H        GLU  87   0.285 -12.706  -1.268
  671    HA   GLU  87           HA       GLU  87   0.204 -15.555  -1.902
  672    HB2  GLU  87           1HB      GLU  87  -0.640 -13.132  -3.504
  673    HB3  GLU  87           2HB      GLU  87  -0.667 -14.773  -4.130
  674    HG2  GLU  87           1HG      GLU  87  -2.224 -15.373  -2.275
  675    HG3  GLU  87           2HG      GLU  87  -2.292 -13.660  -1.859
  676    H    ASP  88           H        ASP  88   2.581 -15.491  -1.483
  677    HA   ASP  88           HA       ASP  88   3.977 -15.013  -4.006
  678    HB2  ASP  88           1HB      ASP  88   4.409 -13.055  -2.530
  679    HB3  ASP  88           2HB      ASP  88   5.071 -14.149  -1.319
  680    H    LYS  89           H        LYS  89   5.316 -16.624  -4.536
  681    HA   LYS  89           HA       LYS  89   5.608 -18.785  -2.578
  682    HB2  LYS  89           1HB      LYS  89   5.839 -18.764  -5.587
  683    HB3  LYS  89           2HB      LYS  89   6.238 -20.159  -4.592
  684    HG2  LYS  89           1HG      LYS  89   3.932 -20.181  -3.737
  685    HG3  LYS  89           2HG      LYS  89   3.546 -18.826  -4.800
  686    HD2  LYS  89           1HD      LYS  89   3.998 -20.161  -6.750
  687    HD3  LYS  89           2HD      LYS  89   4.582 -21.495  -5.750
  688    HE2  LYS  89           1HE      LYS  89   2.341 -21.985  -6.473
  689    HE3  LYS  89           2HE      LYS  89   2.328 -21.665  -4.740
  690    HZ1  LYS  89           3HZ      LYS  89   1.761 -19.266  -5.511
  691    HZ2  LYS  89           1HZ      LYS  89   0.542 -20.447  -5.470
  692    HZ3  LYS  89           2HZ      LYS  89   1.270 -20.029  -6.941
  693    H    ALA  90           H        ALA  90   7.460 -18.942  -1.549
  694    HA   ALA  90           HA       ALA  90   9.843 -17.615  -2.294
  695    HB1  ALA  90           3HB      ALA  90  10.898 -18.916  -0.513
  696    HB2  ALA  90           1HB      ALA  90   9.470 -19.947  -0.415
  697    HB3  ALA  90           2HB      ALA  90   9.358 -18.242   0.020
  698    H    GLU  91           H        GLU  91   8.453 -20.661  -3.094
  699    HA   GLU  91           HA       GLU  91  10.771 -21.905  -4.190
  700    HB2  GLU  91           1HB      GLU  91   7.881 -22.387  -4.942
  701    HB3  GLU  91           2HB      GLU  91   9.227 -23.501  -5.132
  702    HG2  GLU  91           1HG      GLU  91   8.077 -22.560  -2.516
  703    HG3  GLU  91           2HG      GLU  91   7.788 -24.125  -3.272
  704    H    ALA  92           H        ALA  92  11.268 -22.132  -6.453
  705    HA   ALA  92           HA       ALA  92  10.204 -19.903  -8.056
  706    HB1  ALA  92           3HB      ALA  92  12.890 -21.245  -8.277
  707    HB2  ALA  92           1HB      ALA  92  12.577 -19.675  -7.539
  708    HB3  ALA  92           2HB      ALA  92  12.314 -19.905  -9.268
  709    HA   PRO  93           HA       PRO  93   8.681 -23.436 -10.447
  710    HB2  PRO  93           1HB      PRO  93   6.757 -21.541 -11.513
  711    HB3  PRO  93           2HB      PRO  93   6.465 -22.963 -10.509
  712    HG2  PRO  93           1HG      PRO  93   6.099 -20.410  -9.629
  713    HG3  PRO  93           2HG      PRO  93   6.522 -21.760  -8.561
  714    HD2  PRO  93           1HD      PRO  93   8.282 -19.625  -9.710
  715    HD3  PRO  93           2HD      PRO  93   8.282 -20.330  -8.077
  716    H    ASN  94           H        ASN  94   8.807 -23.881 -12.658
  717    HA   ASN  94           HA       ASN  94  10.271 -21.858 -14.205
  718    HB2  ASN  94           1HB      ASN  94  10.001 -24.844 -14.633
  719    HB3  ASN  94           2HB      ASN  94  10.892 -23.756 -15.693
  720   HD21  ASN  94          2HD2      ASN  94  11.810 -22.153 -13.371
  721   HD22  ASN  94          1HD2      ASN  94  13.073 -23.083 -12.644
  722    H    THR  95           H        THR  95   7.471 -23.973 -14.266
  723    HA   THR  95           HA       THR  95   6.515 -22.621 -16.682
  724    HB   THR  95           HB       THR  95   4.617 -24.334 -16.459
  725    HG1  THR  95           HG1      THR  95   4.762 -25.372 -14.596
  726   HG21  THR  95          3HG2      THR  95   7.426 -25.310 -16.989
  727   HG22  THR  95          1HG2      THR  95   6.379 -24.493 -18.149
  728   HG23  THR  95          2HG2      THR  95   5.943 -26.089 -17.540
  729    H    ILE  96           H        ILE  96   5.328 -20.873 -16.386
  730    HA   ILE  96           HA       ILE  96   3.749 -20.643 -13.909
  731    HB   ILE  96           HB       ILE  96   5.234 -18.392 -15.281
  732   HG12  ILE  96          1HG1      ILE  96   5.803 -19.744 -12.630
  733   HG13  ILE  96          2HG1      ILE  96   6.729 -19.991 -14.107
  734   HG21  ILE  96          1HG2      ILE  96   3.174 -17.647 -14.224
  735   HG22  ILE  96          2HG2      ILE  96   4.573 -17.068 -13.320
  736   HG23  ILE  96          3HG2      ILE  96   3.641 -18.438 -12.718
  737   HD11  ILE  96          3HD1      ILE  96   7.378 -17.639 -14.090
  738   HD12  ILE  96          1HD1      ILE  96   7.856 -18.457 -12.603
  739   HD13  ILE  96          2HD1      ILE  96   6.450 -17.394 -12.611
  740    H    ALA  97           H        ALA  97   1.731 -20.952 -14.626
  741    HA   ALA  97           HA       ALA  97   0.789 -19.751 -17.083
  742    HB1  ALA  97           3HB      ALA  97  -0.730 -21.212 -14.920
  743    HB2  ALA  97           1HB      ALA  97  -0.062 -21.936 -16.382
  744    HB3  ALA  97           2HB      ALA  97  -1.364 -20.752 -16.500
  745    H    SER  98           H        SER  98   0.832 -17.557 -16.916
  746    HA   SER  98           HA       SER  98   0.102 -16.204 -14.505
  747    HB2  SER  98           1HB      SER  98   0.311 -14.144 -16.004
  748    HB3  SER  98           2HB      SER  98   1.758 -15.130 -15.805
  749    HG   SER  98           HG       SER  98   1.749 -15.512 -17.864
  750    H    GLY  99           H        GLY  99  -1.861 -15.796 -13.832
  751    HA2  GLY  99           1HA      GLY  99  -3.954 -15.230 -15.823
  752    HA3  GLY  99           2HA      GLY  99  -4.250 -16.410 -14.553
  753    H    SER 100           H        SER 100  -5.720 -15.486 -13.302
  754    HA   SER 100           HA       SER 100  -6.674 -14.117 -11.781
  755    HB2  SER 100           1HB      SER 100  -3.892 -12.957 -11.493
  756    HB3  SER 100           2HB      SER 100  -5.217 -12.787 -10.338
  757    HG   SER 100           HG       SER 100  -5.189 -15.150 -10.234
  Start of MODEL   19
    1    H1   MET   1           1H       MET   1 -11.787  13.373  -3.465
    2    H2   MET   1           2H       MET   1 -10.920  12.455  -4.579
    3    H3   MET   1           3H       MET   1 -12.559  12.128  -4.319
    4    HA   MET   1           HA       MET   1 -12.303  13.303  -6.374
    5    HB2  MET   1           1HB      MET   1 -13.376  15.096  -4.175
    6    HB3  MET   1           2HB      MET   1 -13.718  15.276  -5.890
    7    HG2  MET   1           1HG      MET   1 -14.859  13.144  -5.916
    8    HG3  MET   1           2HG      MET   1 -14.458  12.888  -4.218
    9    HE1  MET   1           3HE      MET   1 -16.995  12.408  -3.655
   10    HE2  MET   1           1HE      MET   1 -17.422  12.646  -5.348
   11    HE3  MET   1           2HE      MET   1 -18.319  13.491  -4.087
   12    H    GLU   2           H        GLU   2 -12.002  15.725  -7.138
   13    HA   GLU   2           HA       GLU   2  -9.279  16.394  -6.915
   14    HB2  GLU   2           1HB      GLU   2 -10.612  17.074  -8.828
   15    HB3  GLU   2           2HB      GLU   2 -11.646  18.055  -7.801
   16    HG2  GLU   2           1HG      GLU   2  -9.760  19.522  -7.303
   17    HG3  GLU   2           2HG      GLU   2  -8.724  18.533  -8.332
   18    H    VAL   3           H        VAL   3 -12.159  17.768  -5.409
   19    HA   VAL   3           HA       VAL   3 -10.641  19.565  -3.749
   20    HB   VAL   3           HB       VAL   3 -13.563  18.811  -3.560
   21   HG11  VAL   3          1HG1      VAL   3 -12.032  21.146  -2.423
   22   HG12  VAL   3          2HG1      VAL   3 -12.739  19.811  -1.514
   23   HG13  VAL   3          3HG1      VAL   3 -13.784  20.950  -2.361
   24   HG21  VAL   3          3HG2      VAL   3 -13.986  20.889  -4.799
   25   HG22  VAL   3          1HG2      VAL   3 -13.062  19.725  -5.751
   26   HG23  VAL   3          2HG2      VAL   3 -12.247  21.101  -5.009
   27    H    GLN   4           H        GLN   4  -9.494  18.769  -2.119
   28    HA   GLN   4           HA       GLN   4 -10.694  16.641  -0.483
   29    HB2  GLN   4           1HB      GLN   4  -7.793  17.369  -0.892
   30    HB3  GLN   4           2HB      GLN   4  -8.351  16.232   0.326
   31    HG2  GLN   4           1HG      GLN   4  -9.348  14.867  -1.493
   32    HG3  GLN   4           2HG      GLN   4  -8.603  15.963  -2.657
   33   HE21  GLN   4          2HE2      GLN   4  -8.201  13.097  -2.167
   34   HE22  GLN   4          1HE2      GLN   4  -6.513  12.908  -1.874
   35    H    SER   5           H        SER   5 -10.668  16.848   1.753
   36    HA   SER   5           HA       SER   5 -10.796  19.546   2.716
   37    HB2  SER   5           1HB      SER   5 -11.267  18.294   4.921
   38    HB3  SER   5           2HB      SER   5 -12.431  18.089   3.612
   39    HG   SER   5           HG       SER   5 -10.553  16.275   4.649
   40    H    MET   6           H        MET   6  -9.437  20.484   4.275
   41    HA   MET   6           HA       MET   6  -6.706  19.748   4.154
   42    HB2  MET   6           1HB      MET   6  -7.580  22.065   4.596
   43    HB3  MET   6           2HB      MET   6  -8.015  21.531   6.215
   44    HG2  MET   6           1HG      MET   6  -5.700  21.077   6.727
   45    HG3  MET   6           2HG      MET   6  -5.229  21.492   5.081
   46    HE1  MET   6           3HE      MET   6  -3.764  22.776   7.536
   47    HE2  MET   6           1HE      MET   6  -3.700  24.467   7.040
   48    HE3  MET   6           2HE      MET   6  -3.422  23.190   5.857
   49    H    LEU   7           H        LEU   7  -9.328  18.964   6.276
   50    HA   LEU   7           HA       LEU   7  -7.611  17.523   8.126
   51    HB2  LEU   7           1HB      LEU   7  -9.615  18.692   8.958
   52    HB3  LEU   7           2HB      LEU   7 -10.625  17.687   7.936
   53    HG   LEU   7           HG       LEU   7  -9.890  15.696   9.214
   54   HD11  LEU   7          1HD1      LEU   7  -7.735  16.485   9.979
   55   HD12  LEU   7          2HD1      LEU   7  -8.738  16.036  11.360
   56   HD13  LEU   7          3HD1      LEU   7  -8.508  17.737  10.951
   57   HD21  LEU   7          3HD2      LEU   7 -11.968  16.834   9.783
   58   HD22  LEU   7          1HD2      LEU   7 -11.093  17.911  10.872
   59   HD23  LEU   7          2HD2      LEU   7 -11.190  16.186  11.226
   60    H    LEU   8           H        LEU   8  -6.939  15.527   7.691
   61    HA   LEU   8           HA       LEU   8  -8.086  14.009   5.529
   62    HB2  LEU   8           1HB      LEU   8  -5.893  13.312   7.484
   63    HB3  LEU   8           2HB      LEU   8  -6.347  12.337   6.099
   64    HG   LEU   8           HG       LEU   8  -5.204  15.131   5.984
   65   HD11  LEU   8          1HD1      LEU   8  -3.555  13.487   6.665
   66   HD12  LEU   8          2HD1      LEU   8  -3.241  14.031   5.017
   67   HD13  LEU   8          3HD1      LEU   8  -3.988  12.458   5.300
   68   HD21  LEU   8          3HD2      LEU   8  -5.920  13.211   3.767
   69   HD22  LEU   8          1HD2      LEU   8  -5.084  14.750   3.565
   70   HD23  LEU   8          2HD2      LEU   8  -6.748  14.721   4.145
   71    H    ASN   9           H        ASN   9  -9.127  12.017   5.687
   72    HA   ASN   9           HA       ASN   9 -10.590  11.725   8.206
   73    HB2  ASN   9           1HB      ASN   9 -11.229  10.531   5.499
   74    HB3  ASN   9           2HB      ASN   9 -12.269  10.527   6.919
   75   HD21  ASN   9          2HD2      ASN   9 -11.081  12.336   4.246
   76   HD22  ASN   9          1HD2      ASN   9 -12.082  13.729   4.463
   77    H    ASP  10           H        ASP  10 -10.664   9.847   9.343
   78    HA   ASP  10           HA       ASP  10  -8.569   7.926   8.819
   79    HB2  ASP  10           1HB      ASP  10 -10.615   8.161  11.030
   80    HB3  ASP  10           2HB      ASP  10  -9.467   6.832  10.924
   81    H    VAL  11           H        VAL  11  -9.087   6.764   7.040
   82    HA   VAL  11           HA       VAL  11 -11.714   5.491   6.931
   83    HB   VAL  11           HB       VAL  11  -9.559   5.611   4.813
   84   HG11  VAL  11          1HG1      VAL  11 -10.987   3.649   4.562
   85   HG12  VAL  11          2HG1      VAL  11 -11.311   4.824   3.287
   86   HG13  VAL  11          3HG1      VAL  11 -12.424   4.669   4.647
   87   HG21  VAL  11          3HG2      VAL  11 -11.034   7.231   3.710
   88   HG22  VAL  11          1HG2      VAL  11 -10.483   7.809   5.283
   89   HG23  VAL  11          2HG2      VAL  11 -12.119   7.178   5.098
   90    H    LYS  12           H        LYS  12 -11.818   3.626   7.948
   91    HA   LYS  12           HA       LYS  12  -9.531   1.896   8.223
   92    HB2  LYS  12           1HB      LYS  12 -11.091   2.094  10.081
   93    HB3  LYS  12           2HB      LYS  12 -12.423   1.577   9.058
   94    HG2  LYS  12           1HG      LYS  12 -11.298  -0.616   8.791
   95    HG3  LYS  12           2HG      LYS  12 -10.076  -0.084   9.946
   96    HD2  LYS  12           1HD      LYS  12 -11.746   0.149  11.671
   97    HD3  LYS  12           2HD      LYS  12 -13.031  -0.228  10.522
   98    HE2  LYS  12           1HE      LYS  12 -10.809  -2.083  11.367
   99    HE3  LYS  12           2HE      LYS  12 -12.481  -2.158  11.919
  100    HZ1  LYS  12           3HZ      LYS  12 -12.193  -3.758  10.199
  101    HZ2  LYS  12           1HZ      LYS  12 -11.490  -2.617   9.157
  102    HZ3  LYS  12           2HZ      LYS  12 -13.129  -2.494   9.559
  103    H    TRP  13           H        TRP  13  -9.287  -0.141   7.287
  104    HA   TRP  13           HA       TRP  13 -10.609  -0.477   4.744
  105    HB2  TRP  13           1HB      TRP  13  -8.185  -1.452   6.003
  106    HB3  TRP  13           2HB      TRP  13  -9.081  -2.762   5.238
  107    HD1  TRP  13           HD1      TRP  13 -10.114  -1.541   2.641
  108    HE1  TRP  13           HE1      TRP  13  -8.530  -0.716   0.797
  109    HE3  TRP  13           HE3      TRP  13  -5.903  -0.855   5.449
  110    HZ2  TRP  13           HZ2      TRP  13  -5.841   0.112   0.556
  111    HZ3  TRP  13           HZ3      TRP  13  -3.864  -0.046   4.334
  112    HH2  TRP  13           HH2      TRP  13  -3.834   0.427   1.938
  113    H    GLU  14           H        GLU  14 -11.992  -2.089   4.164
  114    HA   GLU  14           HA       GLU  14 -13.700  -3.264   6.062
  115    HB2  GLU  14           1HB      GLU  14 -13.125  -4.301   3.278
  116    HB3  GLU  14           2HB      GLU  14 -14.588  -4.549   4.216
  117    HG2  GLU  14           1HG      GLU  14 -15.193  -2.244   4.001
  118    HG3  GLU  14           2HG      GLU  14 -13.648  -1.868   3.235
  119    H    LYS  15           H        LYS  15 -11.075  -4.581   4.137
  120    HA   LYS  15           HA       LYS  15 -10.633  -6.652   6.162
  121    HB2  LYS  15           1HB      LYS  15 -10.679  -6.914   3.159
  122    HB3  LYS  15           2HB      LYS  15  -9.813  -8.066   4.169
  123    HG2  LYS  15           1HG      LYS  15 -11.709  -9.008   4.973
  124    HG3  LYS  15           2HG      LYS  15 -12.619  -7.499   4.907
  125    HD2  LYS  15           1HD      LYS  15 -11.818  -9.014   2.434
  126    HD3  LYS  15           2HD      LYS  15 -13.324  -9.335   3.296
  127    HE2  LYS  15           1HE      LYS  15 -13.902  -6.921   3.037
  128    HE3  LYS  15           2HE      LYS  15 -12.470  -6.738   2.027
  129    HZ1  LYS  15           3HZ      LYS  15 -13.378  -8.288   0.449
  130    HZ2  LYS  15           1HZ      LYS  15 -14.515  -7.062   0.736
  131    HZ3  LYS  15           2HZ      LYS  15 -14.725  -8.583   1.445
  132    HA   PRO  16           HA       PRO  16  -6.927  -4.098   6.359
  133    HB2  PRO  16           1HB      PRO  16  -6.215  -6.380   8.142
  134    HB3  PRO  16           2HB      PRO  16  -6.071  -4.643   8.425
  135    HG2  PRO  16           1HG      PRO  16  -8.025  -6.023   9.566
  136    HG3  PRO  16           2HG      PRO  16  -8.332  -4.403   8.911
  137    HD2  PRO  16           1HD      PRO  16  -9.053  -7.074   7.789
  138    HD3  PRO  16           2HD      PRO  16  -9.958  -5.547   7.740
  139    H    VAL  17           H        VAL  17  -4.814  -4.236   5.608
  140    HA   VAL  17           HA       VAL  17  -4.335  -6.581   3.886
  141    HB   VAL  17           HB       VAL  17  -3.213  -3.793   3.558
  142   HG11  VAL  17          1HG1      VAL  17  -3.236  -6.165   1.694
  143   HG12  VAL  17          2HG1      VAL  17  -1.833  -5.512   2.540
  144   HG13  VAL  17          3HG1      VAL  17  -2.638  -4.553   1.296
  145   HG21  VAL  17          3HG2      VAL  17  -5.633  -3.759   3.291
  146   HG22  VAL  17          1HG2      VAL  17  -5.536  -5.088   2.136
  147   HG23  VAL  17          2HG2      VAL  17  -4.829  -3.522   1.739
  148    H    THR  18           H        THR  18  -2.675  -7.849   4.334
  149    HA   THR  18           HA       THR  18  -0.669  -7.058   6.283
  150    HB   THR  18           HB       THR  18  -0.884  -9.665   4.770
  151    HG1  THR  18           HG1      THR  18  -2.828  -9.229   5.912
  152   HG21  THR  18          3HG2      THR  18   1.253  -9.309   5.900
  153   HG22  THR  18          1HG2      THR  18   0.322 -10.568   6.709
  154   HG23  THR  18          2HG2      THR  18   0.408  -8.951   7.405
  155    H    ILE  19           H        ILE  19   1.069  -5.972   5.648
  156    HA   ILE  19           HA       ILE  19   2.307  -6.628   3.043
  157    HB   ILE  19           HB       ILE  19   2.023  -3.984   4.463
  158   HG12  ILE  19          1HG1      ILE  19   0.322  -4.700   2.788
  159   HG13  ILE  19          2HG1      ILE  19   1.159  -3.213   2.349
  160   HG21  ILE  19          1HG2      ILE  19   3.613  -2.993   2.878
  161   HG22  ILE  19          2HG2      ILE  19   4.008  -4.606   2.284
  162   HG23  ILE  19          3HG2      ILE  19   4.383  -4.164   3.949
  163   HD11  ILE  19          3HD1      ILE  19   2.583  -4.464   0.825
  164   HD12  ILE  19          1HD1      ILE  19   0.875  -4.656   0.427
  165   HD13  ILE  19          2HD1      ILE  19   1.739  -5.952   1.255
  166    H    SER  20           H        SER  20   4.459  -7.107   3.043
  167    HA   SER  20           HA       SER  20   5.756  -7.321   5.654
  168    HB2  SER  20           1HB      SER  20   5.639  -9.327   4.150
  169    HB3  SER  20           2HB      SER  20   6.658  -8.463   3.000
  170    HG   SER  20           HG       SER  20   8.351  -8.834   4.207
  171    H    LEU  21           H        LEU  21   7.026  -5.700   6.242
  172    HA   LEU  21           HA       LEU  21   8.075  -3.778   4.416
  173    HB2  LEU  21           1HB      LEU  21   8.674  -4.329   7.322
  174    HB3  LEU  21           2HB      LEU  21   9.430  -3.032   6.422
  175    HG   LEU  21           HG       LEU  21   7.140  -2.078   6.020
  176   HD11  LEU  21          1HD1      LEU  21   5.324  -2.797   7.488
  177   HD12  LEU  21          2HD1      LEU  21   6.325  -4.125   8.075
  178   HD13  LEU  21          3HD1      LEU  21   5.814  -4.085   6.387
  179   HD21  LEU  21          3HD2      LEU  21   8.013  -2.384   8.888
  180   HD22  LEU  21          1HD2      LEU  21   6.945  -1.128   8.259
  181   HD23  LEU  21          2HD2      LEU  21   8.628  -1.199   7.735
  182    H    GLN  22           H        GLN  22  10.475  -3.269   4.348
  183    HA   GLN  22           HA       GLN  22  11.815  -5.422   3.156
  184    HB2  GLN  22           1HB      GLN  22  12.805  -2.758   4.146
  185    HB3  GLN  22           2HB      GLN  22  13.855  -3.910   3.331
  186    HG2  GLN  22           1HG      GLN  22  12.315  -3.859   1.388
  187    HG3  GLN  22           2HG      GLN  22  11.395  -2.596   2.202
  188   HE21  GLN  22          2HE2      GLN  22  13.718  -1.305   3.337
  189   HE22  GLN  22          1HE2      GLN  22  14.531  -0.507   2.030
  190    H    ASN  23           H        ASN  23  11.678  -4.467   6.471
  191    HA   ASN  23           HA       ASN  23  14.059  -5.789   7.323
  192    HB2  ASN  23           1HB      ASN  23  11.606  -4.976   8.895
  193    HB3  ASN  23           2HB      ASN  23  13.103  -5.566   9.606
  194   HD21  ASN  23          2HD2      ASN  23  11.766  -3.037   9.992
  195   HD22  ASN  23          1HD2      ASN  23  12.898  -1.809   9.529
  196    H    GLY  24           H        GLY  24  11.042  -6.928   6.308
  197    HA2  GLY  24           1HA      GLY  24  10.407  -9.174   6.113
  198    HA3  GLY  24           2HA      GLY  24  11.672  -9.609   7.256
  199    H    ALA  25           H        ALA  25   8.772  -7.564   7.257
  200    HA   ALA  25           HA       ALA  25   7.755  -9.023   9.561
  201    HB1  ALA  25           3HB      ALA  25   7.370  -6.990  10.853
  202    HB2  ALA  25           1HB      ALA  25   8.155  -6.031   9.599
  203    HB3  ALA  25           2HB      ALA  25   9.089  -7.207  10.526
  204    HA   PRO  26           HA       PRO  26   4.185  -8.166   6.955
  205    HB2  PRO  26           1HB      PRO  26   2.789 -10.150   8.523
  206    HB3  PRO  26           2HB      PRO  26   3.338 -10.258   6.850
  207    HG2  PRO  26           1HG      PRO  26   4.391 -11.737   8.898
  208    HG3  PRO  26           2HG      PRO  26   5.281 -11.311   7.426
  209    HD2  PRO  26           1HD      PRO  26   5.397 -10.054  10.142
  210    HD3  PRO  26           2HD      PRO  26   6.714 -10.403   9.000
  211    H    ARG  27           H        ARG  27   3.559  -6.166   7.671
  212    HA   ARG  27           HA       ARG  27   2.105  -5.997  10.203
  213    HB2  ARG  27           1HB      ARG  27   3.239  -3.963   8.322
  214    HB3  ARG  27           2HB      ARG  27   1.952  -3.505   9.428
  215    HG2  ARG  27           1HG      ARG  27   3.383  -4.346  11.299
  216    HG3  ARG  27           2HG      ARG  27   4.685  -4.538  10.123
  217    HD2  ARG  27           1HD      ARG  27   4.796  -2.397  11.358
  218    HD3  ARG  27           2HD      ARG  27   4.646  -2.190   9.613
  219    HE   ARG  27           HE       ARG  27   2.074  -2.128  10.634
  220   HH11  ARG  27          1HH1      ARG  27   5.008  -0.280  11.110
  221   HH12  ARG  27          2HH1      ARG  27   4.173   1.230  11.335
  222   HH21  ARG  27          1HH2      ARG  27   0.964  -0.174  10.946
  223   HH22  ARG  27          2HH2      ARG  27   1.856   1.296  11.245
  224    H    ILE  28           H        ILE  28  -0.016  -5.922  10.310
  225    HA   ILE  28           HA       ILE  28  -1.545  -5.965   7.831
  226    HB   ILE  28           HB       ILE  28  -2.532  -6.374  10.662
  227   HG12  ILE  28          1HG1      ILE  28  -1.720  -8.443   8.602
  228   HG13  ILE  28          2HG1      ILE  28  -0.814  -8.045  10.057
  229   HG21  ILE  28          1HG2      ILE  28  -4.278  -5.775   9.090
  230   HG22  ILE  28          2HG2      ILE  28  -4.433  -7.468   9.560
  231   HG23  ILE  28          3HG2      ILE  28  -3.752  -7.047   7.988
  232   HD11  ILE  28          3HD1      ILE  28  -2.083 -10.098  10.328
  233   HD12  ILE  28          1HD1      ILE  28  -3.579  -9.234   9.978
  234   HD13  ILE  28          2HD1      ILE  28  -2.657  -8.848  11.432
  235    H    PHE  29           H        PHE  29  -2.197  -4.063   7.061
  236    HA   PHE  29           HA       PHE  29  -2.440  -1.760   8.803
  237    HB2  PHE  29           1HB      PHE  29  -3.029  -1.984   5.842
  238    HB3  PHE  29           2HB      PHE  29  -2.881  -0.493   6.764
  239    HD1  PHE  29           HD2      PHE  29  -0.540  -0.454   8.178
  240    HD2  PHE  29           HD1      PHE  29  -1.270  -2.488   4.513
  241    HE1  PHE  29           HE2      PHE  29   1.868  -0.406   7.673
  242    HE2  PHE  29           HE1      PHE  29   1.131  -2.439   4.003
  243    HZ   PHE  29           HZ       PHE  29   2.703  -1.403   5.575
  244    H    ASN  30           H        ASN  30  -4.215  -1.264   9.848
  245    HA   ASN  30           HA       ASN  30  -6.692  -2.653   9.262
  246    HB2  ASN  30           1HB      ASN  30  -6.200  -0.536  11.367
  247    HB3  ASN  30           2HB      ASN  30  -7.500  -1.721  11.330
  248   HD21  ASN  30          2HD2      ASN  30  -4.122  -1.177  11.928
  249   HD22  ASN  30          1HD2      ASN  30  -3.826  -2.670  12.758
  250    H    GLY  31           H        GLY  31  -5.235   0.428   8.749
  251    HA2  GLY  31           1HA      GLY  31  -7.702   1.354   7.448
  252    HA3  GLY  31           2HA      GLY  31  -6.900   2.399   8.613
  253    H    VAL  32           H        VAL  32  -7.351   3.114   5.952
  254    HA   VAL  32           HA       VAL  32  -5.210   2.577   4.213
  255    HB   VAL  32           HB       VAL  32  -6.956   5.046   4.276
  256   HG11  VAL  32          1HG1      VAL  32  -5.395   3.816   2.006
  257   HG12  VAL  32          2HG1      VAL  32  -4.955   5.281   2.882
  258   HG13  VAL  32          3HG1      VAL  32  -6.426   5.244   1.913
  259   HG21  VAL  32          3HG2      VAL  32  -8.310   3.033   4.200
  260   HG22  VAL  32          1HG2      VAL  32  -7.352   2.414   2.856
  261   HG23  VAL  32          2HG2      VAL  32  -8.349   3.852   2.639
  262    H    TYR  33           H        TYR  33  -5.590   4.901   6.794
  263    HA   TYR  33           HA       TYR  33  -3.558   6.689   6.076
  264    HB2  TYR  33           1HB      TYR  33  -5.217   7.217   7.798
  265    HB3  TYR  33           2HB      TYR  33  -4.538   5.973   8.845
  266    HD1  TYR  33           HD2      TYR  33  -3.624   9.120   7.073
  267    HD2  TYR  33           HD1      TYR  33  -2.848   6.523  10.354
  268    HE1  TYR  33           HE2      TYR  33  -2.035  10.762   7.994
  269    HE2  TYR  33           HE1      TYR  33  -1.258   8.154  11.279
  270    HH   TYR  33           HH       TYR  33   0.126   9.997  10.525
  271    H    GLU  34           H        GLU  34  -3.445   3.696   7.978
  272    HA   GLU  34           HA       GLU  34  -0.781   3.911   8.851
  273    HB2  GLU  34           1HB      GLU  34  -2.366   1.405   8.238
  274    HB3  GLU  34           2HB      GLU  34  -0.875   1.466   9.165
  275    HG2  GLU  34           1HG      GLU  34  -2.045   2.924  10.810
  276    HG3  GLU  34           2HG      GLU  34  -3.539   2.634   9.920
  277    H    ALA  35           H        ALA  35  -2.221   2.567   5.951
  278    HA   ALA  35           HA       ALA  35   0.198   1.519   4.878
  279    HB1  ALA  35           3HB      ALA  35  -1.094   1.103   2.880
  280    HB2  ALA  35           1HB      ALA  35  -2.375   2.172   3.450
  281    HB3  ALA  35           2HB      ALA  35  -2.048   0.661   4.300
  282    H    PHE  36           H        PHE  36  -1.703   4.463   4.275
  283    HA   PHE  36           HA       PHE  36  -0.132   5.479   2.185
  284    HB2  PHE  36           1HB      PHE  36  -2.367   6.346   2.730
  285    HB3  PHE  36           2HB      PHE  36  -1.748   7.009   4.238
  286    HD1  PHE  36           HD2      PHE  36  -1.220   7.178   0.556
  287    HD2  PHE  36           HD1      PHE  36  -1.009   9.198   4.296
  288    HE1  PHE  36           HE2      PHE  36  -0.654   9.269  -0.611
  289    HE2  PHE  36           HE1      PHE  36  -0.445  11.293   3.136
  290    HZ   PHE  36           HZ       PHE  36  -0.265  11.331   0.681
  291    H    ASP  37           H        ASP  37   0.080   5.982   5.689
  292    HA   ASP  37           HA       ASP  37   2.294   7.707   5.683
  293    HB2  ASP  37           1HB      ASP  37   1.018   7.395   7.705
  294    HB3  ASP  37           2HB      ASP  37   1.383   5.672   7.731
  295    H    PHE  38           H        PHE  38   2.123   4.175   5.986
  296    HA   PHE  38           HA       PHE  38   4.815   3.571   6.142
  297    HB2  PHE  38           1HB      PHE  38   3.250   1.828   6.495
  298    HB3  PHE  38           2HB      PHE  38   2.487   2.087   4.931
  299    HD1  PHE  38           HD2      PHE  38   5.851   1.214   6.310
  300    HD2  PHE  38           HD1      PHE  38   2.922   0.563   3.289
  301    HE1  PHE  38           HE2      PHE  38   7.256  -0.550   5.326
  302    HE2  PHE  38           HE1      PHE  38   4.322  -1.196   2.303
  303    HZ   PHE  38           HZ       PHE  38   6.488  -1.759   3.318
  304    H    LEU  39           H        LEU  39   2.834   4.106   3.266
  305    HA   LEU  39           HA       LEU  39   4.669   3.419   1.297
  306    HB2  LEU  39           1HB      LEU  39   2.540   5.551   1.257
  307    HB3  LEU  39           2HB      LEU  39   3.394   4.981  -0.163
  308    HG   LEU  39           HG       LEU  39   1.613   3.291   1.592
  309   HD11  LEU  39          1HD1      LEU  39   0.083   3.333  -0.309
  310   HD12  LEU  39          2HD1      LEU  39   1.162   4.442  -1.156
  311   HD13  LEU  39          3HD1      LEU  39   0.360   4.952   0.331
  312   HD21  LEU  39          3HD2      LEU  39   1.848   1.619  -0.169
  313   HD22  LEU  39          1HD2      LEU  39   3.411   2.008   0.550
  314   HD23  LEU  39          2HD2      LEU  39   2.976   2.670  -1.026
  315    H    GLN  40           H        GLN  40   4.192   6.542   2.910
  316    HA   GLN  40           HA       GLN  40   6.156   7.837   1.272
  317    HB2  GLN  40           1HB      GLN  40   4.703   8.734   3.761
  318    HB3  GLN  40           2HB      GLN  40   5.828   9.752   2.872
  319    HG2  GLN  40           1HG      GLN  40   4.409   9.578   0.886
  320    HG3  GLN  40           2HG      GLN  40   3.275   8.575   1.790
  321   HE21  GLN  40          2HE2      GLN  40   2.939  11.193   0.485
  322   HE22  GLN  40          1HE2      GLN  40   2.343  12.255   1.715
  323    H    HIS  41           H        HIS  41   6.279   5.976   4.133
  324    HA   HIS  41           HA       HIS  41   8.800   7.113   5.000
  325    HB2  HIS  41           1HB      HIS  41   7.126   4.823   6.001
  326    HB3  HIS  41           2HB      HIS  41   8.763   5.085   6.590
  327    HD1  HIS  41           HD1      HIS  41   9.009   6.681   8.493
  328    HD2  HIS  41           HD2      HIS  41   5.375   7.112   6.525
  329    HE1  HIS  41           HE1      HIS  41   7.673   8.302   9.878
  330    HE2  HIS  41           HE2      HIS  41   5.396   8.345   8.785
  331    H    GLU  42           H        GLU  42   7.808   3.825   3.948
  332    HA   GLU  42           HA       GLU  42  10.217   3.596   2.385
  333    HB2  GLU  42           1HB      GLU  42  10.933   3.153   4.758
  334    HB3  GLU  42           2HB      GLU  42   9.887   1.742   4.741
  335    HG2  GLU  42           1HG      GLU  42  11.192   0.768   2.942
  336    HG3  GLU  42           2HG      GLU  42  12.217   2.202   2.895
  337    H    TRP  43           H        TRP  43   8.415   3.340   0.872
  338    HA   TRP  43           HA       TRP  43   7.111   0.738   0.906
  339    HB2  TRP  43           1HB      TRP  43   5.795   2.626   0.145
  340    HB3  TRP  43           2HB      TRP  43   7.006   3.036  -1.061
  341    HD1  TRP  43           HD1      TRP  43   6.197   2.434  -3.381
  342    HE1  TRP  43           HE1      TRP  43   4.796   0.557  -4.441
  343    HE3  TRP  43           HE3      TRP  43   5.123  -0.272   0.829
  344    HZ2  TRP  43           HZ2      TRP  43   3.423  -1.754  -3.615
  345    HZ3  TRP  43           HZ3      TRP  43   3.763  -2.305   0.600
  346    HH2  TRP  43           HH2      TRP  43   2.931  -3.030  -1.575
  347    HA   PRO  44           HA       PRO  44  10.725  -1.211  -0.862
  348    HB2  PRO  44           1HB      PRO  44   8.595  -3.173  -1.586
  349    HB3  PRO  44           2HB      PRO  44  10.176  -3.450  -0.849
  350    HG2  PRO  44           1HG      PRO  44   7.975  -3.502   0.637
  351    HG3  PRO  44           2HG      PRO  44   9.466  -2.761   1.251
  352    HD2  PRO  44           1HD      PRO  44   6.972  -1.469   0.261
  353    HD3  PRO  44           2HD      PRO  44   8.097  -0.939   1.529
  354    H    ALA  45           H        ALA  45   7.683  -0.965  -2.705
  355    HA   ALA  45           HA       ALA  45   9.076  -1.453  -5.195
  356    HB1  ALA  45           3HB      ALA  45   6.202  -0.649  -4.750
  357    HB2  ALA  45           1HB      ALA  45   6.798  -2.304  -4.889
  358    HB3  ALA  45           2HB      ALA  45   6.908  -1.209  -6.267
  359    H    ARG  46           H        ARG  46  10.550   0.222  -5.255
  360    HA   ARG  46           HA       ARG  46   9.492   2.951  -5.380
  361    HB2  ARG  46           1HB      ARG  46  11.929   3.587  -5.196
  362    HB3  ARG  46           2HB      ARG  46  11.256   2.759  -3.798
  363    HG2  ARG  46           1HG      ARG  46  12.217   0.631  -4.736
  364    HG3  ARG  46           2HG      ARG  46  13.076   1.635  -5.906
  365    HD2  ARG  46           1HD      ARG  46  14.241   2.781  -4.145
  366    HD3  ARG  46           2HD      ARG  46  13.285   1.951  -2.916
  367    HE   ARG  46           HE       ARG  46  15.103   0.501  -4.734
  368   HH11  ARG  46          1HH1      ARG  46  13.970   1.280  -1.516
  369   HH12  ARG  46          2HH1      ARG  46  14.882   0.025  -0.745
  370   HH21  ARG  46          1HH2      ARG  46  16.314  -1.167  -3.719
  371   HH22  ARG  46          2HH2      ARG  46  16.207  -1.374  -1.995
  372    H    GLY  47           H        GLY  47  10.011   4.337  -7.076
  373    HA2  GLY  47           1HA      GLY  47  11.580   3.991  -9.266
  374    HA3  GLY  47           2HA      GLY  47  10.152   3.029  -9.642
  375    H    ASP  48           H        ASP  48   8.299   4.036 -10.285
  376    HA   ASP  48           HA       ASP  48   7.922   6.847  -9.689
  377    HB2  ASP  48           1HB      ASP  48   9.159   7.022 -11.768
  378    HB3  ASP  48           2HB      ASP  48   8.075   5.872 -12.547
  379    H    ARG  49           H        ARG  49   6.496   4.763 -12.179
  380    HA   ARG  49           HA       ARG  49   3.898   5.718 -11.578
  381    HB2  ARG  49           1HB      ARG  49   4.700   4.994 -13.817
  382    HB3  ARG  49           2HB      ARG  49   4.678   3.333 -13.252
  383    HG2  ARG  49           1HG      ARG  49   2.352   3.268 -13.156
  384    HG3  ARG  49           2HG      ARG  49   2.212   5.030 -13.166
  385    HD2  ARG  49           1HD      ARG  49   2.973   5.117 -15.456
  386    HD3  ARG  49           2HD      ARG  49   3.261   3.379 -15.461
  387    HE   ARG  49           HE       ARG  49   0.971   3.003 -15.636
  388   HH11  ARG  49          1HH1      ARG  49   1.633   6.431 -15.249
  389   HH12  ARG  49          2HH1      ARG  49   0.092   6.922 -15.871
  390   HH21  ARG  49          1HH2      ARG  49  -1.050   3.663 -16.480
  391   HH22  ARG  49          2HH2      ARG  49  -1.435   5.358 -16.576
  392    H    ALA  50           H        ALA  50   5.628   2.771 -10.709
  393    HA   ALA  50           HA       ALA  50   3.355   1.395  -9.665
  394    HB1  ALA  50           3HB      ALA  50   5.394   0.214 -10.320
  395    HB2  ALA  50           1HB      ALA  50   4.984  -0.110  -8.635
  396    HB3  ALA  50           2HB      ALA  50   6.282   1.018  -9.026
  397    H    HIS  51           H        HIS  51   5.827   3.474  -8.293
  398    HA   HIS  51           HA       HIS  51   4.937   3.290  -5.593
  399    HB2  HIS  51           1HB      HIS  51   7.233   3.975  -6.275
  400    HB3  HIS  51           2HB      HIS  51   6.569   5.455  -6.952
  401    HD1  HIS  51           HD1      HIS  51   6.335   7.400  -5.409
  402    HD2  HIS  51           HD2      HIS  51   7.003   3.829  -3.385
  403    HE1  HIS  51           HE1      HIS  51   6.734   8.041  -3.009
  404    HE2  HIS  51           HE2      HIS  51   7.395   5.890  -1.873
  405    H    GLU  52           H        GLU  52   4.504   5.608  -8.209
  406    HA   GLU  52           HA       GLU  52   2.966   7.552  -7.008
  407    HB2  GLU  52           1HB      GLU  52   3.822   7.819  -9.232
  408    HB3  GLU  52           2HB      GLU  52   2.916   6.429  -9.807
  409    HG2  GLU  52           1HG      GLU  52   0.825   7.676  -9.370
  410    HG3  GLU  52           2HG      GLU  52   1.801   9.086  -8.950
  411    H    GLN  53           H        GLN  53   1.775   4.715  -8.807
  412    HA   GLN  53           HA       GLN  53  -0.932   5.160  -8.527
  413    HB2  GLN  53           1HB      GLN  53   0.079   3.439  -9.980
  414    HB3  GLN  53           2HB      GLN  53   0.462   2.480  -8.557
  415    HG2  GLN  53           1HG      GLN  53  -1.911   2.254  -8.058
  416    HG3  GLN  53           2HG      GLN  53  -2.305   3.236  -9.467
  417   HE21  GLN  53          2HE2      GLN  53  -0.157   2.039 -11.060
  418   HE22  GLN  53          1HE2      GLN  53  -0.716   0.464 -11.497
  419    H    ALA  54           H        ALA  54   1.195   3.333  -6.348
  420    HA   ALA  54           HA       ALA  54  -0.715   2.402  -4.562
  421    HB1  ALA  54           3HB      ALA  54   1.103   2.151  -2.971
  422    HB2  ALA  54           1HB      ALA  54   2.117   3.225  -3.934
  423    HB3  ALA  54           2HB      ALA  54   1.622   1.663  -4.585
  424    H    LEU  55           H        LEU  55   1.118   5.457  -4.451
  425    HA   LEU  55           HA       LEU  55  -0.133   6.317  -2.031
  426    HB2  LEU  55           1HB      LEU  55   1.632   7.648  -4.046
  427    HB3  LEU  55           2HB      LEU  55   0.822   8.609  -2.826
  428    HG   LEU  55           HG       LEU  55   1.916   7.132  -1.087
  429   HD11  LEU  55          1HD1      LEU  55   3.543   6.241  -3.459
  430   HD12  LEU  55          2HD1      LEU  55   2.471   5.234  -2.485
  431   HD13  LEU  55          3HD1      LEU  55   3.929   5.920  -1.769
  432   HD21  LEU  55          3HD2      LEU  55   2.708   9.381  -1.590
  433   HD22  LEU  55          1HD2      LEU  55   3.714   8.742  -2.890
  434   HD23  LEU  55          2HD2      LEU  55   4.051   8.300  -1.217
  435    H    ARG  56           H        ARG  56  -0.725   6.904  -5.458
  436    HA   ARG  56           HA       ARG  56  -2.600   8.984  -5.169
  437    HB2  ARG  56           1HB      ARG  56  -2.289   6.895  -7.329
  438    HB3  ARG  56           2HB      ARG  56  -3.404   8.251  -7.441
  439    HG2  ARG  56           1HG      ARG  56  -0.439   8.555  -7.046
  440    HG3  ARG  56           2HG      ARG  56  -1.231   8.571  -8.623
  441    HD2  ARG  56           1HD      ARG  56  -2.452  10.534  -8.082
  442    HD3  ARG  56           2HD      ARG  56  -1.988  10.434  -6.385
  443    HE   ARG  56           HE       ARG  56   0.065  11.357  -6.890
  444   HH11  ARG  56          1HH1      ARG  56  -1.644  10.610  -9.861
  445   HH12  ARG  56          2HH1      ARG  56  -0.592  11.559 -10.862
  446   HH21  ARG  56          1HH2      ARG  56   1.451  12.604  -8.200
  447   HH22  ARG  56          2HH2      ARG  56   1.184  12.681  -9.917
  448    H    LEU  57           H        LEU  57  -2.984   5.477  -5.191
  449    HA   LEU  57           HA       LEU  57  -5.805   5.429  -5.103
  450    HB2  LEU  57           1HB      LEU  57  -3.802   3.437  -4.035
  451    HB3  LEU  57           2HB      LEU  57  -5.517   3.130  -4.224
  452    HG   LEU  57           HG       LEU  57  -3.666   3.795  -6.510
  453   HD11  LEU  57          1HD1      LEU  57  -3.767   1.419  -7.057
  454   HD12  LEU  57          2HD1      LEU  57  -4.699   1.116  -5.591
  455   HD13  LEU  57          3HD1      LEU  57  -3.031   1.680  -5.476
  456   HD21  LEU  57          3HD2      LEU  57  -6.482   2.712  -6.447
  457   HD22  LEU  57          1HD2      LEU  57  -5.507   2.973  -7.891
  458   HD23  LEU  57          2HD2      LEU  57  -6.012   4.347  -6.910
  459    H    CYS  58           H        CYS  58  -3.364   5.289  -2.532
  460    HA   CYS  58           HA       CYS  58  -5.204   5.058  -0.408
  461    HB2  CYS  58           1HB      CYS  58  -2.366   6.099  -0.385
  462    HB3  CYS  58           2HB      CYS  58  -3.289   5.612   1.034
  463    HG   CYS  58           HG       CYS  58  -1.912   3.664  -1.384
  464    H    ARG  59           H        ARG  59  -3.770   7.842  -2.022
  465    HA   ARG  59           HA       ARG  59  -4.587   9.827  -0.209
  466    HB2  ARG  59           1HB      ARG  59  -2.988  10.244  -2.042
  467    HB3  ARG  59           2HB      ARG  59  -4.288  10.054  -3.213
  468    HG2  ARG  59           1HG      ARG  59  -5.451  11.968  -2.088
  469    HG3  ARG  59           2HG      ARG  59  -3.982  12.213  -1.145
  470    HD2  ARG  59           1HD      ARG  59  -2.715  12.585  -3.189
  471    HD3  ARG  59           2HD      ARG  59  -4.163  12.290  -4.155
  472    HE   ARG  59           HE       ARG  59  -4.124  14.476  -2.190
  473   HH11  ARG  59          1HH1      ARG  59  -4.378  13.402  -5.524
  474   HH12  ARG  59          2HH1      ARG  59  -4.936  14.948  -6.102
  475   HH21  ARG  59          1HH2      ARG  59  -4.874  16.485  -2.954
  476   HH22  ARG  59          2HH2      ARG  59  -5.228  16.696  -4.642
  477    H    ALA  60           H        ALA  60  -6.236   8.354  -2.968
  478    HA   ALA  60           HA       ALA  60  -8.560  10.020  -2.744
  479    HB1  ALA  60           3HB      ALA  60  -8.178   7.412  -4.214
  480    HB2  ALA  60           1HB      ALA  60  -7.919   9.025  -4.879
  481    HB3  ALA  60           2HB      ALA  60  -9.540   8.516  -4.406
  482    H    SER  61           H        SER  61  -7.610   6.853  -1.568
  483    HA   SER  61           HA       SER  61 -10.139   5.999  -0.689
  484    HB2  SER  61           1HB      SER  61  -7.406   5.258   0.370
  485    HB3  SER  61           2HB      SER  61  -8.898   4.363   0.661
  486    HG   SER  61           HG       SER  61  -7.516   4.735  -1.787
  487    H    LEU  62           H        LEU  62  -7.719   8.070   0.810
  488    HA   LEU  62           HA       LEU  62  -8.852   8.021   3.422
  489    HB2  LEU  62           1HB      LEU  62  -6.949   9.895   2.047
  490    HB3  LEU  62           2HB      LEU  62  -7.526  10.202   3.675
  491    HG   LEU  62           HG       LEU  62  -5.972   7.763   2.799
  492   HD11  LEU  62          1HD1      LEU  62  -5.143  10.137   4.464
  493   HD12  LEU  62          2HD1      LEU  62  -4.618   9.796   2.816
  494   HD13  LEU  62          3HD1      LEU  62  -4.161   8.711   4.127
  495   HD21  LEU  62          3HD2      LEU  62  -6.916   8.638   5.530
  496   HD22  LEU  62          1HD2      LEU  62  -5.853   7.267   5.198
  497   HD23  LEU  62          2HD2      LEU  62  -7.516   7.257   4.610
  498    H    MET  63           H        MET  63  -9.977   9.385   0.575
  499    HA   MET  63           HA       MET  63 -11.563  11.378   2.045
  500    HB2  MET  63           1HB      MET  63 -10.954  11.109  -0.899
  501    HB3  MET  63           2HB      MET  63 -12.129  12.247  -0.253
  502    HG2  MET  63           1HG      MET  63  -9.203  12.190   0.444
  503    HG3  MET  63           2HG      MET  63  -9.958  13.284  -0.714
  504    HE1  MET  63           3HE      MET  63 -11.796  15.109  -0.026
  505    HE2  MET  63           1HE      MET  63 -12.358  15.345   1.630
  506    HE3  MET  63           2HE      MET  63 -12.747  13.854   0.770
  507    H    GLY  64           H        GLY  64 -11.710   8.274   0.946
  508    HA2  GLY  64           1HA      GLY  64 -13.537   6.834   1.083
  509    HA3  GLY  64           2HA      GLY  64 -14.598   8.230   1.195
  510    H    ASP  65           H        ASP  65 -12.312   8.279  -1.363
  511    HA   ASP  65           HA       ASP  65 -14.384   8.167  -3.343
  512    HB2  ASP  65           1HB      ASP  65 -11.373   8.270  -3.583
  513    HB3  ASP  65           2HB      ASP  65 -12.460   8.290  -4.966
  514    H    VAL  66           H        VAL  66 -11.888   6.006  -2.189
  515    HA   VAL  66           HA       VAL  66 -12.763   3.960  -4.107
  516    HB   VAL  66           HB       VAL  66 -10.212   3.979  -2.484
  517   HG11  VAL  66          1HG1      VAL  66 -10.933   1.771  -3.198
  518   HG12  VAL  66          2HG1      VAL  66  -9.487   2.273  -4.077
  519   HG13  VAL  66          3HG1      VAL  66 -11.067   2.338  -4.861
  520   HG21  VAL  66          3HG2      VAL  66  -9.074   4.640  -4.555
  521   HG22  VAL  66          1HG2      VAL  66 -10.207   5.876  -4.008
  522   HG23  VAL  66          2HG2      VAL  66 -10.637   4.818  -5.352
  523    H    ALA  67           H        ALA  67 -13.967   2.357  -3.347
  524    HA   ALA  67           HA       ALA  67 -14.563   2.244  -0.545
  525    HB1  ALA  67           3HB      ALA  67 -16.234   0.603  -1.152
  526    HB2  ALA  67           1HB      ALA  67 -15.546   0.470  -2.769
  527    HB3  ALA  67           2HB      ALA  67 -16.299   1.979  -2.253
  528    H    GLY  68           H        GLY  68 -12.566   1.597   0.357
  529    HA2  GLY  68           1HA      GLY  68 -11.356   0.043   1.513
  530    HA3  GLY  68           2HA      GLY  68 -12.799  -0.940   1.390
  531    H    GLU  69           H        GLU  69 -12.851  -2.661   0.041
  532    HA   GLU  69           HA       GLU  69 -10.420  -3.967  -0.352
  533    HB2  GLU  69           1HB      GLU  69 -12.506  -5.164  -0.022
  534    HB3  GLU  69           2HB      GLU  69 -13.116  -4.576  -1.562
  535    HG2  GLU  69           1HG      GLU  69 -11.500  -5.856  -2.767
  536    HG3  GLU  69           2HG      GLU  69 -10.675  -6.310  -1.277
  537    H    ILE  70           H        ILE  70 -12.183  -1.896  -2.541
  538    HA   ILE  70           HA       ILE  70 -11.009  -2.739  -4.952
  539    HB   ILE  70           HB       ILE  70 -11.915   0.041  -4.188
  540   HG12  ILE  70          1HG1      ILE  70 -13.340  -2.211  -5.628
  541   HG13  ILE  70          2HG1      ILE  70 -13.684  -1.650  -3.996
  542   HG21  ILE  70          1HG2      ILE  70 -12.093   0.427  -6.609
  543   HG22  ILE  70          2HG2      ILE  70 -11.379  -1.158  -6.906
  544   HG23  ILE  70          3HG2      ILE  70 -10.432   0.101  -6.113
  545   HD11  ILE  70          3HD1      ILE  70 -14.028  -0.048  -6.518
  546   HD12  ILE  70          1HD1      ILE  70 -14.384   0.508  -4.883
  547   HD13  ILE  70          2HD1      ILE  70 -15.314  -0.816  -5.588
  548    H    ALA  71           H        ALA  71  -9.984  -0.272  -2.611
  549    HA   ALA  71           HA       ALA  71  -7.572   0.394  -3.958
  550    HB1  ALA  71           3HB      ALA  71  -8.265   0.702  -1.036
  551    HB2  ALA  71           1HB      ALA  71  -8.598   1.883  -2.302
  552    HB3  ALA  71           2HB      ALA  71  -6.932   1.495  -1.875
  553    H    ARG  72           H        ARG  72  -8.466  -1.927  -1.496
  554    HA   ARG  72           HA       ARG  72  -5.931  -2.831  -0.748
  555    HB2  ARG  72           1HB      ARG  72  -7.707  -3.520   0.611
  556    HB3  ARG  72           2HB      ARG  72  -8.666  -4.063  -0.759
  557    HG2  ARG  72           1HG      ARG  72  -7.206  -5.973  -1.062
  558    HG3  ARG  72           2HG      ARG  72  -6.173  -5.412   0.255
  559    HD2  ARG  72           1HD      ARG  72  -7.795  -5.858   1.875
  560    HD3  ARG  72           2HD      ARG  72  -9.096  -5.920   0.685
  561    HE   ARG  72           HE       ARG  72  -8.370  -8.074   0.031
  562   HH11  ARG  72          1HH1      ARG  72  -6.651  -6.808   2.819
  563   HH12  ARG  72          2HH1      ARG  72  -5.999  -8.355   3.272
  564   HH21  ARG  72          1HH2      ARG  72  -7.519 -10.098   0.654
  565   HH22  ARG  72          2HH2      ARG  72  -6.496 -10.205   2.059
  566    H    THR  73           H        THR  73  -8.115  -4.044  -3.289
  567    HA   THR  73           HA       THR  73  -6.400  -6.120  -4.143
  568    HB   THR  73           HB       THR  73  -8.525  -4.715  -5.773
  569    HG1  THR  73           HG1      THR  73  -9.586  -5.445  -3.995
  570   HG21  THR  73          3HG2      THR  73  -7.383  -7.510  -5.955
  571   HG22  THR  73          1HG2      THR  73  -7.070  -6.192  -7.084
  572   HG23  THR  73          2HG2      THR  73  -8.694  -6.865  -6.943
  573    H    ALA  74           H        ALA  74  -6.858  -2.785  -5.266
  574    HA   ALA  74           HA       ALA  74  -5.062  -2.957  -7.449
  575    HB1  ALA  74           3HB      ALA  74  -5.158  -0.523  -7.479
  576    HB2  ALA  74           1HB      ALA  74  -5.913  -0.522  -5.884
  577    HB3  ALA  74           2HB      ALA  74  -6.768  -1.210  -7.265
  578    H    PHE  75           H        PHE  75  -4.664  -2.214  -4.045
  579    HA   PHE  75           HA       PHE  75  -1.987  -1.313  -4.163
  580    HB2  PHE  75           1HB      PHE  75  -3.628  -1.085  -2.228
  581    HB3  PHE  75           2HB      PHE  75  -3.275  -2.764  -1.845
  582    HD1  PHE  75           HD1      PHE  75  -1.749   0.583  -2.198
  583    HD2  PHE  75           HD2      PHE  75  -1.385  -3.338  -0.590
  584    HE1  PHE  75           HE1      PHE  75   0.186   1.314  -0.870
  585    HE2  PHE  75           HE2      PHE  75   0.555  -2.614   0.741
  586    HZ   PHE  75           HZ       PHE  75   1.342  -0.285   0.601
  587    H    VAL  76           H        VAL  76  -3.474  -4.488  -3.867
  588    HA   VAL  76           HA       VAL  76  -1.161  -6.030  -3.474
  589    HB   VAL  76           HB       VAL  76  -3.748  -6.722  -4.886
  590   HG11  VAL  76          1HG1      VAL  76  -1.976  -8.214  -5.655
  591   HG12  VAL  76          2HG1      VAL  76  -3.123  -9.068  -4.622
  592   HG13  VAL  76          3HG1      VAL  76  -1.553  -8.582  -3.982
  593   HG21  VAL  76          3HG2      VAL  76  -2.749  -7.321  -2.104
  594   HG22  VAL  76          1HG2      VAL  76  -4.263  -7.907  -2.796
  595   HG23  VAL  76          2HG2      VAL  76  -4.022  -6.178  -2.536
  596    H    ALA  77           H        ALA  77  -2.687  -4.785  -6.405
  597    HA   ALA  77           HA       ALA  77  -1.062  -6.115  -8.278
  598    HB1  ALA  77           3HB      ALA  77  -1.824  -4.435  -9.873
  599    HB2  ALA  77           1HB      ALA  77  -2.441  -3.446  -8.551
  600    HB3  ALA  77           2HB      ALA  77  -3.162  -5.021  -8.885
  601    H    ALA  78           H        ALA  78  -0.654  -3.061  -6.554
  602    HA   ALA  78           HA       ALA  78   1.729  -2.301  -7.938
  603    HB1  ALA  78           3HB      ALA  78   1.965  -0.613  -6.182
  604    HB2  ALA  78           1HB      ALA  78   0.681  -1.389  -5.256
  605    HB3  ALA  78           2HB      ALA  78   0.320  -0.647  -6.816
  606    H    SER  79           H        SER  79   1.015  -4.038  -4.962
  607    HA   SER  79           HA       SER  79   3.671  -4.198  -3.996
  608    HB2  SER  79           1HB      SER  79   1.353  -6.069  -3.449
  609    HB3  SER  79           2HB      SER  79   2.801  -5.884  -2.460
  610    HG   SER  79           HG       SER  79   0.736  -3.995  -2.910
  611    H    ARG  80           H        ARG  80   2.074  -5.771  -6.534
  612    HA   ARG  80           HA       ARG  80   3.271  -8.307  -6.539
  613    HB2  ARG  80           1HB      ARG  80   1.313  -7.640  -7.904
  614    HB3  ARG  80           2HB      ARG  80   2.367  -6.656  -8.905
  615    HG2  ARG  80           1HG      ARG  80   3.578  -8.663  -9.601
  616    HG3  ARG  80           2HG      ARG  80   2.508  -9.648  -8.597
  617    HD2  ARG  80           1HD      ARG  80   0.582  -8.782  -9.912
  618    HD3  ARG  80           2HD      ARG  80   1.727  -7.962 -10.972
  619    HE   ARG  80           HE       ARG  80   2.636 -10.361 -11.298
  620   HH11  ARG  80          1HH1      ARG  80  -0.721  -9.479 -10.865
  621   HH12  ARG  80          2HH1      ARG  80  -1.340 -10.844 -11.745
  622   HH21  ARG  80          1HH2      ARG  80   1.839 -12.142 -12.487
  623   HH22  ARG  80          2HH2      ARG  80   0.124 -12.349 -12.692
  624    H    GLN  81           H        GLN  81   4.368  -5.202  -7.791
  625    HA   GLN  81           HA       GLN  81   6.500  -6.110  -9.375
  626    HB2  GLN  81           1HB      GLN  81   5.668  -3.817  -9.508
  627    HB3  GLN  81           2HB      GLN  81   6.214  -3.506  -7.865
  628    HG2  GLN  81           1HG      GLN  81   8.537  -3.935  -8.612
  629    HG3  GLN  81           2HG      GLN  81   7.936  -4.088 -10.261
  630   HE21  GLN  81          2HE2      GLN  81   7.221  -2.259 -11.349
  631   HE22  GLN  81          1HE2      GLN  81   7.599  -0.661 -10.798
  632    H    ALA  82           H        ALA  82   6.354  -5.228  -5.957
  633    HA   ALA  82           HA       ALA  82   9.182  -5.784  -5.598
  634    HB1  ALA  82           3HB      ALA  82   7.076  -4.947  -3.608
  635    HB2  ALA  82           1HB      ALA  82   8.196  -3.874  -4.447
  636    HB3  ALA  82           2HB      ALA  82   8.807  -5.057  -3.290
  637    H    HIS  83           H        HIS  83   6.524  -7.643  -5.861
  638    HA   HIS  83           HA       HIS  83   5.885  -9.722  -5.217
  639    HB2  HIS  83           1HB      HIS  83   8.844  -9.885  -4.657
  640    HB3  HIS  83           2HB      HIS  83   7.769 -11.258  -4.419
  641    HD1  HIS  83           HD1      HIS  83   7.359 -12.694  -6.404
  642    HD2  HIS  83           HD2      HIS  83   8.843  -8.946  -7.450
  643    HE1  HIS  83           HE1      HIS  83   7.768 -12.790  -8.889
  644    HE2  HIS  83           HE2      HIS  83   8.800 -10.560  -9.474
  645    H    CYS  84           H        CYS  84   5.566  -7.598  -3.377
  646    HA   CYS  84           HA       CYS  84   6.156  -8.670  -0.740
  647    HB2  CYS  84           1HB      CYS  84   6.412  -6.254  -1.193
  648    HB3  CYS  84           2HB      CYS  84   4.700  -6.148  -1.582
  649    HG   CYS  84           HG       CYS  84   3.798  -6.636   0.964
  650    H    LEU  85           H        LEU  85   4.427 -10.185  -2.440
  651    HA   LEU  85           HA       LEU  85   1.722  -9.673  -1.538
  652    HB2  LEU  85           1HB      LEU  85   2.811 -11.819  -3.348
  653    HB3  LEU  85           2HB      LEU  85   1.112 -11.552  -3.002
  654    HG   LEU  85           HG       LEU  85   2.949  -9.616  -4.390
  655   HD11  LEU  85          1HD1      LEU  85   1.577 -10.091  -6.358
  656   HD12  LEU  85          2HD1      LEU  85   0.672 -11.288  -5.431
  657   HD13  LEU  85          3HD1      LEU  85   2.385 -11.544  -5.767
  658   HD21  LEU  85          3HD2      LEU  85   1.254  -8.474  -3.058
  659   HD22  LEU  85          1HD2      LEU  85  -0.005  -9.435  -3.834
  660   HD23  LEU  85          2HD2      LEU  85   0.943  -8.291  -4.784
  661    H    MET  86           H        MET  86   0.905 -10.496   0.163
  662    HA   MET  86           HA       MET  86   1.658 -13.187   1.023
  663    HB2  MET  86           1HB      MET  86   1.585 -10.764   2.829
  664    HB3  MET  86           2HB      MET  86   1.597 -12.418   3.417
  665    HG2  MET  86           1HG      MET  86   3.766 -12.740   2.235
  666    HG3  MET  86           2HG      MET  86   3.760 -11.016   1.871
  667    HE1  MET  86           3HE      MET  86   2.490 -12.831   5.122
  668    HE2  MET  86           1HE      MET  86   3.927 -12.759   6.143
  669    HE3  MET  86           2HE      MET  86   3.932 -13.747   4.682
  670    H    GLU  87           H        GLU  87   0.049 -14.281   2.166
  671    HA   GLU  87           HA       GLU  87  -2.643 -13.284   1.867
  672    HB2  GLU  87           1HB      GLU  87  -1.595 -15.750   3.277
  673    HB3  GLU  87           2HB      GLU  87  -3.291 -15.397   2.978
  674    HG2  GLU  87           1HG      GLU  87  -1.185 -15.855   0.876
  675    HG3  GLU  87           2HG      GLU  87  -2.422 -17.007   1.381
  676    H    ASP  88           H        ASP  88  -4.018 -12.659   3.555
  677    HA   ASP  88           HA       ASP  88  -2.745 -11.446   5.796
  678    HB2  ASP  88           1HB      ASP  88  -5.693 -11.950   5.336
  679    HB3  ASP  88           2HB      ASP  88  -5.005 -10.870   6.546
  680    H    LYS  89           H        LYS  89  -2.676 -12.081   7.898
  681    HA   LYS  89           HA       LYS  89  -2.460 -13.529   9.633
  682    HB2  LYS  89           1HB      LYS  89  -4.900 -14.863   8.432
  683    HB3  LYS  89           2HB      LYS  89  -4.261 -15.171  10.037
  684    HG2  LYS  89           1HG      LYS  89  -5.892 -13.712  10.601
  685    HG3  LYS  89           2HG      LYS  89  -4.619 -12.543  10.256
  686    HD2  LYS  89           1HD      LYS  89  -5.496 -12.184   8.029
  687    HD3  LYS  89           2HD      LYS  89  -6.702 -13.448   8.267
  688    HE2  LYS  89           1HE      LYS  89  -7.643 -12.103  10.141
  689    HE3  LYS  89           2HE      LYS  89  -6.513 -10.817   9.726
  690    HZ1  LYS  89           3HZ      LYS  89  -8.795 -10.562   8.791
  691    HZ2  LYS  89           1HZ      LYS  89  -8.502 -11.917   7.816
  692    HZ3  LYS  89           2HZ      LYS  89  -7.561 -10.520   7.627
  693    H    ALA  90           H        ALA  90  -1.055 -14.016   7.155
  694    HA   ALA  90           HA       ALA  90  -1.039 -16.683   6.339
  695    HB1  ALA  90           3HB      ALA  90   0.053 -14.881   5.099
  696    HB2  ALA  90           1HB      ALA  90   1.155 -16.224   5.397
  697    HB3  ALA  90           2HB      ALA  90   1.276 -14.753   6.363
  698    H    GLU  91           H        GLU  91   0.578 -15.132   9.045
  699    HA   GLU  91           HA       GLU  91   1.845 -17.673   9.748
  700    HB2  GLU  91           1HB      GLU  91   2.149 -14.952  11.039
  701    HB3  GLU  91           2HB      GLU  91   3.059 -16.397  11.457
  702    HG2  GLU  91           1HG      GLU  91   3.893 -16.416   9.079
  703    HG3  GLU  91           2HG      GLU  91   3.174 -14.817   8.905
  704    H    ALA  92           H        ALA  92   0.364 -18.963  10.628
  705    HA   ALA  92           HA       ALA  92  -1.392 -17.832  12.710
  706    HB1  ALA  92           3HB      ALA  92  -2.627 -18.490  10.700
  707    HB2  ALA  92           1HB      ALA  92  -3.064 -19.489  12.086
  708    HB3  ALA  92           2HB      ALA  92  -1.987 -20.128  10.845
  709    HA   PRO  93           HA       PRO  93   0.680 -20.809  15.321
  710    HB2  PRO  93           1HB      PRO  93  -0.597 -20.167  17.607
  711    HB3  PRO  93           2HB      PRO  93   0.656 -19.133  16.907
  712    HG2  PRO  93           1HG      PRO  93  -2.321 -18.863  16.768
  713    HG3  PRO  93           2HG      PRO  93  -1.093 -17.610  17.025
  714    HD2  PRO  93           1HD      PRO  93  -2.289 -18.085  14.612
  715    HD3  PRO  93           2HD      PRO  93  -0.660 -17.405  14.783
  716    H    ASN  94           H        ASN  94  -0.015 -22.516  16.877
  717    HA   ASN  94           HA       ASN  94  -1.090 -24.469  17.263
  718    HB2  ASN  94           1HB      ASN  94  -2.726 -22.837  18.279
  719    HB3  ASN  94           2HB      ASN  94  -3.650 -22.936  16.782
  720   HD21  ASN  94          2HD2      ASN  94  -4.781 -24.815  16.308
  721   HD22  ASN  94          1HD2      ASN  94  -5.077 -26.040  17.491
  722    H    THR  95           H        THR  95  -0.133 -25.134  15.187
  723    HA   THR  95           HA       THR  95  -2.191 -25.652  13.138
  724    HB   THR  95           HB       THR  95   0.756 -26.007  12.691
  725    HG1  THR  95           HG1      THR  95  -0.752 -23.591  12.646
  726   HG21  THR  95          3HG2      THR  95  -1.519 -25.256  10.851
  727   HG22  THR  95          1HG2      THR  95  -0.808 -26.864  11.003
  728   HG23  THR  95          2HG2      THR  95   0.156 -25.530  10.373
  729    H    ILE  96           H        ILE  96  -2.289 -27.766  12.228
  730    HA   ILE  96           HA       ILE  96  -0.993 -29.855  13.831
  731    HB   ILE  96           HB       ILE  96  -3.241 -29.793  14.637
  732   HG12  ILE  96          1HG1      ILE  96  -4.092 -32.037  13.961
  733   HG13  ILE  96          2HG1      ILE  96  -2.896 -32.063  12.670
  734   HG21  ILE  96          1HG2      ILE  96  -4.155 -29.934  11.772
  735   HG22  ILE  96          2HG2      ILE  96  -4.303 -28.553  12.861
  736   HG23  ILE  96          3HG2      ILE  96  -5.203 -30.033  13.188
  737   HD11  ILE  96          3HD1      ILE  96  -1.107 -31.964  14.328
  738   HD12  ILE  96          1HD1      ILE  96  -2.155 -33.360  14.582
  739   HD13  ILE  96          2HD1      ILE  96  -2.308 -31.942  15.619
  740    H    ALA  97           H        ALA  97   0.455 -30.662  12.484
  741    HA   ALA  97           HA       ALA  97  -0.489 -31.574   9.845
  742    HB1  ALA  97           3HB      ALA  97   2.223 -30.388  10.435
  743    HB2  ALA  97           1HB      ALA  97   0.922 -29.599   9.543
  744    HB3  ALA  97           2HB      ALA  97   1.692 -31.042   8.885
  745    H    SER  98           H        SER  98   2.609 -31.894  11.545
  746    HA   SER  98           HA       SER  98   2.099 -34.780  11.772
  747    HB2  SER  98           1HB      SER  98   4.686 -33.446  10.932
  748    HB3  SER  98           2HB      SER  98   4.518 -35.160  11.295
  749    HG   SER  98           HG       SER  98   3.740 -33.735   9.058
  750    H    GLY  99           H        GLY  99   1.832 -35.114  13.873
  751    HA2  GLY  99           1HA      GLY  99   3.170 -33.528  15.874
  752    HA3  GLY  99           2HA      GLY  99   2.104 -34.896  16.164
  753    H    SER 100           H        SER 100   5.214 -34.444  14.517
  754    HA   SER 100           HA       SER 100   6.357 -36.516  16.253
  755    HB2  SER 100           1HB      SER 100   6.883 -36.184  13.286
  756    HB3  SER 100           2HB      SER 100   7.612 -37.394  14.339
  757    HG   SER 100           HG       SER 100   5.466 -38.192  14.720
  Start of MODEL   20
    1    H1   MET   1           1H       MET   1  -9.680  -0.038  19.976
    2    H2   MET   1           2H       MET   1 -10.609  -1.453  20.024
    3    H3   MET   1           3H       MET   1  -9.521  -1.110  21.282
    4    HA   MET   1           HA       MET   1 -11.817  -0.670  21.925
    5    HB2  MET   1           1HB      MET   1  -9.941   0.649  22.890
    6    HB3  MET   1           2HB      MET   1 -10.153   1.843  21.616
    7    HG2  MET   1           1HG      MET   1 -12.411   2.308  22.432
    8    HG3  MET   1           2HG      MET   1 -12.186   1.121  23.716
    9    HE1  MET   1           3HE      MET   1 -13.136   4.018  24.369
   10    HE2  MET   1           1HE      MET   1 -12.101   4.442  25.732
   11    HE3  MET   1           2HE      MET   1 -12.784   2.819  25.615
   12    H    GLU   2           H        GLU   2 -13.783  -0.232  21.158
   13    HA   GLU   2           HA       GLU   2 -14.102   0.562  18.457
   14    HB2  GLU   2           1HB      GLU   2 -15.646  -0.976  19.638
   15    HB3  GLU   2           2HB      GLU   2 -16.213   0.374  20.613
   16    HG2  GLU   2           1HG      GLU   2 -17.073   1.480  18.643
   17    HG3  GLU   2           2HG      GLU   2 -16.430   0.200  17.615
   18    H    VAL   3           H        VAL   3 -14.330   2.488  17.576
   19    HA   VAL   3           HA       VAL   3 -14.947   4.781  19.320
   20    HB   VAL   3           HB       VAL   3 -13.347   4.800  16.750
   21   HG11  VAL   3          1HG1      VAL   3 -13.931   7.012  18.716
   22   HG12  VAL   3          2HG1      VAL   3 -14.585   6.869  17.084
   23   HG13  VAL   3          3HG1      VAL   3 -12.856   7.132  17.322
   24   HG21  VAL   3          3HG2      VAL   3 -12.439   5.119  19.610
   25   HG22  VAL   3          1HG2      VAL   3 -11.426   5.333  18.181
   26   HG23  VAL   3          2HG2      VAL   3 -12.102   3.747  18.554
   27    H    GLN   4           H        GLN   4 -16.761   5.859  18.884
   28    HA   GLN   4           HA       GLN   4 -18.522   4.923  16.840
   29    HB2  GLN   4           1HB      GLN   4 -18.729   7.323  18.662
   30    HB3  GLN   4           2HB      GLN   4 -20.019   6.748  17.617
   31    HG2  GLN   4           1HG      GLN   4 -20.022   4.614  18.839
   32    HG3  GLN   4           2HG      GLN   4 -18.783   5.255  19.917
   33   HE21  GLN   4          2HE2      GLN   4 -21.517   4.348  20.467
   34   HE22  GLN   4          1HE2      GLN   4 -22.319   5.681  21.224
   35    H    SER   5           H        SER   5 -16.459   7.760  17.193
   36    HA   SER   5           HA       SER   5 -17.611   8.985  14.838
   37    HB2  SER   5           1HB      SER   5 -16.900  10.302  16.872
   38    HB3  SER   5           2HB      SER   5 -15.230   9.952  16.428
   39    HG   SER   5           HG       SER   5 -17.129  11.582  15.149
   40    H    MET   6           H        MET   6 -17.088   7.609  13.178
   41    HA   MET   6           HA       MET   6 -14.250   7.688  12.399
   42    HB2  MET   6           1HB      MET   6 -16.327   5.593  11.715
   43    HB3  MET   6           2HB      MET   6 -14.711   5.657  11.024
   44    HG2  MET   6           1HG      MET   6 -13.773   5.410  13.297
   45    HG3  MET   6           2HG      MET   6 -15.411   5.235  13.921
   46    HE1  MET   6           3HE      MET   6 -16.815   3.544  11.636
   47    HE2  MET   6           1HE      MET   6 -17.006   3.188  13.353
   48    HE3  MET   6           2HE      MET   6 -16.574   1.899  12.229
   49    H    LEU   7           H        LEU   7 -13.923   9.095  10.839
   50    HA   LEU   7           HA       LEU   7 -16.180  10.257   9.471
   51    HB2  LEU   7           1HB      LEU   7 -13.235  10.894   9.277
   52    HB3  LEU   7           2HB      LEU   7 -14.539  11.867   8.622
   53    HG   LEU   7           HG       LEU   7 -14.130  11.306  11.561
   54   HD11  LEU   7          1HD1      LEU   7 -13.394  13.631  11.705
   55   HD12  LEU   7          2HD1      LEU   7 -13.511  13.778   9.952
   56   HD13  LEU   7          3HD1      LEU   7 -12.330  12.680  10.669
   57   HD21  LEU   7          3HD2      LEU   7 -15.795  13.069  11.878
   58   HD22  LEU   7          1HD2      LEU   7 -16.458  11.717  10.960
   59   HD23  LEU   7          2HD2      LEU   7 -15.991  13.202  10.131
   60    H    LEU   8           H        LEU   8 -15.955  10.788   7.104
   61    HA   LEU   8           HA       LEU   8 -15.780   8.390   5.599
   62    HB2  LEU   8           1HB      LEU   8 -17.264  10.299   5.054
   63    HB3  LEU   8           2HB      LEU   8 -15.854  11.247   4.620
   64    HG   LEU   8           HG       LEU   8 -15.361   9.603   2.814
   65   HD11  LEU   8          1HD1      LEU   8 -16.493   7.667   3.756
   66   HD12  LEU   8          2HD1      LEU   8 -17.126   8.037   2.151
   67   HD13  LEU   8          3HD1      LEU   8 -18.051   8.478   3.586
   68   HD21  LEU   8          3HD2      LEU   8 -18.092  10.877   2.703
   69   HD22  LEU   8          1HD2      LEU   8 -17.128  10.365   1.318
   70   HD23  LEU   8          2HD2      LEU   8 -16.562  11.680   2.348
   71    H    ASN   9           H        ASN   9 -13.512  10.893   6.356
   72    HA   ASN   9           HA       ASN   9 -11.620   9.895   4.365
   73    HB2  ASN   9           1HB      ASN   9 -11.449  12.263   6.237
   74    HB3  ASN   9           2HB      ASN   9 -10.191  11.800   5.095
   75   HD21  ASN   9          2HD2      ASN   9 -12.249  10.942   3.133
   76   HD22  ASN   9          1HD2      ASN   9 -12.831  12.410   2.429
   77    H    ASP  10           H        ASP  10 -12.561   9.124   7.379
   78    HA   ASP  10           HA       ASP  10  -9.916   8.070   8.111
   79    HB2  ASP  10           1HB      ASP  10 -11.043   9.302   9.922
   80    HB3  ASP  10           2HB      ASP  10 -12.456   8.266   9.760
   81    H    VAL  11           H        VAL  11 -10.106   6.607   6.338
   82    HA   VAL  11           HA       VAL  11 -12.311   4.706   6.443
   83    HB   VAL  11           HB       VAL  11 -12.034   5.758   4.295
   84   HG11  VAL  11          1HG1      VAL  11  -9.204   4.729   4.314
   85   HG12  VAL  11          2HG1      VAL  11  -9.700   6.414   4.474
   86   HG13  VAL  11          3HG1      VAL  11  -9.998   5.546   2.968
   87   HG21  VAL  11          3HG2      VAL  11 -11.033   2.915   4.209
   88   HG22  VAL  11          1HG2      VAL  11 -11.719   3.804   2.850
   89   HG23  VAL  11          2HG2      VAL  11 -12.720   3.429   4.254
   90    H    LYS  12           H        LYS  12 -12.048   2.717   7.094
   91    HA   LYS  12           HA       LYS  12  -9.311   1.757   7.526
   92    HB2  LYS  12           1HB      LYS  12 -11.837   1.010   9.021
   93    HB3  LYS  12           2HB      LYS  12 -10.216   0.418   9.374
   94    HG2  LYS  12           1HG      LYS  12  -9.484   2.608  10.006
   95    HG3  LYS  12           2HG      LYS  12 -11.009   3.317   9.477
   96    HD2  LYS  12           1HD      LYS  12 -12.172   1.969  11.209
   97    HD3  LYS  12           2HD      LYS  12 -10.592   1.423  11.785
   98    HE2  LYS  12           1HE      LYS  12  -9.949   3.714  12.261
   99    HE3  LYS  12           2HE      LYS  12 -11.481   4.299  11.615
  100    HZ1  LYS  12           3HZ      LYS  12 -11.608   4.257  13.976
  101    HZ2  LYS  12           1HZ      LYS  12 -11.086   2.642  14.047
  102    HZ3  LYS  12           2HZ      LYS  12 -12.603   3.017  13.385
  103    H    TRP  13           H        TRP  13  -9.081  -0.645   7.358
  104    HA   TRP  13           HA       TRP  13 -10.391  -1.388   4.880
  105    HB2  TRP  13           1HB      TRP  13  -7.831  -1.973   6.115
  106    HB3  TRP  13           2HB      TRP  13  -8.608  -3.419   5.469
  107    HD1  TRP  13           HD1      TRP  13  -9.893  -2.528   2.884
  108    HE1  TRP  13           HE1      TRP  13  -8.544  -1.613   0.906
  109    HE3  TRP  13           HE3      TRP  13  -5.679  -1.086   5.388
  110    HZ2  TRP  13           HZ2      TRP  13  -6.002  -0.445   0.451
  111    HZ3  TRP  13           HZ3      TRP  13  -3.832  -0.084   4.109
  112    HH2  TRP  13           HH2      TRP  13  -3.991   0.229   1.693
  113    H    GLU  14           H        GLU  14 -11.760  -2.943   4.568
  114    HA   GLU  14           HA       GLU  14 -13.050  -4.270   6.742
  115    HB2  GLU  14           1HB      GLU  14 -13.220  -4.935   3.795
  116    HB3  GLU  14           2HB      GLU  14 -14.422  -5.274   5.035
  117    HG2  GLU  14           1HG      GLU  14 -14.955  -2.967   5.261
  118    HG3  GLU  14           2HG      GLU  14 -13.593  -2.495   4.246
  119    H    LYS  15           H        LYS  15 -10.570  -5.000   4.455
  120    HA   LYS  15           HA       LYS  15  -9.926  -7.447   5.941
  121    HB2  LYS  15           1HB      LYS  15  -9.747  -6.991   2.956
  122    HB3  LYS  15           2HB      LYS  15  -8.969  -8.332   3.781
  123    HG2  LYS  15           1HG      LYS  15 -11.062  -9.274   4.395
  124    HG3  LYS  15           2HG      LYS  15 -11.933  -7.835   3.858
  125    HD2  LYS  15           1HD      LYS  15 -11.354  -8.265   1.570
  126    HD3  LYS  15           2HD      LYS  15 -10.287  -9.589   2.041
  127    HE2  LYS  15           1HE      LYS  15 -12.130 -10.923   2.743
  128    HE3  LYS  15           2HE      LYS  15 -13.247  -9.567   2.587
  129    HZ1  LYS  15           3HZ      LYS  15 -11.742 -10.649   0.278
  130    HZ2  LYS  15           1HZ      LYS  15 -13.102  -9.634   0.262
  131    HZ3  LYS  15           2HZ      LYS  15 -13.259 -11.261   0.733
  132    HA   PRO  16           HA       PRO  16  -6.501  -4.582   6.671
  133    HB2  PRO  16           1HB      PRO  16  -5.521  -6.990   8.118
  134    HB3  PRO  16           2HB      PRO  16  -5.636  -5.314   8.667
  135    HG2  PRO  16           1HG      PRO  16  -7.375  -7.138   9.516
  136    HG3  PRO  16           2HG      PRO  16  -7.902  -5.487   9.139
  137    HD2  PRO  16           1HD      PRO  16  -8.234  -7.995   7.547
  138    HD3  PRO  16           2HD      PRO  16  -9.356  -6.635   7.759
  139    H    VAL  17           H        VAL  17  -4.493  -4.345   5.822
  140    HA   VAL  17           HA       VAL  17  -3.581  -6.489   4.030
  141    HB   VAL  17           HB       VAL  17  -2.799  -3.564   4.030
  142   HG11  VAL  17          1HG1      VAL  17  -2.228  -5.758   2.040
  143   HG12  VAL  17          2HG1      VAL  17  -1.056  -5.007   3.124
  144   HG13  VAL  17          3HG1      VAL  17  -1.809  -4.057   1.842
  145   HG21  VAL  17          3HG2      VAL  17  -4.690  -5.068   2.228
  146   HG22  VAL  17          1HG2      VAL  17  -4.169  -3.398   2.000
  147   HG23  VAL  17          2HG2      VAL  17  -5.133  -3.837   3.411
  148    H    THR  18           H        THR  18  -1.801  -7.593   4.556
  149    HA   THR  18           HA       THR  18  -0.036  -6.443   6.612
  150    HB   THR  18           HB       THR  18  -0.282  -9.377   5.945
  151    HG1  THR  18           HG1      THR  18  -2.092  -7.811   7.131
  152   HG21  THR  18          3HG2      THR  18   1.744  -8.705   7.149
  153   HG22  THR  18          1HG2      THR  18   0.684  -9.664   8.182
  154   HG23  THR  18          2HG2      THR  18   0.756  -7.913   8.376
  155    H    ILE  19           H        ILE  19   1.710  -5.610   5.719
  156    HA   ILE  19           HA       ILE  19   2.831  -6.849   3.291
  157    HB   ILE  19           HB       ILE  19   3.127  -4.051   4.400
  158   HG12  ILE  19          1HG1      ILE  19   0.991  -4.607   3.226
  159   HG13  ILE  19          2HG1      ILE  19   1.921  -3.328   2.452
  160   HG21  ILE  19          1HG2      ILE  19   4.458  -3.539   2.412
  161   HG22  ILE  19          2HG2      ILE  19   4.414  -5.239   1.946
  162   HG23  ILE  19          3HG2      ILE  19   5.240  -4.752   3.427
  163   HD11  ILE  19          3HD1      ILE  19   2.747  -4.927   0.815
  164   HD12  ILE  19          1HD1      ILE  19   0.986  -4.837   0.818
  165   HD13  ILE  19          2HD1      ILE  19   1.800  -6.202   1.585
  166    H    SER  20           H        SER  20   4.665  -7.967   3.520
  167    HA   SER  20           HA       SER  20   6.189  -7.755   5.976
  168    HB2  SER  20           1HB      SER  20   6.735  -9.491   3.554
  169    HB3  SER  20           2HB      SER  20   7.412  -9.683   5.172
  170    HG   SER  20           HG       SER  20   4.665  -9.897   4.473
  171    H    LEU  21           H        LEU  21   7.696  -6.260   6.194
  172    HA   LEU  21           HA       LEU  21   8.803  -4.821   4.006
  173    HB2  LEU  21           1HB      LEU  21   9.261  -4.878   6.954
  174    HB3  LEU  21           2HB      LEU  21  10.404  -4.040   5.922
  175    HG   LEU  21           HG       LEU  21   7.449  -3.439   5.966
  176   HD11  LEU  21          1HD1      LEU  21   8.443  -2.946   8.143
  177   HD12  LEU  21          2HD1      LEU  21   8.046  -1.462   7.277
  178   HD13  LEU  21          3HD1      LEU  21   9.719  -2.016   7.356
  179   HD21  LEU  21          3HD2      LEU  21   8.601  -2.848   3.897
  180   HD22  LEU  21          1HD2      LEU  21   9.820  -1.967   4.816
  181   HD23  LEU  21          2HD2      LEU  21   8.148  -1.402   4.799
  182    H    GLN  22           H        GLN  22  11.376  -4.450   4.296
  183    HA   GLN  22           HA       GLN  22  12.489  -6.698   2.998
  184    HB2  GLN  22           1HB      GLN  22  13.145  -4.266   2.700
  185    HB3  GLN  22           2HB      GLN  22  14.016  -4.396   4.221
  186    HG2  GLN  22           1HG      GLN  22  15.515  -4.653   2.336
  187    HG3  GLN  22           2HG      GLN  22  15.429  -6.140   3.278
  188   HE21  GLN  22          2HE2      GLN  22  16.171  -7.339   1.510
  189   HE22  GLN  22          1HE2      GLN  22  15.142  -7.699   0.165
  190    H    ASN  23           H        ASN  23  12.545  -5.549   6.293
  191    HA   ASN  23           HA       ASN  23  14.528  -7.432   7.194
  192    HB2  ASN  23           1HB      ASN  23  12.583  -5.667   8.695
  193    HB3  ASN  23           2HB      ASN  23  13.749  -6.719   9.487
  194   HD21  ASN  23          2HD2      ASN  23  15.934  -6.225   9.392
  195   HD22  ASN  23          1HD2      ASN  23  16.497  -4.657   8.915
  196    H    GLY  24           H        GLY  24  11.622  -8.039   5.991
  197    HA2  GLY  24           1HA      GLY  24  10.232  -9.868   6.123
  198    HA3  GLY  24           2HA      GLY  24  11.341 -10.553   7.306
  199    H    ALA  25           H        ALA  25   9.769  -7.444   7.603
  200    HA   ALA  25           HA       ALA  25   8.333  -8.471   9.953
  201    HB1  ALA  25           3HB      ALA  25  10.011  -6.745  10.445
  202    HB2  ALA  25           1HB      ALA  25   8.376  -6.197  10.818
  203    HB3  ALA  25           2HB      ALA  25   9.180  -5.638   9.351
  204    HA   PRO  26           HA       PRO  26   4.820  -7.581   7.249
  205    HB2  PRO  26           1HB      PRO  26   3.314  -9.270   9.060
  206    HB3  PRO  26           2HB      PRO  26   3.734  -9.562   7.373
  207    HG2  PRO  26           1HG      PRO  26   4.770 -10.997   9.443
  208    HG3  PRO  26           2HG      PRO  26   5.627 -10.734   7.913
  209    HD2  PRO  26           1HD      PRO  26   5.960  -9.332  10.541
  210    HD3  PRO  26           2HD      PRO  26   7.199  -9.876   9.388
  211    H    ARG  27           H        ARG  27   4.080  -5.577   7.630
  212    HA   ARG  27           HA       ARG  27   3.068  -4.883  10.288
  213    HB2  ARG  27           1HB      ARG  27   3.403  -3.179   7.808
  214    HB3  ARG  27           2HB      ARG  27   2.833  -2.595   9.363
  215    HG2  ARG  27           1HG      ARG  27   5.006  -3.266  10.353
  216    HG3  ARG  27           2HG      ARG  27   5.565  -3.689   8.733
  217    HD2  ARG  27           1HD      ARG  27   6.342  -1.477   9.279
  218    HD3  ARG  27           2HD      ARG  27   5.116  -1.361   8.017
  219    HE   ARG  27           HE       ARG  27   4.119  -1.040  10.720
  220   HH11  ARG  27          1HH1      ARG  27   5.414   0.585   7.893
  221   HH12  ARG  27          2HH1      ARG  27   4.741   2.125   8.319
  222   HH21  ARG  27          1HH2      ARG  27   3.232   0.997  11.270
  223   HH22  ARG  27          2HH2      ARG  27   3.506   2.363  10.220
  224    H    ILE  28           H        ILE  28   0.974  -4.957  10.769
  225    HA   ILE  28           HA       ILE  28  -0.917  -5.598   8.652
  226    HB   ILE  28           HB       ILE  28  -1.368  -5.403  11.636
  227   HG12  ILE  28          1HG1      ILE  28  -0.958  -7.832   9.873
  228   HG13  ILE  28          2HG1      ILE  28   0.227  -7.182  11.001
  229   HG21  ILE  28          1HG2      ILE  28  -3.109  -6.549   9.453
  230   HG22  ILE  28          2HG2      ILE  28  -3.419  -5.071  10.364
  231   HG23  ILE  28          3HG2      ILE  28  -3.442  -6.633  11.182
  232   HD11  ILE  28          3HD1      ILE  28  -1.276  -7.674  12.860
  233   HD12  ILE  28          1HD1      ILE  28  -0.898  -9.120  11.924
  234   HD13  ILE  28          2HD1      ILE  28  -2.460  -8.325  11.727
  235    H    PHE  29           H        PHE  29  -1.652  -3.921   7.539
  236    HA   PHE  29           HA       PHE  29  -2.155  -1.372   8.858
  237    HB2  PHE  29           1HB      PHE  29  -2.626  -2.056   5.952
  238    HB3  PHE  29           2HB      PHE  29  -2.447  -0.458   6.664
  239    HD1  PHE  29           HD2      PHE  29  -0.141  -0.044   7.874
  240    HD2  PHE  29           HD1      PHE  29  -0.827  -3.004   4.898
  241    HE1  PHE  29           HE2      PHE  29   2.274  -0.125   7.396
  242    HE2  PHE  29           HE1      PHE  29   1.573  -3.088   4.420
  243    HZ   PHE  29           HZ       PHE  29   3.125  -1.656   5.658
  244    H    ASN  30           H        ASN  30  -4.061  -0.922   9.692
  245    HA   ASN  30           HA       ASN  30  -6.371  -2.557   8.876
  246    HB2  ASN  30           1HB      ASN  30  -6.036  -0.902  11.392
  247    HB3  ASN  30           2HB      ASN  30  -7.353  -2.013  11.035
  248   HD21  ASN  30          2HD2      ASN  30  -4.101  -1.685  12.119
  249   HD22  ASN  30          1HD2      ASN  30  -3.841  -3.348  12.523
  250    H    GLY  31           H        GLY  31  -4.976   0.503   8.721
  251    HA2  GLY  31           1HA      GLY  31  -7.515   1.619   7.710
  252    HA3  GLY  31           2HA      GLY  31  -6.407   2.576   8.689
  253    H    VAL  32           H        VAL  32  -7.342   3.018   5.938
  254    HA   VAL  32           HA       VAL  32  -5.274   2.312   4.126
  255    HB   VAL  32           HB       VAL  32  -7.300   4.543   3.878
  256   HG11  VAL  32          1HG1      VAL  32  -5.655   3.128   1.782
  257   HG12  VAL  32          2HG1      VAL  32  -5.468   4.802   2.305
  258   HG13  VAL  32          3HG1      VAL  32  -6.933   4.300   1.460
  259   HG21  VAL  32          3HG2      VAL  32  -8.396   2.409   4.249
  260   HG22  VAL  32          1HG2      VAL  32  -7.434   1.669   2.968
  261   HG23  VAL  32          2HG2      VAL  32  -8.613   2.921   2.576
  262    H    TYR  33           H        TYR  33  -5.737   4.970   6.338
  263    HA   TYR  33           HA       TYR  33  -3.853   6.748   5.194
  264    HB2  TYR  33           1HB      TYR  33  -5.542   7.414   6.910
  265    HB3  TYR  33           2HB      TYR  33  -4.622   6.516   8.114
  266    HD1  TYR  33           HD2      TYR  33  -4.538   9.424   5.843
  267    HD2  TYR  33           HD1      TYR  33  -2.661   7.444   9.105
  268    HE1  TYR  33           HE2      TYR  33  -3.137  11.404   6.229
  269    HE2  TYR  33           HE1      TYR  33  -1.254   9.418   9.501
  270    HH   TYR  33           HH       TYR  33  -1.856  12.442   7.992
  271    H    GLU  34           H        GLU  34  -3.582   4.063   7.435
  272    HA   GLU  34           HA       GLU  34  -0.920   4.499   8.257
  273    HB2  GLU  34           1HB      GLU  34  -2.282   1.820   7.961
  274    HB3  GLU  34           2HB      GLU  34  -0.952   2.224   9.037
  275    HG2  GLU  34           1HG      GLU  34  -2.460   3.736  10.273
  276    HG3  GLU  34           2HG      GLU  34  -3.785   3.217   9.230
  277    H    ALA  35           H        ALA  35  -2.359   2.719   5.588
  278    HA   ALA  35           HA       ALA  35   0.042   1.598   4.588
  279    HB1  ALA  35           3HB      ALA  35  -2.194   0.726   4.056
  280    HB2  ALA  35           1HB      ALA  35  -1.249   1.068   2.606
  281    HB3  ALA  35           2HB      ALA  35  -2.524   2.179   3.113
  282    H    PHE  36           H        PHE  36  -1.773   4.535   3.809
  283    HA   PHE  36           HA       PHE  36  -0.181   5.477   1.712
  284    HB2  PHE  36           1HB      PHE  36  -2.334   6.482   2.244
  285    HB3  PHE  36           2HB      PHE  36  -1.732   7.018   3.809
  286    HD1  PHE  36           HD2      PHE  36  -1.203   7.430   0.154
  287    HD2  PHE  36           HD1      PHE  36  -0.760   9.113   4.040
  288    HE1  PHE  36           HE2      PHE  36  -0.495   9.561  -0.851
  289    HE2  PHE  36           HE1      PHE  36  -0.049  11.245   3.039
  290    HZ   PHE  36           HZ       PHE  36   0.084  11.471   0.590
  291    H    ASP  37           H        ASP  37   0.068   6.006   5.201
  292    HA   ASP  37           HA       ASP  37   2.342   7.664   5.174
  293    HB2  ASP  37           1HB      ASP  37   0.893   7.395   7.145
  294    HB3  ASP  37           2HB      ASP  37   1.406   5.720   7.303
  295    H    PHE  38           H        PHE  38   1.964   4.176   5.423
  296    HA   PHE  38           HA       PHE  38   4.594   3.403   5.836
  297    HB2  PHE  38           1HB      PHE  38   2.800   1.833   6.046
  298    HB3  PHE  38           2HB      PHE  38   2.324   2.061   4.369
  299    HD1  PHE  38           HD2      PHE  38   5.254   0.961   6.389
  300    HD2  PHE  38           HD1      PHE  38   2.981   0.498   2.823
  301    HE1  PHE  38           HE2      PHE  38   6.657  -0.951   5.744
  302    HE2  PHE  38           HE1      PHE  38   4.378  -1.414   2.175
  303    HZ   PHE  38           HZ       PHE  38   6.218  -2.142   3.637
  304    H    LEU  39           H        LEU  39   2.902   4.015   2.788
  305    HA   LEU  39           HA       LEU  39   4.921   3.067   1.074
  306    HB2  LEU  39           1HB      LEU  39   2.786   5.133   0.549
  307    HB3  LEU  39           2HB      LEU  39   3.737   4.325  -0.681
  308    HG   LEU  39           HG       LEU  39   1.818   2.954   1.201
  309   HD11  LEU  39          1HD1      LEU  39   1.549   3.625  -1.724
  310   HD12  LEU  39          2HD1      LEU  39   0.670   4.389  -0.401
  311   HD13  LEU  39          3HD1      LEU  39   0.405   2.684  -0.768
  312   HD21  LEU  39          3HD2      LEU  39   2.149   1.013  -0.245
  313   HD22  LEU  39          1HD2      LEU  39   3.661   1.514   0.513
  314   HD23  LEU  39          2HD2      LEU  39   3.348   1.910  -1.178
  315    H    GLN  40           H        GLN  40   4.726   5.991   2.867
  316    HA   GLN  40           HA       GLN  40   6.660   7.311   1.110
  317    HB2  GLN  40           1HB      GLN  40   5.100   8.326   3.490
  318    HB3  GLN  40           2HB      GLN  40   6.300   9.279   2.630
  319    HG2  GLN  40           1HG      GLN  40   4.972   9.113   0.589
  320    HG3  GLN  40           2HG      GLN  40   3.769   8.155   1.454
  321   HE21  GLN  40          2HE2      GLN  40   3.594  10.773   0.098
  322   HE22  GLN  40          1HE2      GLN  40   2.963  11.859   1.291
  323    H    HIS  41           H        HIS  41   6.398   5.828   4.252
  324    HA   HIS  41           HA       HIS  41   8.887   6.977   5.157
  325    HB2  HIS  41           1HB      HIS  41   6.890   5.119   6.404
  326    HB3  HIS  41           2HB      HIS  41   8.482   5.341   7.127
  327    HD1  HIS  41           HD1      HIS  41   8.858   7.438   8.487
  328    HD2  HIS  41           HD2      HIS  41   5.292   7.516   6.349
  329    HE1  HIS  41           HE1      HIS  41   7.620   9.465   9.306
  330    HE2  HIS  41           HE2      HIS  41   5.391   9.383   8.137
  331    H    GLU  42           H        GLU  42   7.770   3.806   4.014
  332    HA   GLU  42           HA       GLU  42  10.452   3.129   3.286
  333    HB2  GLU  42           1HB      GLU  42  10.353   2.674   5.785
  334    HB3  GLU  42           2HB      GLU  42   9.210   1.391   5.417
  335    HG2  GLU  42           1HG      GLU  42  10.848   0.205   4.153
  336    HG3  GLU  42           2HG      GLU  42  11.983   1.548   4.271
  337    H    TRP  43           H        TRP  43   9.278   3.003   1.282
  338    HA   TRP  43           HA       TRP  43   7.915   0.405   0.994
  339    HB2  TRP  43           1HB      TRP  43   6.466   2.321   0.465
  340    HB3  TRP  43           2HB      TRP  43   7.639   2.888  -0.715
  341    HD1  TRP  43           HD1      TRP  43   6.859   2.392  -3.069
  342    HE1  TRP  43           HE1      TRP  43   5.564   0.509  -4.249
  343    HE3  TRP  43           HE3      TRP  43   5.984  -0.642   0.953
  344    HZ2  TRP  43           HZ2      TRP  43   4.338  -1.934  -3.570
  345    HZ3  TRP  43           HZ3      TRP  43   4.745  -2.735   0.598
  346    HH2  TRP  43           HH2      TRP  43   3.940  -3.367  -1.616
  347    HA   PRO  44           HA       PRO  44  11.852  -0.526  -0.945
  348    HB2  PRO  44           1HB      PRO  44  10.552  -3.127  -1.456
  349    HB3  PRO  44           2HB      PRO  44  12.043  -2.766  -0.582
  350    HG2  PRO  44           1HG      PRO  44   9.822  -3.513   0.706
  351    HG3  PRO  44           2HG      PRO  44  10.929  -2.310   1.396
  352    HD2  PRO  44           1HD      PRO  44   8.304  -1.905   0.013
  353    HD3  PRO  44           2HD      PRO  44   8.964  -1.088   1.447
  354    H    ALA  45           H        ALA  45   8.731  -1.183  -2.483
  355    HA   ALA  45           HA       ALA  45   9.876  -1.778  -5.041
  356    HB1  ALA  45           3HB      ALA  45   7.586  -1.796  -5.858
  357    HB2  ALA  45           1HB      ALA  45   7.024  -1.096  -4.340
  358    HB3  ALA  45           2HB      ALA  45   7.720  -2.717  -4.360
  359    H    ARG  46           H        ARG  46  10.903  -0.268  -6.161
  360    HA   ARG  46           HA       ARG  46   9.968   2.507  -5.956
  361    HB2  ARG  46           1HB      ARG  46  12.590   1.541  -7.096
  362    HB3  ARG  46           2HB      ARG  46  12.155   3.190  -6.665
  363    HG2  ARG  46           1HG      ARG  46  11.924   2.403  -4.295
  364    HG3  ARG  46           2HG      ARG  46  12.631   0.873  -4.814
  365    HD2  ARG  46           1HD      ARG  46  14.551   2.280  -5.738
  366    HD3  ARG  46           2HD      ARG  46  13.885   3.600  -4.777
  367    HE   ARG  46           HE       ARG  46  15.267   1.246  -3.816
  368   HH11  ARG  46          1HH1      ARG  46  13.179   3.934  -2.978
  369   HH12  ARG  46          2HH1      ARG  46  13.579   3.884  -1.294
  370   HH21  ARG  46          1HH2      ARG  46  15.794   1.182  -1.594
  371   HH22  ARG  46          2HH2      ARG  46  15.069   2.327  -0.503
  372    H    GLY  47           H        GLY  47  10.730   3.735  -8.121
  373    HA2  GLY  47           1HA      GLY  47  10.644   3.245 -10.607
  374    HA3  GLY  47           2HA      GLY  47   9.168   2.367 -10.222
  375    H    ASP  48           H        ASP  48   8.735   4.469  -8.088
  376    HA   ASP  48           HA       ASP  48   7.679   6.414  -7.732
  377    HB2  ASP  48           1HB      ASP  48   9.125   7.073 -10.245
  378    HB3  ASP  48           2HB      ASP  48   7.866   8.173  -9.688
  379    H    ARG  49           H        ARG  49   7.114   5.474 -11.135
  380    HA   ARG  49           HA       ARG  49   4.551   6.619 -11.261
  381    HB2  ARG  49           1HB      ARG  49   5.793   4.365 -12.833
  382    HB3  ARG  49           2HB      ARG  49   4.214   5.049 -13.206
  383    HG2  ARG  49           1HG      ARG  49   5.206   7.218 -13.596
  384    HG3  ARG  49           2HG      ARG  49   6.791   6.605 -13.126
  385    HD2  ARG  49           1HD      ARG  49   5.173   5.598 -15.461
  386    HD3  ARG  49           2HD      ARG  49   6.481   6.774 -15.577
  387    HE   ARG  49           HE       ARG  49   6.756   3.926 -14.896
  388   HH11  ARG  49          1HH1      ARG  49   8.216   7.002 -15.729
  389   HH12  ARG  49          2HH1      ARG  49   9.773   6.315 -16.055
  390   HH21  ARG  49          1HH2      ARG  49   8.790   3.023 -15.351
  391   HH22  ARG  49          2HH2      ARG  49  10.098   4.050 -15.867
  392    H    ALA  50           H        ALA  50   5.498   3.242 -10.603
  393    HA   ALA  50           HA       ALA  50   2.860   2.379  -9.987
  394    HB1  ALA  50           3HB      ALA  50   4.624   0.807 -10.590
  395    HB2  ALA  50           1HB      ALA  50   3.946   0.412  -9.011
  396    HB3  ALA  50           2HB      ALA  50   5.509   1.221  -9.122
  397    H    HIS  51           H        HIS  51   5.388   3.928  -8.175
  398    HA   HIS  51           HA       HIS  51   4.383   3.425  -5.567
  399    HB2  HIS  51           1HB      HIS  51   6.713   4.071  -5.970
  400    HB3  HIS  51           2HB      HIS  51   6.192   5.629  -6.594
  401    HD1  HIS  51           HD1      HIS  51   6.490   7.446  -4.965
  402    HD2  HIS  51           HD2      HIS  51   5.717   3.808  -3.091
  403    HE1  HIS  51           HE1      HIS  51   6.612   7.910  -2.491
  404    HE2  HIS  51           HE2      HIS  51   6.291   5.666  -1.382
  405    H    GLU  52           H        GLU  52   4.077   6.138  -7.817
  406    HA   GLU  52           HA       GLU  52   2.491   7.796  -6.174
  407    HB2  GLU  52           1HB      GLU  52   3.786   8.395  -8.303
  408    HB3  GLU  52           2HB      GLU  52   2.419   7.736  -9.190
  409    HG2  GLU  52           1HG      GLU  52   2.175  10.100  -9.078
  410    HG3  GLU  52           2HG      GLU  52   0.954   9.371  -8.035
  411    H    GLN  53           H        GLN  53   1.746   5.235  -8.458
  412    HA   GLN  53           HA       GLN  53  -1.017   5.575  -8.686
  413    HB2  GLN  53           1HB      GLN  53   0.319   4.026 -10.073
  414    HB3  GLN  53           2HB      GLN  53   0.546   2.985  -8.676
  415    HG2  GLN  53           1HG      GLN  53  -1.903   2.657  -8.574
  416    HG3  GLN  53           2HG      GLN  53  -2.059   3.614 -10.046
  417   HE21  GLN  53          2HE2      GLN  53  -1.294   2.781 -11.995
  418   HE22  GLN  53          1HE2      GLN  53  -0.973   1.087 -12.201
  419    H    ALA  54           H        ALA  54   0.825   3.524  -6.438
  420    HA   ALA  54           HA       ALA  54  -1.355   2.584  -4.947
  421    HB1  ALA  54           3HB      ALA  54   0.869   1.569  -4.850
  422    HB2  ALA  54           1HB      ALA  54   0.287   1.989  -3.240
  423    HB3  ALA  54           2HB      ALA  54   1.492   3.004  -4.034
  424    H    LEU  55           H        LEU  55   0.683   5.439  -4.555
  425    HA   LEU  55           HA       LEU  55  -0.389   6.366  -2.130
  426    HB2  LEU  55           1HB      LEU  55   0.809   7.887  -4.443
  427    HB3  LEU  55           2HB      LEU  55   0.435   8.601  -2.888
  428    HG   LEU  55           HG       LEU  55   2.403   6.349  -3.296
  429   HD11  LEU  55          1HD1      LEU  55   2.884   9.298  -2.890
  430   HD12  LEU  55          2HD1      LEU  55   3.167   8.395  -4.379
  431   HD13  LEU  55          3HD1      LEU  55   4.124   8.045  -2.940
  432   HD21  LEU  55          3HD2      LEU  55   3.096   6.881  -1.015
  433   HD22  LEU  55          1HD2      LEU  55   1.400   6.402  -1.070
  434   HD23  LEU  55          2HD2      LEU  55   1.830   8.104  -0.911
  435    H    ARG  56           H        ARG  56  -1.313   6.970  -5.493
  436    HA   ARG  56           HA       ARG  56  -3.273   8.918  -4.983
  437    HB2  ARG  56           1HB      ARG  56  -2.202   8.250  -7.213
  438    HB3  ARG  56           2HB      ARG  56  -3.389   6.955  -7.262
  439    HG2  ARG  56           1HG      ARG  56  -5.184   8.645  -7.114
  440    HG3  ARG  56           2HG      ARG  56  -3.955   9.908  -7.181
  441    HD2  ARG  56           1HD      ARG  56  -4.696   7.912  -9.302
  442    HD3  ARG  56           2HD      ARG  56  -4.788   9.669  -9.382
  443    HE   ARG  56           HE       ARG  56  -2.456   8.007  -9.815
  444   HH11  ARG  56          1HH1      ARG  56  -3.557  11.242  -9.009
  445   HH12  ARG  56          2HH1      ARG  56  -2.172  12.019  -9.709
  446   HH21  ARG  56          1HH2      ARG  56  -0.644   9.023 -10.720
  447   HH22  ARG  56          2HH2      ARG  56  -0.511  10.760 -10.699
  448    H    LEU  57           H        LEU  57  -3.463   5.400  -5.225
  449    HA   LEU  57           HA       LEU  57  -6.243   5.117  -5.012
  450    HB2  LEU  57           1HB      LEU  57  -4.074   3.282  -3.983
  451    HB3  LEU  57           2HB      LEU  57  -5.754   2.837  -4.217
  452    HG   LEU  57           HG       LEU  57  -3.904   3.709  -6.436
  453   HD11  LEU  57          1HD1      LEU  57  -4.781   0.939  -5.636
  454   HD12  LEU  57          2HD1      LEU  57  -3.154   1.605  -5.477
  455   HD13  LEU  57          3HD1      LEU  57  -3.852   1.354  -7.077
  456   HD21  LEU  57          3HD2      LEU  57  -6.254   4.141  -6.900
  457   HD22  LEU  57          1HD2      LEU  57  -6.656   2.474  -6.482
  458   HD23  LEU  57          2HD2      LEU  57  -5.656   2.813  -7.895
  459    H    CYS  58           H        CYS  58  -3.730   5.265  -2.525
  460    HA   CYS  58           HA       CYS  58  -5.450   4.944  -0.310
  461    HB2  CYS  58           1HB      CYS  58  -2.774   6.350  -0.444
  462    HB3  CYS  58           2HB      CYS  58  -3.572   5.784   1.021
  463    HG   CYS  58           HG       CYS  58  -2.189   3.888  -1.461
  464    H    ARG  59           H        ARG  59  -4.231   7.803  -2.000
  465    HA   ARG  59           HA       ARG  59  -5.268   9.746  -0.267
  466    HB2  ARG  59           1HB      ARG  59  -4.724   9.871  -3.231
  467    HB3  ARG  59           2HB      ARG  59  -5.157  11.268  -2.258
  468    HG2  ARG  59           1HG      ARG  59  -3.156  11.000  -0.928
  469    HG3  ARG  59           2HG      ARG  59  -2.733   9.540  -1.828
  470    HD2  ARG  59           1HD      ARG  59  -2.664  10.904  -3.898
  471    HD3  ARG  59           2HD      ARG  59  -2.945  12.341  -2.917
  472    HE   ARG  59           HE       ARG  59  -0.795  11.788  -1.788
  473   HH11  ARG  59          1HH1      ARG  59  -1.468  10.644  -5.020
  474   HH12  ARG  59          2HH1      ARG  59   0.211  10.498  -5.458
  475   HH21  ARG  59          1HH2      ARG  59   1.414  11.600  -2.368
  476   HH22  ARG  59          2HH2      ARG  59   1.834  11.033  -3.960
  477    H    ALA  60           H        ALA  60  -6.698   8.226  -3.145
  478    HA   ALA  60           HA       ALA  60  -9.059   9.751  -3.204
  479    HB1  ALA  60           3HB      ALA  60  -9.994   7.940  -4.562
  480    HB2  ALA  60           1HB      ALA  60  -8.630   6.911  -4.125
  481    HB3  ALA  60           2HB      ALA  60  -8.363   8.371  -5.082
  482    H    SER  61           H        SER  61  -8.251   6.761  -1.516
  483    HA   SER  61           HA       SER  61 -10.803   6.205  -0.467
  484    HB2  SER  61           1HB      SER  61  -8.116   5.577   0.782
  485    HB3  SER  61           2HB      SER  61  -9.641   4.743   1.083
  486    HG   SER  61           HG       SER  61  -8.053   4.733  -1.264
  487    H    LEU  62           H        LEU  62  -8.117   8.164   0.666
  488    HA   LEU  62           HA       LEU  62  -9.472   8.910   3.117
  489    HB2  LEU  62           1HB      LEU  62  -6.891   9.915   1.907
  490    HB3  LEU  62           2HB      LEU  62  -7.461  10.261   3.528
  491    HG   LEU  62           HG       LEU  62  -6.817   7.477   2.559
  492   HD11  LEU  62          1HD1      LEU  62  -4.721   7.712   3.817
  493   HD12  LEU  62          2HD1      LEU  62  -5.091   9.413   4.097
  494   HD13  LEU  62          3HD1      LEU  62  -4.808   8.831   2.457
  495   HD21  LEU  62          3HD2      LEU  62  -7.222   8.633   5.315
  496   HD22  LEU  62          1HD2      LEU  62  -6.753   6.971   4.957
  497   HD23  LEU  62          2HD2      LEU  62  -8.335   7.569   4.457
  498    H    MET  63           H        MET  63 -10.164   9.703   0.135
  499    HA   MET  63           HA       MET  63 -10.355  12.597   0.627
  500    HB2  MET  63           1HB      MET  63  -8.978  11.998  -1.327
  501    HB3  MET  63           2HB      MET  63 -10.349  11.149  -2.026
  502    HG2  MET  63           1HG      MET  63 -11.587  13.234  -2.179
  503    HG3  MET  63           2HG      MET  63 -10.249  14.100  -1.427
  504    HE1  MET  63           3HE      MET  63 -11.499  12.144  -4.571
  505    HE2  MET  63           1HE      MET  63 -10.079  11.200  -4.119
  506    HE3  MET  63           2HE      MET  63 -10.073  12.148  -5.608
  507    H    GLY  64           H        GLY  64 -12.118   9.922  -1.010
  508    HA2  GLY  64           1HA      GLY  64 -14.589  10.977   0.048
  509    HA3  GLY  64           2HA      GLY  64 -14.400  11.232  -1.675
  510    H    ASP  65           H        ASP  65 -13.578   8.962  -2.769
  511    HA   ASP  65           HA       ASP  65 -15.655   7.079  -1.914
  512    HB2  ASP  65           1HB      ASP  65 -16.796   8.476  -3.461
  513    HB3  ASP  65           2HB      ASP  65 -15.455   8.435  -4.598
  514    H    VAL  66           H        VAL  66 -13.904   5.738  -1.314
  515    HA   VAL  66           HA       VAL  66 -13.416   3.910  -3.546
  516    HB   VAL  66           HB       VAL  66 -11.349   4.662  -1.469
  517   HG11  VAL  66          1HG1      VAL  66 -11.360   2.323  -3.375
  518   HG12  VAL  66          2HG1      VAL  66 -11.393   2.248  -1.613
  519   HG13  VAL  66          3HG1      VAL  66  -9.963   2.862  -2.445
  520   HG21  VAL  66          3HG2      VAL  66  -9.919   5.059  -3.410
  521   HG22  VAL  66          1HG2      VAL  66 -11.368   6.065  -3.467
  522   HG23  VAL  66          2HG2      VAL  66 -11.250   4.626  -4.481
  523    H    ALA  67           H        ALA  67 -14.250   1.966  -3.096
  524    HA   ALA  67           HA       ALA  67 -15.363   1.550  -0.460
  525    HB1  ALA  67           3HB      ALA  67 -16.563  -0.308  -1.440
  526    HB2  ALA  67           1HB      ALA  67 -15.611  -0.173  -2.917
  527    HB3  ALA  67           2HB      ALA  67 -16.716   1.123  -2.460
  528    H    GLY  68           H        GLY  68 -13.283   1.312   0.585
  529    HA2  GLY  68           1HA      GLY  68 -11.714   0.004   1.665
  530    HA3  GLY  68           2HA      GLY  68 -13.120  -1.017   1.852
  531    H    GLU  69           H        GLU  69 -13.350  -2.854   0.579
  532    HA   GLU  69           HA       GLU  69 -11.084  -4.385   0.251
  533    HB2  GLU  69           1HB      GLU  69 -13.390  -5.251   0.463
  534    HB3  GLU  69           2HB      GLU  69 -13.718  -4.743  -1.187
  535    HG2  GLU  69           1HG      GLU  69 -12.036  -6.287  -2.016
  536    HG3  GLU  69           2HG      GLU  69 -11.655  -6.774  -0.365
  537    H    ILE  70           H        ILE  70 -12.666  -2.343  -2.149
  538    HA   ILE  70           HA       ILE  70 -11.353  -3.291  -4.444
  539    HB   ILE  70           HB       ILE  70 -12.253  -0.461  -3.860
  540   HG12  ILE  70          1HG1      ILE  70 -13.672  -2.733  -5.271
  541   HG13  ILE  70          2HG1      ILE  70 -14.059  -2.129  -3.665
  542   HG21  ILE  70          1HG2      ILE  70 -12.322  -0.203  -6.300
  543   HG22  ILE  70          2HG2      ILE  70 -11.629  -1.815  -6.482
  544   HG23  ILE  70          3HG2      ILE  70 -10.692  -0.532  -5.717
  545   HD11  ILE  70          3HD1      ILE  70 -15.620  -1.293  -5.321
  546   HD12  ILE  70          1HD1      ILE  70 -14.290  -0.580  -6.235
  547   HD13  ILE  70          2HD1      ILE  70 -14.679   0.027  -4.625
  548    H    ALA  71           H        ALA  71 -10.466  -0.650  -2.225
  549    HA   ALA  71           HA       ALA  71  -8.031   0.046  -3.403
  550    HB1  ALA  71           3HB      ALA  71  -9.160   1.372  -1.663
  551    HB2  ALA  71           1HB      ALA  71  -7.465   1.074  -1.288
  552    HB3  ALA  71           2HB      ALA  71  -8.727   0.151  -0.470
  553    H    ARG  72           H        ARG  72  -8.858  -2.555  -1.184
  554    HA   ARG  72           HA       ARG  72  -6.225  -3.217  -0.402
  555    HB2  ARG  72           1HB      ARG  72  -8.244  -4.045   0.768
  556    HB3  ARG  72           2HB      ARG  72  -8.606  -5.066  -0.617
  557    HG2  ARG  72           1HG      ARG  72  -6.384  -6.170  -0.268
  558    HG3  ARG  72           2HG      ARG  72  -6.253  -5.267   1.242
  559    HD2  ARG  72           1HD      ARG  72  -8.382  -6.281   1.985
  560    HD3  ARG  72           2HD      ARG  72  -8.405  -7.243   0.507
  561    HE   ARG  72           HE       ARG  72  -6.656  -7.596   2.812
  562   HH11  ARG  72          1HH1      ARG  72  -7.474  -8.520  -0.464
  563   HH12  ARG  72          2HH1      ARG  72  -6.579 -10.007  -0.407
  564   HH21  ARG  72          1HH2      ARG  72  -5.523  -9.600   2.911
  565   HH22  ARG  72          2HH2      ARG  72  -5.499 -10.637   1.511
  566    H    THR  73           H        THR  73  -8.329  -4.654  -2.895
  567    HA   THR  73           HA       THR  73  -6.410  -6.438  -3.915
  568    HB   THR  73           HB       THR  73  -8.677  -5.165  -5.461
  569    HG1  THR  73           HG1      THR  73  -9.600  -7.377  -4.683
  570   HG21  THR  73          3HG2      THR  73  -7.109  -6.437  -6.842
  571   HG22  THR  73          1HG2      THR  73  -8.656  -7.278  -6.715
  572   HG23  THR  73          2HG2      THR  73  -7.274  -7.825  -5.766
  573    H    ALA  74           H        ALA  74  -7.203  -3.094  -4.748
  574    HA   ALA  74           HA       ALA  74  -5.470  -2.874  -6.972
  575    HB1  ALA  74           3HB      ALA  74  -6.437  -0.714  -5.100
  576    HB2  ALA  74           1HB      ALA  74  -7.282  -1.289  -6.537
  577    HB3  ALA  74           2HB      ALA  74  -5.730  -0.465  -6.696
  578    H    PHE  75           H        PHE  75  -5.012  -2.449  -3.513
  579    HA   PHE  75           HA       PHE  75  -2.398  -1.362  -3.648
  580    HB2  PHE  75           1HB      PHE  75  -3.949  -1.304  -1.647
  581    HB3  PHE  75           2HB      PHE  75  -3.549  -2.997  -1.380
  582    HD1  PHE  75           HD2      PHE  75  -2.205   0.430  -1.418
  583    HD2  PHE  75           HD1      PHE  75  -1.493  -3.636  -0.385
  584    HE1  PHE  75           HE2      PHE  75  -0.233   1.111  -0.114
  585    HE2  PHE  75           HE1      PHE  75   0.480  -2.962   0.921
  586    HZ   PHE  75           HZ       PHE  75   1.112  -0.587   1.057
  587    H    VAL  76           H        VAL  76  -3.676  -4.650  -3.473
  588    HA   VAL  76           HA       VAL  76  -1.188  -5.980  -3.256
  589    HB   VAL  76           HB       VAL  76  -3.831  -6.920  -4.389
  590   HG11  VAL  76          1HG1      VAL  76  -2.034  -8.238  -5.375
  591   HG12  VAL  76          2HG1      VAL  76  -2.936  -9.202  -4.204
  592   HG13  VAL  76          3HG1      VAL  76  -1.358  -8.539  -3.774
  593   HG21  VAL  76          3HG2      VAL  76  -2.464  -7.476  -1.755
  594   HG22  VAL  76          1HG2      VAL  76  -4.026  -8.116  -2.271
  595   HG23  VAL  76          2HG2      VAL  76  -3.830  -6.384  -1.997
  596    H    ALA  77           H        ALA  77  -3.085  -4.870  -6.016
  597    HA   ALA  77           HA       ALA  77  -1.433  -5.965  -8.033
  598    HB1  ALA  77           3HB      ALA  77  -3.705  -5.184  -8.477
  599    HB2  ALA  77           1HB      ALA  77  -2.540  -4.390  -9.535
  600    HB3  ALA  77           2HB      ALA  77  -3.205  -3.525  -8.149
  601    H    ALA  78           H        ALA  78  -1.245  -3.047  -6.114
  602    HA   ALA  78           HA       ALA  78   0.884  -1.892  -7.668
  603    HB1  ALA  78           3HB      ALA  78  -0.665  -0.476  -6.417
  604    HB2  ALA  78           1HB      ALA  78   0.999  -0.222  -5.895
  605    HB3  ALA  78           2HB      ALA  78  -0.098  -1.185  -4.905
  606    H    SER  79           H        SER  79   0.618  -3.699  -4.632
  607    HA   SER  79           HA       SER  79   3.403  -3.517  -4.033
  608    HB2  SER  79           1HB      SER  79   2.828  -5.329  -2.335
  609    HB3  SER  79           2HB      SER  79   1.956  -3.804  -2.175
  610    HG   SER  79           HG       SER  79   0.144  -4.733  -2.891
  611    H    ARG  80           H        ARG  80   1.651  -5.379  -6.232
  612    HA   ARG  80           HA       ARG  80   3.143  -7.757  -6.303
  613    HB2  ARG  80           1HB      ARG  80   1.006  -7.150  -7.613
  614    HB3  ARG  80           2HB      ARG  80   2.086  -6.382  -8.768
  615    HG2  ARG  80           1HG      ARG  80   3.288  -8.632  -8.877
  616    HG3  ARG  80           2HG      ARG  80   1.872  -9.287  -8.056
  617    HD2  ARG  80           1HD      ARG  80   1.521  -9.611 -10.377
  618    HD3  ARG  80           2HD      ARG  80   0.480  -8.272  -9.893
  619    HE   ARG  80           HE       ARG  80   2.940  -7.232 -10.770
  620   HH11  ARG  80          1HH1      ARG  80   0.108  -8.846 -12.064
  621   HH12  ARG  80          2HH1      ARG  80   0.291  -8.164 -13.656
  622   HH21  ARG  80          1HH2      ARG  80   3.173  -6.326 -12.840
  623   HH22  ARG  80          2HH2      ARG  80   2.039  -6.715 -14.095
  624    H    GLN  81           H        GLN  81   3.833  -4.524  -7.293
  625    HA   GLN  81           HA       GLN  81   6.012  -5.080  -9.032
  626    HB2  GLN  81           1HB      GLN  81   5.218  -2.603  -7.500
  627    HB3  GLN  81           2HB      GLN  81   6.566  -2.652  -8.628
  628    HG2  GLN  81           1HG      GLN  81   3.731  -3.326  -9.371
  629    HG3  GLN  81           2HG      GLN  81   4.455  -1.731  -9.567
  630   HE21  GLN  81          2HE2      GLN  81   3.392  -3.620 -11.558
  631   HE22  GLN  81          1HE2      GLN  81   4.693  -3.903 -12.669
  632    H    ALA  82           H        ALA  82   5.668  -5.307  -5.669
  633    HA   ALA  82           HA       ALA  82   8.478  -4.881  -5.076
  634    HB1  ALA  82           3HB      ALA  82   6.801  -4.297  -3.400
  635    HB2  ALA  82           1HB      ALA  82   7.890  -5.546  -2.796
  636    HB3  ALA  82           2HB      ALA  82   6.267  -5.976  -3.338
  637    H    HIS  83           H        HIS  83   6.595  -7.316  -6.367
  638    HA   HIS  83           HA       HIS  83   7.029  -9.426  -7.054
  639    HB2  HIS  83           1HB      HIS  83   9.863  -8.815  -6.186
  640    HB3  HIS  83           2HB      HIS  83   9.374 -10.195  -7.163
  641    HD1  HIS  83           HD1      HIS  83   8.594  -9.672  -9.630
  642    HD2  HIS  83           HD2      HIS  83  10.185  -6.434  -7.557
  643    HE1  HIS  83           HE1      HIS  83   9.069  -7.917 -11.369
  644    HE2  HIS  83           HE2      HIS  83   9.914  -5.923 -10.080
  645    H    CYS  84           H        CYS  84   6.310  -8.819  -4.221
  646    HA   CYS  84           HA       CYS  84   6.658 -11.503  -3.239
  647    HB2  CYS  84           1HB      CYS  84   8.694 -10.315  -2.413
  648    HB3  CYS  84           2HB      CYS  84   7.648  -9.184  -1.562
  649    HG   CYS  84           HG       CYS  84   8.635 -12.243  -0.688
  650    H    LEU  85           H        LEU  85   4.454 -11.688  -3.346
  651    HA   LEU  85           HA       LEU  85   2.825  -9.828  -1.782
  652    HB2  LEU  85           1HB      LEU  85   2.047 -12.077  -3.643
  653    HB3  LEU  85           2HB      LEU  85   0.907 -11.070  -2.773
  654    HG   LEU  85           HG       LEU  85   2.863 -10.076  -4.843
  655   HD11  LEU  85          1HD1      LEU  85   1.138 -11.446  -5.854
  656   HD12  LEU  85          2HD1      LEU  85   0.865  -9.747  -6.232
  657   HD13  LEU  85          3HD1      LEU  85  -0.110 -10.543  -4.998
  658   HD21  LEU  85          3HD2      LEU  85   2.349  -8.400  -3.154
  659   HD22  LEU  85          1HD2      LEU  85   0.623  -8.675  -3.391
  660   HD23  LEU  85          2HD2      LEU  85   1.594  -7.991  -4.695
  661    H    MET  86           H        MET  86   1.649 -10.448   0.009
  662    HA   MET  86           HA       MET  86   2.723 -12.626   1.503
  663    HB2  MET  86           1HB      MET  86   1.895 -10.547   2.566
  664    HB3  MET  86           2HB      MET  86   0.256 -10.979   2.092
  665    HG2  MET  86           1HG      MET  86   0.533 -13.086   3.423
  666    HG3  MET  86           2HG      MET  86   2.049 -12.421   4.027
  667    HE1  MET  86           3HE      MET  86  -1.844 -12.089   3.938
  668    HE2  MET  86           1HE      MET  86  -1.341 -10.548   3.246
  669    HE3  MET  86           2HE      MET  86  -2.110 -10.594   4.834
  670    H    GLU  87           H        GLU  87  -0.182 -12.154  -0.393
  671    HA   GLU  87           HA       GLU  87  -1.418 -14.574   0.569
  672    HB2  GLU  87           1HB      GLU  87  -2.246 -12.889  -1.800
  673    HB3  GLU  87           2HB      GLU  87  -3.238 -14.037  -0.906
  674    HG2  GLU  87           1HG      GLU  87  -2.823 -12.542   1.123
  675    HG3  GLU  87           2HG      GLU  87  -2.249 -11.345  -0.034
  676    H    ASP  88           H        ASP  88  -1.589 -16.501  -0.475
  677    HA   ASP  88           HA       ASP  88  -0.700 -18.278  -1.552
  678    HB2  ASP  88           1HB      ASP  88  -0.821 -16.308  -3.840
  679    HB3  ASP  88           2HB      ASP  88  -0.368 -17.996  -4.055
  680    H    LYS  89           H        LYS  89   1.108 -17.736  -0.048
  681    HA   LYS  89           HA       LYS  89   3.595 -17.288  -1.562
  682    HB2  LYS  89           1HB      LYS  89   3.099 -15.271  -0.308
  683    HB3  LYS  89           2HB      LYS  89   2.839 -16.198   1.158
  684    HG2  LYS  89           1HG      LYS  89   5.179 -16.758   1.274
  685    HG3  LYS  89           2HG      LYS  89   5.475 -15.970  -0.278
  686    HD2  LYS  89           1HD      LYS  89   5.245 -13.853   0.603
  687    HD3  LYS  89           2HD      LYS  89   4.237 -14.406   1.942
  688    HE2  LYS  89           1HE      LYS  89   7.157 -15.093   1.669
  689    HE3  LYS  89           2HE      LYS  89   6.569 -13.689   2.563
  690    HZ1  LYS  89           3HZ      LYS  89   6.961 -15.611   4.005
  691    HZ2  LYS  89           1HZ      LYS  89   5.818 -16.510   3.136
  692    HZ3  LYS  89           2HZ      LYS  89   5.336 -15.145   4.017
  693    H    ALA  90           H        ALA  90   1.846 -19.509  -0.065
  694    HA   ALA  90           HA       ALA  90   3.812 -20.682   1.700
  695    HB1  ALA  90           3HB      ALA  90   1.421 -20.881   2.184
  696    HB2  ALA  90           1HB      ALA  90   2.170 -22.466   1.990
  697    HB3  ALA  90           2HB      ALA  90   1.192 -21.787   0.688
  698    H    GLU  91           H        GLU  91   4.922 -20.302  -0.750
  699    HA   GLU  91           HA       GLU  91   6.195 -21.281  -2.324
  700    HB2  GLU  91           1HB      GLU  91   5.408 -23.849  -0.944
  701    HB3  GLU  91           2HB      GLU  91   6.576 -23.749  -2.255
  702    HG2  GLU  91           1HG      GLU  91   6.803 -22.450   0.451
  703    HG3  GLU  91           2HG      GLU  91   7.718 -23.839  -0.135
  704    H    ALA  92           H        ALA  92   5.786 -21.471  -4.394
  705    HA   ALA  92           HA       ALA  92   3.126 -22.447  -5.172
  706    HB1  ALA  92           3HB      ALA  92   3.509 -20.072  -5.606
  707    HB2  ALA  92           1HB      ALA  92   3.305 -20.975  -7.107
  708    HB3  ALA  92           2HB      ALA  92   4.915 -20.477  -6.590
  709    HA   PRO  93           HA       PRO  93   5.651 -25.562  -7.266
  710    HB2  PRO  93           1HB      PRO  93   3.779 -27.489  -7.281
  711    HB3  PRO  93           2HB      PRO  93   4.704 -27.098  -5.826
  712    HG2  PRO  93           1HG      PRO  93   1.908 -26.355  -6.552
  713    HG3  PRO  93           2HG      PRO  93   2.578 -26.794  -4.973
  714    HD2  PRO  93           1HD      PRO  93   2.086 -24.204  -5.838
  715    HD3  PRO  93           2HD      PRO  93   3.183 -24.650  -4.518
  716    H    ASN  94           H        ASN  94   2.565 -24.203  -8.066
  717    HA   ASN  94           HA       ASN  94   3.023 -24.775 -10.910
  718    HB2  ASN  94           1HB      ASN  94   0.645 -25.491  -9.273
  719    HB3  ASN  94           2HB      ASN  94   0.323 -24.808 -10.860
  720   HD21  ASN  94          2HD2      ASN  94   3.191 -26.707 -10.325
  721   HD22  ASN  94          1HD2      ASN  94   2.654 -28.112 -11.187
  722    H    THR  95           H        THR  95   2.369 -23.132 -12.303
  723    HA   THR  95           HA       THR  95   1.661 -20.602 -10.981
  724    HB   THR  95           HB       THR  95   2.335 -19.550 -13.146
  725    HG1  THR  95           HG1      THR  95   3.789 -21.644 -14.068
  726   HG21  THR  95          3HG2      THR  95   4.747 -19.889 -12.848
  727   HG22  THR  95          1HG2      THR  95   4.421 -21.301 -11.842
  728   HG23  THR  95          2HG2      THR  95   3.923 -19.697 -11.299
  729    H    ILE  96           H        ILE  96   0.285 -19.124 -12.509
  730    HA   ILE  96           HA       ILE  96  -2.217 -20.436 -12.884
  731    HB   ILE  96           HB       ILE  96  -3.014 -18.291 -13.802
  732   HG12  ILE  96          1HG1      ILE  96  -0.157 -17.366 -13.415
  733   HG13  ILE  96          2HG1      ILE  96  -0.928 -17.643 -14.972
  734   HG21  ILE  96          1HG2      ILE  96  -2.664 -16.958 -11.768
  735   HG22  ILE  96          2HG2      ILE  96  -1.372 -18.057 -11.285
  736   HG23  ILE  96          3HG2      ILE  96  -3.031 -18.645 -11.406
  737   HD11  ILE  96          3HD1      ILE  96  -1.726 -15.574 -12.937
  738   HD12  ILE  96          1HD1      ILE  96  -2.534 -15.862 -14.478
  739   HD13  ILE  96          2HD1      ILE  96  -0.868 -15.284 -14.451
  740    H    ALA  97           H        ALA  97   0.517 -20.211 -14.824
  741    HA   ALA  97           HA       ALA  97  -0.776 -20.191 -17.386
  742    HB1  ALA  97           3HB      ALA  97   2.061 -20.892 -16.644
  743    HB2  ALA  97           1HB      ALA  97   1.476 -19.293 -17.104
  744    HB3  ALA  97           2HB      ALA  97   1.457 -20.609 -18.278
  745    H    SER  98           H        SER  98  -0.307 -22.562 -15.016
  746    HA   SER  98           HA       SER  98  -0.188 -24.777 -16.872
  747    HB2  SER  98           1HB      SER  98  -0.351 -26.200 -14.845
  748    HB3  SER  98           2HB      SER  98   0.954 -25.023 -14.730
  749    HG   SER  98           HG       SER  98  -0.327 -23.776 -13.367
  750    H    GLY  99           H        GLY  99  -1.945 -25.135 -18.044
  751    HA2  GLY  99           1HA      GLY  99  -4.560 -25.060 -16.669
  752    HA3  GLY  99           2HA      GLY  99  -4.339 -24.425 -18.294
  753    H    SER 100           H        SER 100  -2.451 -27.145 -17.763
  754    HA   SER 100           HA       SER 100  -4.542 -28.996 -18.620
  755    HB2  SER 100           1HB      SER 100  -2.843 -29.955 -20.284
  756    HB3  SER 100           2HB      SER 100  -3.603 -28.425 -20.721
  757    HG   SER 100           HG       SER 100  -0.969 -29.006 -20.133